A0A087XQ31_POEFO Loading...

Scaffold attachment factor B

AlphaFold DB , UniProt , Accession A0A087XQ31, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 753 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.1	Very low	45.4	Very low	239 Å²	239	123.9 Å²	123.9	100%	1.177	75%	0.748	S	S	*	*				0	102.6	0	-64.3	169.8	-178.3	0	0	105.1
2	A	38.5	Very low	45.7	Very low	92 Å²	92	130.8 Å²	130.8	76%	0.76	77%	0.767	S	S	*	*				91.7	93.2	66	0	0	0	0	0	110
3	N	44	Very low	46.7	Very low	161 Å²	161	125 Å²	125	86%	0.861	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-74.6	143.8	167.5	-56.1	-11.7	0	0	0	108.8
4	P	52.8	Low	47.9	Very low	123 Å²	123	117.5 Å²	117.5	80%	0.799	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-100.3	123.6	144.3	32	-23.9	0	0	0	108.6
5	S	45.7	Very low	49.7	Very low	91 Å²	91	116.2 Å²	116.2	64%	0.636	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-72.1	138.1	169.4	53.8	0	0	0	0	110.3	D7	S5-D7 WeakPolarHBondContact CB-OD2 3.03Å; S5-D7 PolarHBondContact OG-OD2 2.93Å
6	G	37.3	Very low	51.5	Low	73 Å²	73	113.6 Å²	113.6	75%	0.753	68%	0.678	S	S	*	*			trans	-103	63.7	163	0	0	0	0	0	108.5	V8	G6-V8 PolarHBondContact O-N 3.21Å
7	D	40.5	Very low	53.3	Low	133 Å²	133	111.3 Å²	111.3	71%	0.711	65%	0.654	S	S	*	*			trans	-66.1	97	176.9	-66.2	-59.3	0	0	0	108.8	S5 D9	S5-D7 WeakPolarHBondContact CB-OD2 3.03Å; S5-D7 PolarHBondContact OG-OD2 2.93Å; D7-D9 PolarHBondContact O-N 2.72Å
8	V	48.3	Very low	55.1	Low	129 Å²	129	110.6 Å²	110.6	78%	0.782	64%	0.642	S	S	*	*			trans	-75.7	103.7	170.6	179.7	0	0	0	0	106.8	G6 M10	G6-V8 PolarHBondContact O-N 3.21Å; V8-M10 PolarHBondContact O-N 2.83Å
9	D	46.2	Very low	56.7	Low	158 Å²	158	105.4 Å²	105.4	85%	0.845	61%	0.611	S	S	*	*			trans	-50.2	99.4	175.4	-99.5	-38.4	0	0	0	110.5	D7 P11	D7-D9 PolarHBondContact O-N 2.72Å; D9-P11 WeakPolarHBondContact O-CD 3.37Å
10	M	48.6	Very low	58.2	Low	100 Å²	100	104.2 Å²	104.2	49%	0.493	61%	0.609	S	S	.	*			trans	-75.1	116	170.3	-79.1	-166.3	62.5	0	0	107.7	V8 E12 A14 V16 V64	V8-M10 PolarHBondContact O-N 2.83Å; M10-E12 PolarHBondContact O-N 2.74Å; M10-A14 HydrophobicContact CE-CB 3.94Å; M10-V16 HydrophobicContact CE-CG2 4.25Å; M10-V64 HydrophobicContact CE-CG1 3.8Å; M10-V64 HydrophobicContact CE-CG2 4.27Å
11	P	55.4	Low	59.7	Low	64 Å²	64	104.3 Å²	104.3	42%	0.416	60%	0.604	S	S	.	*			trans	-62.9	136.5	-175	24.2	-32.4	0	0	0	110.5	D9 G13 A14 I66	D9-P11 WeakPolarHBondContact O-CD 3.37Å; P11-G13 PolarHBondContact O-N 3.4Å; P11-G13 VanDerWaalsContact O-N 3.11Å; P11-A14 HydrophobicContact CG-CB 4.28Å; P11-A14 VanDerWaalsContact O-CB 3.29Å; P11-A14 WeakPolarHBondContact O-CB 3.45Å; P11-A14 PolarHBondContact O-N 3.29Å; P11-I66 HydrophobicContact CG-CD1 3.73Å; P11-I66 HydrophobicContact CG-CG1 3.84Å; P11-I66 HydrophobicContact CG-CG2 4.13Å
12	E	48.7	Very low	61.9	Low	207 Å²	207	93 Å²	93	97%	0.967	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	115	-170.3	-166.9	177.3	-171.1	0	0	111.7	M10	M10-E12 PolarHBondContact O-N 2.74Å
13	G	59.2	Low	64.5	Low	55 Å²	55	95.7 Å²	95.7	57%	0.567	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.3	4.3	-174.9	0	0	0	0	0	116	P11 E15 P67	P11-G13 PolarHBondContact O-N 3.4Å; P11-G13 VanDerWaalsContact O-N 3.11Å; G13-E15 PolarHBondContact O-N 2.9Å; G13-P67 WeakPolarHBondContact O-CD 3.44Å
14	A	63.2	Low	66.8	Low	20 Å²	20	90.9 Å²	90.9	17%	0.165	52%	0.515	C	S	.	.			trans	-70	121.7	171.8	0	0	0	0	0	112.1	M10 P11 V64 L65 I66	M10-A14 HydrophobicContact CE-CB 3.94Å; P11-A14 HydrophobicContact CG-CB 4.28Å; P11-A14 VanDerWaalsContact O-CB 3.29Å; P11-A14 WeakPolarHBondContact O-CB 3.45Å; P11-A14 PolarHBondContact O-N 3.29Å; A14-V64 HydrophobicContact CB-CG1 3.83Å; A14-L65 WeakPolarHBondContact CA-O 3.36Å; A14-I66 HydrophobicContact CB-CG1 4.22Å
15	E	74.7	Confident	68.7	Low	98 Å²	98	91 Å²	91	46%	0.458	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.1	-173.1	-165.7	-176.3	147.9	0	0	111.3	G13 R17 L65	G13-E15 PolarHBondContact O-N 2.9Å; E15-R17 VanDerWaalsContact CD-NE 3.31Å; E15-R17 HydrophobicContact CG-CG 4.31Å; E15-R17 IonicContact OE1-CZ 2.61Å; E15-R17 IonicContact OE1-NE 2.68Å; E15-R17 PolarHBondContact OE1-NE 3.32Å; E15-R17 IonicContact OE1-NH2 3.52Å; E15-R17 PolarHBondContact OE1-NH2 2.87Å; E15-R17 IonicContact OE2-CZ 3.98Å; E15-R17 VanDerWaalsContact OE2-CZ 3.26Å; E15-R17 IonicContact OE2-NE 2.88Å; E15-R17 IonicContact OE2-NH2 3.2Å; E15-R17 PolarHBondContact OE2-NH2 3.22Å; E15-L65 PolarHBondContact N-O 2.8Å; E15-L65 WeakPolarHBondContact O-CB 3.34Å; E15-L65 PolarHBondContact O-N 2.71Å
16	V	78.4	Confident	71	Confident	75 Å²	75	87.6 Å²	87.6	46%	0.455	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.4	176.5	-173	0	0	0	0	109.7	M10 Q62 I63 V64	M10-V16 HydrophobicContact CE-CG2 4.25Å; V16-Q62 HydrophobicContact CG1-CB 4.09Å; V16-I63 CarbonylContact C-O 3.51Å; V16-I63 WeakPolarHBondContact CA-O 3.42Å; V16-V64 HydrophobicContact CG2-CG2 4.31Å
17	R	82.1	Confident	73.6	Confident	74 Å²	74	84.1 Å²	84.1	28%	0.279	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	155.2	178.7	-66.4	-167.6	-179.3	134.1	-4.2	112.7	E15 L22 I63 L65	E15-R17 VanDerWaalsContact CD-NE 3.31Å; E15-R17 HydrophobicContact CG-CG 4.31Å; E15-R17 IonicContact OE1-CZ 2.61Å; E15-R17 IonicContact OE1-NE 2.68Å; E15-R17 PolarHBondContact OE1-NE 3.32Å; E15-R17 IonicContact OE1-NH2 3.52Å; E15-R17 PolarHBondContact OE1-NH2 2.87Å; E15-R17 IonicContact OE2-CZ 3.98Å; E15-R17 VanDerWaalsContact OE2-CZ 3.26Å; E15-R17 IonicContact OE2-NE 2.88Å; E15-R17 IonicContact OE2-NH2 3.2Å; E15-R17 PolarHBondContact OE2-NH2 3.22Å; R17-L22 HydrophobicContact CB-CD2 3.93Å; R17-I63 PolarHBondContact N-O 3.03Å; R17-I63 WeakPolarHBondContact O-CB 3.44Å; R17-I63 PolarHBondContact O-N 2.88Å; R17-L65 HydrophobicContact CG-CD1 4.34Å; R17-L65 VanDerWaalsContact NH1-CD1 3.32Å
18	K	86.6	Confident	76.1	Confident	98 Å²	98	81.3 Å²	81.3	43%	0.426	43%	0.428	S	S	.	.			trans	-80.7	149	174.7	-62.8	170.4	-174.6	160.2	0	111.4	S20 E21 L22 D61	K18-S20 PolarHBondContact O-N 3.05Å; K18-S20 VanDerWaalsContact O-N 3.1Å; K18-E21 HydrophobicContact CB-CG 4.26Å; K18-E21 PolarHBondContact N-OE2 3.34Å; K18-E21 WeakPolarHBondContact O-CB 3.34Å; K18-E21 PolarHBondContact O-N 3.49Å; K18-L22 PolarHBondContact O-N 3.14Å; K18-D61 HydrophobicContact CG-CB 4.06Å; K18-D61 VanDerWaalsContact CG-O 3.25Å; K18-D61 WeakPolarHBondContact CG-O 3.14Å
19	L	86.1	Confident	78.2	Confident	12 Å²	12	77 Å²	77	6%	0.063	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-35.9	172.3	-86.8	167.6	0	0	0	114.2	E21 L27 L49 K50 I53 P60 I63	L19-E21 VanDerWaalsContact C-N 3.34Å; L19-L27 HydrophobicContact CD2-CD2 3.98Å; L19-L49 HydrophobicContact CD2-CB 3.96Å; L19-L49 HydrophobicContact CD2-CD2 3.73Å; L19-L49 HydrophobicContact CD2-CG 3.85Å; L19-K50 HydrophobicContact CD1-CB 3.57Å; L19-K50 HydrophobicContact CD1-CG 3.98Å; L19-I53 HydrophobicContact CD2-CD1 4.43Å; L19-P60 HydrophobicContact CD1-CB 3.7Å; L19-P60 WeakPolarHBondContact CD1-O 3.25Å; L19-P60 WeakPolarHBondContact CG-O 3.22Å; L19-I63 HydrophobicContact CD2-CD1 3.49Å; L19-I63 VanDerWaalsContact CD2-CD1 3.49Å; L19-I63 HydrophobicContact CG-CD1 3.59Å
20	S	86.2	Confident	80.3	Confident	81 Å²	81	70.1 Å²	70.1	57%	0.566	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-35.7	179.2	53.9	0	0	0	0	112.4	K18 K42	K18-S20 PolarHBondContact O-N 3.05Å; K18-S20 VanDerWaalsContact O-N 3.1Å; S20-K42 PolarHBondContact O-NZ 3.07Å
21	E	88.8	Confident	82.4	Confident	108 Å²	108	65.3 Å²	65.3	51%	0.505	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-29.5	-178.8	-66.1	157.1	178.5	0	0	112	K18 L19 R23	K18-E21 HydrophobicContact CB-CG 4.26Å; K18-E21 PolarHBondContact N-OE2 3.34Å; K18-E21 WeakPolarHBondContact O-CB 3.34Å; K18-E21 PolarHBondContact O-N 3.49Å; L19-E21 VanDerWaalsContact C-N 3.34Å; E21-R23 PolarHBondContact O-N 2.97Å
22	L	89.7	Confident	84.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.357	C	S	.	.			trans	-56.3	134.3	177.9	-62	-166.2	0	0	0	112.6	R17 K18 D26 L27 K42 L49 I63 L65	R17-L22 HydrophobicContact CB-CD2 3.93Å; K18-L22 PolarHBondContact O-N 3.14Å; L22-D26 HydrophobicContact CB-CB 4.37Å; L22-D26 HydrophobicContact CD2-CB 4.29Å; L22-L27 HydrophobicContact CB-CD2 3.73Å; L22-L27 HydrophobicContact CB-CG 3.78Å; L22-L27 HydrophobicContact CD1-CD2 3.8Å; L22-L27 HydrophobicContact CG-CD2 4.35Å; L22-K42 VanDerWaalsContact O-CE 3.22Å; L22-K42 WeakPolarHBondContact O-CE 3.37Å; L22-K42 PolarHBondContact O-NZ 3.48Å; L22-L49 HydrophobicContact CD1-CD2 4.17Å; L22-I63 HydrophobicContact CD1-CD1 3.54Å; L22-I63 HydrophobicContact CD1-CG2 4.47Å; L22-L65 HydrophobicContact CD2-CD1 3.62Å; L22-L65 HydrophobicContact CD2-CD2 4.11Å; L22-L65 HydrophobicContact CD2-CG 4.07Å
23	R	92	Very high	86.1	Confident	150 Å²	150	64.2 Å²	64.2	57%	0.566	33%	0.33	S	S	*	.			trans	-83	166.3	174.2	-50.6	164.8	-62.2	179.5	5.5	109.2	E21 I25 D26 L27	E21-R23 PolarHBondContact O-N 2.97Å; R23-I25 PolarHBondContact O-N 3.11Å; R23-I25 VanDerWaalsContact O-N 3.11Å; R23-D26 WeakPolarHBondContact CA-OD2 3.29Å; R23-D26 WeakPolarHBondContact CB-OD2 3.35Å; R23-D26 WeakPolarHBondContact CG-OD2 3.17Å; R23-D26 IonicContact CZ-OD1 2.74Å; R23-D26 IonicContact CZ-OD2 3.34Å; R23-D26 PolarHBondContact N-OD2 2.93Å; R23-D26 IonicContact NE-OD1 3.67Å; R23-D26 PolarHBondContact NE-OD1 2.61Å; R23-D26 IonicContact NE-OD2 3.3Å; R23-D26 PolarHBondContact NE-OD2 2.84Å; R23-D26 IonicContact NH2-OD1 3.82Å; R23-D26 PolarHBondContact NH2-OD1 3.43Å; R23-D26 IonicContact NH2-OD2 3.05Å; R23-D26 PolarHBondContact O-N 3.46Å; R23-L27 WeakPolarHBondContact O-CG 3.26Å; R23-L27 PolarHBondContact O-N 3.38Å
24	V	92.2	Very high	87.4	Confident	60 Å²	60	64.8 Å²	64.8	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-59.4	-25.8	178.8	176.1	0	0	0	0	112.9	K28 K42 L45	V24-K28 HydrophobicContact CG1-CD 4.12Å; V24-K28 WeakPolarHBondContact O-CB 3.3Å; V24-K28 WeakPolarHBondContact O-CD 3.42Å; V24-K28 WeakPolarHBondContact O-CG 3.48Å; V24-K28 PolarHBondContact O-N 2.9Å; V24-K42 HydrophobicContact CG2-CB 3.74Å; V24-K42 HydrophobicContact CG2-CD 4.42Å; V24-K42 HydrophobicContact CG2-CG 4.08Å; V24-L45 HydrophobicContact CG1-CD1 3.97Å
25	I	93.5	Very high	88.6	Confident	125 Å²	125	71.1 Å²	71.1	64%	0.641	35%	0.346	S	S	*	.	H	α-helix	trans	-68.9	-51.2	173.3	-58.6	173.2	0	0	0	109.9	R23 K28 A29	R23-I25 PolarHBondContact O-N 3.11Å; R23-I25 VanDerWaalsContact O-N 3.11Å; I25-K28 PolarHBondContact O-N 3.11Å; I25-A29 PolarHBondContact O-N 3.29Å
26	D	92.6	Very high	89.3	Confident	20 Å²	20	69.8 Å²	69.8	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-66.8	-43.7	-175.5	-36	-45.2	0	0	0	110.5	L22 R23 K28 A29 E30	L22-D26 HydrophobicContact CB-CB 4.37Å; L22-D26 HydrophobicContact CD2-CB 4.29Å; R23-D26 WeakPolarHBondContact CA-OD2 3.29Å; R23-D26 WeakPolarHBondContact CB-OD2 3.35Å; R23-D26 WeakPolarHBondContact CG-OD2 3.17Å; R23-D26 IonicContact CZ-OD1 2.74Å; R23-D26 IonicContact CZ-OD2 3.34Å; R23-D26 PolarHBondContact N-OD2 2.93Å; R23-D26 IonicContact NE-OD1 3.67Å; R23-D26 PolarHBondContact NE-OD1 2.61Å; R23-D26 IonicContact NE-OD2 3.3Å; R23-D26 PolarHBondContact NE-OD2 2.84Å; R23-D26 IonicContact NH2-OD1 3.82Å; R23-D26 PolarHBondContact NH2-OD1 3.43Å; R23-D26 IonicContact NH2-OD2 3.05Å; R23-D26 PolarHBondContact O-N 3.46Å; D26-K28 VanDerWaalsContact C-N 3.31Å; D26-K28 PolarHBondContact O-N 3Å; D26-A29 WeakPolarHBondContact O-CB 3.24Å; D26-A29 PolarHBondContact O-N 3Å; D26-A29 VanDerWaalsContact O-N 3.14Å; D26-E30 PolarHBondContact O-N 3.34Å
27	L	92.6	Very high	89.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-56.4	-41.4	171.3	-71	173.4	0	0	0	112.7	L19 L22 R23 L31 K42 L45 L49	L19-L27 HydrophobicContact CD2-CD2 3.98Å; L22-L27 HydrophobicContact CB-CD2 3.73Å; L22-L27 HydrophobicContact CB-CG 3.78Å; L22-L27 HydrophobicContact CD1-CD2 3.8Å; L22-L27 HydrophobicContact CG-CD2 4.35Å; R23-L27 WeakPolarHBondContact O-CG 3.26Å; R23-L27 PolarHBondContact O-N 3.38Å; L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 WeakPolarHBondContact O-CD1 3.18Å; L27-L31 VanDerWaalsContact O-CG 3.24Å; L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 2.81Å; L27-K42 HydrophobicContact CD1-CD 4.28Å; L27-K42 HydrophobicContact CD1-CG 3.68Å; L27-L45 HydrophobicContact CB-CB 4.43Å; L27-L45 HydrophobicContact CD1-CB 4.35Å; L27-L49 HydrophobicContact CD2-CD2 3.69Å
28	K	93.1	Very high	90.5	Very high	74 Å²	74	69.6 Å²	69.6	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-73.7	-30.2	177.9	-74.9	176	-177.9	-112.6	0	112.4	V24 I25 D26 K32 T38 L45	V24-K28 HydrophobicContact CG1-CD 4.12Å; V24-K28 WeakPolarHBondContact O-CB 3.3Å; V24-K28 WeakPolarHBondContact O-CD 3.42Å; V24-K28 WeakPolarHBondContact O-CG 3.48Å; V24-K28 PolarHBondContact O-N 2.9Å; I25-K28 PolarHBondContact O-N 3.11Å; D26-K28 VanDerWaalsContact C-N 3.31Å; D26-K28 PolarHBondContact O-N 3Å; K28-K32 WeakPolarHBondContact O-CB 3.18Å; K28-K32 PolarHBondContact O-N 3.33Å; K28-T38 HydrophobicContact CB-CG2 4.32Å; K28-T38 WeakPolarHBondContact CE-O 3.46Å; K28-T38 PolarHBondContact NZ-O 3.11Å; K28-L45 HydrophobicContact CG-CD1 4.08Å
29	A	91.9	Very high	90.7	Very high	39 Å²	39	68.7 Å²	68.7	32%	0.322	35%	0.349	S	S	.	.	H	α-helix	trans	-65.5	-49.2	173	0	0	0	0	0	110.4	I25 D26 K32 K33	I25-A29 PolarHBondContact O-N 3.29Å; D26-A29 WeakPolarHBondContact O-CB 3.24Å; D26-A29 PolarHBondContact O-N 3Å; D26-A29 VanDerWaalsContact O-N 3.14Å; A29-K32 PolarHBondContact O-N 3.36Å; A29-K33 WeakPolarHBondContact O-CG 3.44Å; A29-K33 PolarHBondContact O-N 3.43Å
30	E	90.1	Very high	91	Very high	12 Å²	12	70.4 Å²	70.4	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-66.4	-42.1	178.4	-70.5	-54.6	130.9	0	0	113.4	D26 K32 K33 R34 L49 I63 L65	D26-E30 PolarHBondContact O-N 3.34Å; E30-K32 VanDerWaalsContact C-N 3.28Å; E30-K32 PolarHBondContact O-N 2.68Å; E30-K33 PolarHBondContact O-N 3.22Å; E30-K33 WeakPolarHBondContact OE1-CD 2.73Å; E30-K33 WeakPolarHBondContact OE1-CE 3.5Å; E30-K33 IonicContact OE1-NZ 2.79Å; E30-K33 PolarHBondContact OE1-NZ 2.88Å; E30-R34 PolarHBondContact O-N 2.91Å; E30-R34 VanDerWaalsContact O-N 3.09Å; E30-R34 IonicContact OE2-NH1 3.29Å; E30-R34 PolarHBondContact OE2-NH1 3.22Å; E30-L49 HydrophobicContact CB-CD1 3.88Å; E30-L49 HydrophobicContact CB-CD2 3.62Å; E30-L49 HydrophobicContact CB-CG 4.43Å; E30-L49 HydrophobicContact CG-CD2 4.43Å; E30-I63 HydrophobicContact CG-CG2 4.32Å; E30-L65 HydrophobicContact CG-CD2 3.76Å
31	L	92.4	Very high	91.3	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-59.1	-40.8	170.5	-75.6	167.5	0	0	0	111.5	L27 R34 N35 L36 T38 L45 R48 L49	L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 WeakPolarHBondContact O-CD1 3.18Å; L27-L31 VanDerWaalsContact O-CG 3.24Å; L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 2.81Å; L31-R34 CarbonylContact O-C 3.53Å; L31-R34 PolarHBondContact O-N 2.96Å; L31-N35 PolarHBondContact O-N 2.96Å; L31-N35 VanDerWaalsContact O-N 3.11Å; L31-L36 HydrophobicContact CB-CB 4.33Å; L31-L36 HydrophobicContact CD2-CB 3.71Å; L31-L36 HydrophobicContact CD2-CD1 4.03Å; L31-L36 PolarHBondContact O-N 2.63Å; L31-T38 HydrophobicContact CB-CG2 4.11Å; L31-L45 HydrophobicContact CD1-CB 3.87Å; L31-L45 HydrophobicContact CD1-CD2 3.57Å; L31-L45 HydrophobicContact CD1-CG 4.31Å; L31-R48 HydrophobicContact CD2-CB 3.86Å; L31-L49 HydrophobicContact CD2-CB 3.87Å; L31-L49 HydrophobicContact CD2-CD1 4.18Å; L31-L49 HydrophobicContact CG-CB 4.1Å; L31-L49 HydrophobicContact CG-CD1 4.3Å
32	K	93.1	Very high	91.5	Very high	154 Å²	154	70 Å²	70	67%	0.67	36%	0.364	S	S	*	.	H	α-helix	trans	-68.1	-38.6	177.7	-171.6	-170.4	174.2	-158	0	112.2	K28 A29 E30 R34 N35 T38	K28-K32 WeakPolarHBondContact O-CB 3.18Å; K28-K32 PolarHBondContact O-N 3.33Å; A29-K32 PolarHBondContact O-N 3.36Å; E30-K32 VanDerWaalsContact C-N 3.28Å; E30-K32 PolarHBondContact O-N 2.68Å; K32-R34 PolarHBondContact O-N 3.04Å; K32-N35 PolarHBondContact O-N 3.1Å; K32-T38 HydrophobicContact CB-CG2 4.16Å
33	K	89.1	Confident	91.6	Very high	93 Å²	93	72.6 Å²	72.6	40%	0.404	38%	0.382	S	S	.	.	H	α-helix	trans	-57.3	-40.8	172.4	-73.1	176.5	-175.7	173.1	0	110.9	A29 E30 N35 I66	A29-K33 WeakPolarHBondContact O-CG 3.44Å; A29-K33 PolarHBondContact O-N 3.43Å; E30-K33 PolarHBondContact O-N 3.22Å; E30-K33 WeakPolarHBondContact OE1-CD 2.73Å; E30-K33 WeakPolarHBondContact OE1-CE 3.5Å; E30-K33 IonicContact OE1-NZ 2.79Å; E30-K33 PolarHBondContact OE1-NZ 2.88Å; K33-N35 VanDerWaalsContact C-N 3.28Å; K33-N35 PolarHBondContact O-N 2.72Å; K33-I66 PolarHBondContact NZ-O 2.91Å
34	R	86.6	Confident	91.7	Very high	67 Å²	67	67.8 Å²	67.8	25%	0.253	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	5	175.4	-68.4	177.5	165.9	91.6	-1.3	114.8	E30 L31 K32 L36 E56	E30-R34 PolarHBondContact O-N 2.91Å; E30-R34 VanDerWaalsContact O-N 3.09Å; E30-R34 IonicContact OE2-NH1 3.29Å; E30-R34 PolarHBondContact OE2-NH1 3.22Å; L31-R34 CarbonylContact O-C 3.53Å; L31-R34 PolarHBondContact O-N 2.96Å; K32-R34 PolarHBondContact O-N 3.04Å; R34-L36 HydrophobicContact CB-CD1 3.86Å; R34-L36 HydrophobicContact CB-CG 4.13Å; R34-L36 PolarHBondContact O-N 2.94Å; R34-E56 VanDerWaalsContact CD-OE1 3.24Å; R34-E56 WeakPolarHBondContact CD-OE1 3.4Å; R34-E56 IonicContact CZ-OE1 3.81Å; R34-E56 IonicContact CZ-OE2 3.42Å; R34-E56 IonicContact NE-OE1 3.8Å; R34-E56 PolarHBondContact NE-OE1 3.23Å; R34-E56 IonicContact NE-OE2 3.51Å; R34-E56 PolarHBondContact NE-OE2 2.86Å; R34-E56 IonicContact NH2-OE2 2.67Å; R34-E56 PolarHBondContact NH2-OE2 3.14Å
35	N	88.8	Confident	91.8	Very high	153 Å²	153	64.9 Å²	64.9	82%	0.818	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.3	-176.4	-58.3	-72.8	0	0	0	115.1	L31 K32 K33	L31-N35 PolarHBondContact O-N 2.96Å; L31-N35 VanDerWaalsContact O-N 3.11Å; K32-N35 PolarHBondContact O-N 3.1Å; K33-N35 VanDerWaalsContact C-N 3.28Å; K33-N35 PolarHBondContact O-N 2.72Å
36	L	89.6	Confident	91.7	Very high	71 Å²	71	60.2 Å²	60.2	37%	0.372	33%	0.331	S	S	.	.			trans	-99.2	161.9	-178.2	-68	169.6	0	0	0	113.4	L31 R34 T38 A52	L31-L36 HydrophobicContact CB-CB 4.33Å; L31-L36 HydrophobicContact CD2-CB 3.71Å; L31-L36 HydrophobicContact CD2-CD1 4.03Å; L31-L36 PolarHBondContact O-N 2.63Å; R34-L36 HydrophobicContact CB-CD1 3.86Å; R34-L36 HydrophobicContact CB-CG 4.13Å; R34-L36 PolarHBondContact O-N 2.94Å; L36-T38 PolarHBondContact O-N 2.75Å; L36-A52 HydrophobicContact CD1-CB 3.32Å
37	D	91.4	Very high	91.8	Very high	96 Å²	96	64.9 Å²	64.9	51%	0.513	35%	0.352	S	S	.	.			trans	-65.2	112.4	-170.7	-139.2	-21	0	0	0	112.4	T39 R48	D37-T39 PolarHBondContact O-N 3.28Å; D37-T39 PolarHBondContact OD1-OG1 3.42Å; D37-R48 PolarHBondContact O-NH1 3.03Å
38	T	93.8	Very high	91.8	Very high	49 Å²	49	68.5 Å²	68.5	30%	0.301	37%	0.365	S	S	.	.			trans	-86	11.3	-176.8	62.4	0	0	0	0	113.4	K28 L31 K32 L36 L45	K28-T38 HydrophobicContact CB-CG2 4.32Å; K28-T38 WeakPolarHBondContact CE-O 3.46Å; K28-T38 PolarHBondContact NZ-O 3.11Å; L31-T38 HydrophobicContact CB-CG2 4.11Å; K32-T38 HydrophobicContact CB-CG2 4.16Å; L36-T38 PolarHBondContact O-N 2.75Å; T38-L45 VanDerWaalsContact C-CD2 3.5Å
39	T	91.9	Very high	91.7	Very high	79 Å²	79	65 Å²	65	49%	0.485	35%	0.35	S	S	.	.			trans	-98.2	117.1	-171.5	54.2	0	0	0	0	112.3	D37 R48	D37-T39 PolarHBondContact O-N 3.28Å; D37-T39 PolarHBondContact OD1-OG1 3.42Å; T39-R48 PolarHBondContact O-NH1 2.7Å; T39-R48 PolarHBondContact O-NH2 2.99Å
40	G	91.3	Very high	91.7	Very high	48 Å²	48	67.4 Å²	67.4	50%	0.495	35%	0.353	S	S	.	.	S	Bend	trans	150.3	-174.2	177	0	0	0	0	0	116
41	V	92.1	Very high	91.7	Very high	105 Å²	105	74.9 Å²	74.9	64%	0.636	38%	0.381	S	S	*	.			trans	-80.8	159.9	172.3	-178.5	0	0	0	0	109.6	S43 V44 L45	V41-S43 VanDerWaalsContact C-N 3.28Å; V41-S43 PolarHBondContact O-N 2.95Å; V41-V44 PolarHBondContact O-N 3.29Å; V41-L45 WeakPolarHBondContact O-CG 3.34Å; V41-L45 PolarHBondContact O-N 2.86Å; V41-L45 VanDerWaalsContact O-N 3.14Å
42	K	93.4	Very high	91.5	Very high	75 Å²	75	75.4 Å²	75.4	33%	0.326	39%	0.385	S	S	.	.	H	α-helix	trans	-48.2	-47.6	-177.9	-178	173.8	166.8	171.1	0	112.5	S20 L22 V24 L27 L45 S46	S20-K42 PolarHBondContact O-NZ 3.07Å; L22-K42 VanDerWaalsContact O-CE 3.22Å; L22-K42 WeakPolarHBondContact O-CE 3.37Å; L22-K42 PolarHBondContact O-NZ 3.48Å; V24-K42 HydrophobicContact CG2-CB 3.74Å; V24-K42 HydrophobicContact CG2-CD 4.42Å; V24-K42 HydrophobicContact CG2-CG 4.08Å; L27-K42 HydrophobicContact CD1-CD 4.28Å; L27-K42 HydrophobicContact CD1-CG 3.68Å; K42-L45 PolarHBondContact O-N 3.4Å; K42-S46 PolarHBondContact O-N 2.76Å; K42-S46 PolarHBondContact O-OG 2.79Å
43	S	92.8	Very high	91.3	Very high	54 Å²	54	68.4 Å²	68.4	38%	0.378	36%	0.355	S	S	.	.	H	α-helix	trans	-53.8	-56	-179.5	50.9	0	0	0	0	112.2	V41 L45 S46 E47	V41-S43 VanDerWaalsContact C-N 3.28Å; V41-S43 PolarHBondContact O-N 2.95Å; S43-L45 PolarHBondContact O-N 3.09Å; S43-S46 WeakPolarHBondContact CA-OG 3.43Å; S43-S46 CarbonylContact O-C 3.59Å; S43-S46 PolarHBondContact O-N 3.4Å; S43-S46 VanDerWaalsContact O-N 3.08Å; S43-S46 PolarHBondContact O-OG 3.28Å; S43-E47 WeakPolarHBondContact CB-OE1 3.41Å; S43-E47 WeakPolarHBondContact O-CB 3.46Å; S43-E47 VanDerWaalsContact O-CG 3.26Å; S43-E47 WeakPolarHBondContact O-CG 3.42Å; S43-E47 PolarHBondContact O-N 3.01Å
44	V	94.4	Very high	91.2	Very high	49 Å²	49	68.6 Å²	68.6	30%	0.297	36%	0.358	S	S	.	.	H	α-helix	trans	-59	-35.9	179.4	-170.7	0	0	0	0	112	V41 R48	V41-V44 PolarHBondContact O-N 3.29Å; V44-R48 WeakPolarHBondContact O-CG 3.46Å; V44-R48 PolarHBondContact O-N 2.95Å
45	L	93.3	Very high	91.2	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-71.8	-42	176.6	-61.9	170	0	0	0	111.7	V24 L27 K28 L31 T38 V41 K42 S43 L49	V24-L45 HydrophobicContact CG1-CD1 3.97Å; L27-L45 HydrophobicContact CB-CB 4.43Å; L27-L45 HydrophobicContact CD1-CB 4.35Å; K28-L45 HydrophobicContact CG-CD1 4.08Å; L31-L45 HydrophobicContact CD1-CB 3.87Å; L31-L45 HydrophobicContact CD1-CD2 3.57Å; L31-L45 HydrophobicContact CD1-CG 4.31Å; T38-L45 VanDerWaalsContact C-CD2 3.5Å; V41-L45 WeakPolarHBondContact O-CG 3.34Å; V41-L45 PolarHBondContact O-N 2.86Å; V41-L45 VanDerWaalsContact O-N 3.14Å; K42-L45 PolarHBondContact O-N 3.4Å; S43-L45 PolarHBondContact O-N 3.09Å; L45-L49 WeakPolarHBondContact O-CB 3.08Å; L45-L49 PolarHBondContact O-N 3.5Å
46	S	92.3	Very high	91	Very high	27 Å²	27	70.5 Å²	70.5	19%	0.189	36%	0.364	C	S	.	.	H	α-helix	trans	-68.3	-32.4	173.1	47.1	0	0	0	0	112.9	K42 S43 K50	K42-S46 PolarHBondContact O-N 2.76Å; K42-S46 PolarHBondContact O-OG 2.79Å; S43-S46 WeakPolarHBondContact CA-OG 3.43Å; S43-S46 CarbonylContact O-C 3.59Å; S43-S46 PolarHBondContact O-N 3.4Å; S43-S46 VanDerWaalsContact O-N 3.08Å; S43-S46 PolarHBondContact O-OG 3.28Å; S46-K50 WeakPolarHBondContact O-CA 3.4Å; S46-K50 WeakPolarHBondContact O-CB 3.37Å; S46-K50 PolarHBondContact O-N 3.08Å
47	E	93.1	Very high	90.4	Very high	117 Å²	117	70.5 Å²	70.5	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-69.5	-44.5	176.2	-74.3	154.6	-152.9	0	0	111.6	S43 R51	S43-E47 WeakPolarHBondContact CB-OE1 3.41Å; S43-E47 WeakPolarHBondContact O-CB 3.46Å; S43-E47 VanDerWaalsContact O-CG 3.26Å; S43-E47 WeakPolarHBondContact O-CG 3.42Å; S43-E47 PolarHBondContact O-N 3.01Å; E47-R51 WeakPolarHBondContact O-CB 3.34Å; E47-R51 PolarHBondContact O-N 3.02Å
48	R	93.6	Very high	89.7	Confident	77 Å²	77	67.6 Å²	67.6	29%	0.291	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-43.7	172.6	-72.7	-175.2	-159.9	132.5	3.1	111.9	L31 D37 T39 V44 R51 A52	L31-R48 HydrophobicContact CD2-CB 3.86Å; D37-R48 PolarHBondContact O-NH1 3.03Å; T39-R48 PolarHBondContact O-NH1 2.7Å; T39-R48 PolarHBondContact O-NH2 2.99Å; V44-R48 WeakPolarHBondContact O-CG 3.46Å; V44-R48 PolarHBondContact O-N 2.95Å; R48-R51 PolarHBondContact O-N 2.99Å; R48-A52 WeakPolarHBondContact O-CB 3.15Å; R48-A52 PolarHBondContact O-N 2.72Å
49	L	91	Very high	89	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-69.4	-39.3	-179.3	-172.1	59.4	0	0	0	111.2	L19 L22 L27 E30 L31 L45 A52 I53 I63	L19-L49 HydrophobicContact CD2-CB 3.96Å; L19-L49 HydrophobicContact CD2-CD2 3.73Å; L19-L49 HydrophobicContact CD2-CG 3.85Å; L22-L49 HydrophobicContact CD1-CD2 4.17Å; L27-L49 HydrophobicContact CD2-CD2 3.69Å; E30-L49 HydrophobicContact CB-CD1 3.88Å; E30-L49 HydrophobicContact CB-CD2 3.62Å; E30-L49 HydrophobicContact CB-CG 4.43Å; E30-L49 HydrophobicContact CG-CD2 4.43Å; L31-L49 HydrophobicContact CD2-CB 3.87Å; L31-L49 HydrophobicContact CD2-CD1 4.18Å; L31-L49 HydrophobicContact CG-CB 4.1Å; L31-L49 HydrophobicContact CG-CD1 4.3Å; L45-L49 WeakPolarHBondContact O-CB 3.08Å; L45-L49 PolarHBondContact O-N 3.5Å; L49-A52 PolarHBondContact O-N 3.45Å; L49-I53 HydrophobicContact CD1-CD1 4.25Å; L49-I53 HydrophobicContact CG-CD1 3.9Å; L49-I53 WeakPolarHBondContact O-CD1 3.38Å; L49-I53 VanDerWaalsContact O-CG1 3.28Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 3.06Å; L49-I63 HydrophobicContact CD2-CD1 4.07Å
50	K	90.8	Very high	88.2	Confident	90 Å²	90	67.3 Å²	67.3	39%	0.391	37%	0.369	S	S	.	.	H	α-helix	trans	-54	-57.4	170.8	-178.2	169.2	170.5	171.2	0	111	L19 S46 A52 I53 E54 P60	L19-K50 HydrophobicContact CD1-CB 3.57Å; L19-K50 HydrophobicContact CD1-CG 3.98Å; S46-K50 WeakPolarHBondContact O-CA 3.4Å; S46-K50 WeakPolarHBondContact O-CB 3.37Å; S46-K50 PolarHBondContact O-N 3.08Å; K50-A52 VanDerWaalsContact C-N 3.26Å; K50-A52 PolarHBondContact O-N 3.04Å; K50-I53 PolarHBondContact O-N 2.8Å; K50-I53 VanDerWaalsContact O-N 3.11Å; K50-E54 WeakPolarHBondContact CE-OE1 3.26Å; K50-E54 VanDerWaalsContact CE-OE2 3.3Å; K50-E54 WeakPolarHBondContact CE-OE2 3.49Å; K50-E54 HydrophobicContact CG-CG 4.34Å; K50-E54 WeakPolarHBondContact CG-OE2 3.42Å; K50-E54 IonicContact NZ-OE1 2.77Å; K50-E54 PolarHBondContact NZ-OE1 2.99Å; K50-E54 WeakPolarHBondContact O-CG 3.47Å; K50-E54 PolarHBondContact O-N 2.74Å; K50-P60 HydrophobicContact CD-CB 4.48Å; K50-P60 HydrophobicContact CG-CB 3.96Å
51	R	91.6	Very high	87.4	Confident	169 Å²	169	69.5 Å²	69.5	64%	0.638	37%	0.37	S	S	*	.	H	α-helix	trans	-57.6	-40.9	-179.3	177.6	177.2	167.2	165.2	0.7	111.7	E47 R48 E54 E55	E47-R51 WeakPolarHBondContact O-CB 3.34Å; E47-R51 PolarHBondContact O-N 3.02Å; R48-R51 PolarHBondContact O-N 2.99Å; R51-E54 PolarHBondContact O-N 3.17Å; R51-E55 IonicContact NE-OE2 3.06Å; R51-E55 IonicContact NH2-OE2 3.75Å; R51-E55 WeakPolarHBondContact O-CB 3.24Å; R51-E55 PolarHBondContact O-N 3.18Å
52	A	88.2	Confident	86.6	Confident	11 Å²	11	70.1 Å²	70.1	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-39.5	178.1	0	0	0	0	0	112.9	L36 R48 L49 K50 E55 E56	L36-A52 HydrophobicContact CD1-CB 3.32Å; R48-A52 WeakPolarHBondContact O-CB 3.15Å; R48-A52 PolarHBondContact O-N 2.72Å; L49-A52 PolarHBondContact O-N 3.45Å; K50-A52 VanDerWaalsContact C-N 3.26Å; K50-A52 PolarHBondContact O-N 3.04Å; A52-E55 PolarHBondContact O-N 3.21Å; A52-E56 WeakPolarHBondContact O-CB 3.46Å; A52-E56 VanDerWaalsContact O-CG 3.26Å; A52-E56 WeakPolarHBondContact O-CG 3.36Å; A52-E56 PolarHBondContact O-N 2.79Å
53	I	87.8	Confident	85.7	Confident	6 Å²	6	67 Å²	67	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-68	-41.7	175.4	-68.3	159.2	0	0	0	110.8	L19 L49 K50 E55 E56 G57 G58 I63	L19-I53 HydrophobicContact CD2-CD1 4.43Å; L49-I53 HydrophobicContact CD1-CD1 4.25Å; L49-I53 HydrophobicContact CG-CD1 3.9Å; L49-I53 WeakPolarHBondContact O-CD1 3.38Å; L49-I53 VanDerWaalsContact O-CG1 3.28Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 3.06Å; K50-I53 PolarHBondContact O-N 2.8Å; K50-I53 VanDerWaalsContact O-N 3.11Å; I53-E55 VanDerWaalsContact C-N 3.33Å; I53-E55 PolarHBondContact O-N 3.33Å; I53-E56 CarbonylContact O-C 3.33Å; I53-E56 PolarHBondContact O-N 3.08Å; I53-G57 PolarHBondContact O-N 3.19Å; I53-G58 WeakPolarHBondContact CG2-O 3.44Å; I53-G58 PolarHBondContact O-N 3.18Å; I53-I63 HydrophobicContact CD1-CD1 3.43Å; I53-I63 VanDerWaalsContact CD1-CD1 3.43Å; I53-I63 HydrophobicContact CD1-CG1 3.58Å
54	E	87.2	Confident	84.8	Confident	98 Å²	98	67.5 Å²	67.5	46%	0.458	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-34.2	175.1	-69	175	143.8	0	0	112.2	K50 R51 G57 P60	K50-E54 WeakPolarHBondContact CE-OE1 3.26Å; K50-E54 VanDerWaalsContact CE-OE2 3.3Å; K50-E54 WeakPolarHBondContact CE-OE2 3.49Å; K50-E54 HydrophobicContact CG-CG 4.34Å; K50-E54 WeakPolarHBondContact CG-OE2 3.42Å; K50-E54 IonicContact NZ-OE1 2.77Å; K50-E54 PolarHBondContact NZ-OE1 2.99Å; K50-E54 WeakPolarHBondContact O-CG 3.47Å; K50-E54 PolarHBondContact O-N 2.74Å; R51-E54 PolarHBondContact O-N 3.17Å; E54-G57 PolarHBondContact O-N 3.23Å; E54-P60 HydrophobicContact CG-CG 4.3Å
55	E	87.7	Confident	83.8	Confident	146 Å²	146	66 Å²	66	68%	0.682	34%	0.343	S	S	*	.	H	α-helix	trans	-76.2	-28.3	176	-168.3	163.9	169.8	0	0	112.3	R51 A52 I53 G57	R51-E55 IonicContact NE-OE2 3.06Å; R51-E55 IonicContact NH2-OE2 3.75Å; R51-E55 WeakPolarHBondContact O-CB 3.24Å; R51-E55 PolarHBondContact O-N 3.18Å; A52-E55 PolarHBondContact O-N 3.21Å; I53-E55 VanDerWaalsContact C-N 3.33Å; I53-E55 PolarHBondContact O-N 3.33Å; E55-G57 VanDerWaalsContact C-N 3.27Å
56	E	83.4	Confident	82.7	Confident	114 Å²	114	70 Å²	70	53%	0.533	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.3	166.3	-73.4	166.5	-162.3	0	0	113.3	R34 A52 I53	R34-E56 VanDerWaalsContact CD-OE1 3.24Å; R34-E56 WeakPolarHBondContact CD-OE1 3.4Å; R34-E56 IonicContact CZ-OE1 3.81Å; R34-E56 IonicContact CZ-OE2 3.42Å; R34-E56 IonicContact NE-OE1 3.8Å; R34-E56 PolarHBondContact NE-OE1 3.23Å; R34-E56 IonicContact NE-OE2 3.51Å; R34-E56 PolarHBondContact NE-OE2 2.86Å; R34-E56 IonicContact NH2-OE2 2.67Å; R34-E56 PolarHBondContact NH2-OE2 3.14Å; A52-E56 WeakPolarHBondContact O-CB 3.46Å; A52-E56 VanDerWaalsContact O-CG 3.26Å; A52-E56 WeakPolarHBondContact O-CG 3.36Å; A52-E56 PolarHBondContact O-N 2.79Å; I53-E56 CarbonylContact O-C 3.33Å; I53-E56 PolarHBondContact O-N 3.08Å
57	G	77.5	Confident	81.2	Confident	70 Å²	70	72.5 Å²	72.5	72%	0.722	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	16.7	-179.5	0	0	0	0	0	115.4	I53 E54 E55	I53-G57 PolarHBondContact O-N 3.19Å; E54-G57 PolarHBondContact O-N 3.23Å; E55-G57 VanDerWaalsContact C-N 3.27Å
58	G	77.5	Confident	79.1	Confident	36 Å²	36	73.6 Å²	73.6	37%	0.371	39%	0.389	S	S	.	.			trans	-92.8	165.4	177	0	0	0	0	0	113.8	I53 P60	I53-G58 WeakPolarHBondContact CG2-O 3.44Å; I53-G58 PolarHBondContact O-N 3.18Å; G58-P60 WeakPolarHBondContact O-CD 3.35Å
59	D	78.2	Confident	76.6	Confident	97 Å²	97	75.8 Å²	75.8	52%	0.519	42%	0.416	S	S	.	.			trans	-77.1	120.8	175.9	-91.6	-12.6	0	0	0	111.5	D61 Q62	D59-D61 PolarHBondContact O-N 3.35Å; D59-D61 VanDerWaalsContact O-N 3.14Å; D59-Q62 HydrophobicContact CB-CB 3.91Å; D59-Q62 HydrophobicContact CB-CG 3.92Å; D59-Q62 PolarHBondContact O-N 2.92Å; D59-Q62 PolarHBondContact OD2-NE2 2.99Å
60	P	74.4	Confident	73.9	Confident	25 Å²	25	82.4 Å²	82.4	16%	0.162	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.3	-180	26.6	-34.5	0	0	0	114	L19 K50 E54 G58	L19-P60 HydrophobicContact CD1-CB 3.7Å; L19-P60 WeakPolarHBondContact CD1-O 3.25Å; L19-P60 WeakPolarHBondContact CG-O 3.22Å; K50-P60 HydrophobicContact CD-CB 4.48Å; K50-P60 HydrophobicContact CG-CB 3.96Å; E54-P60 HydrophobicContact CG-CG 4.3Å; G58-P60 WeakPolarHBondContact O-CD 3.35Å
61	D	74.1	Confident	71.6	Confident	94 Å²	94	83.4 Å²	83.4	50%	0.503	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	1.2	175.5	-78.6	-43.1	0	0	0	113.8	K18 D59	K18-D61 HydrophobicContact CG-CB 4.06Å; K18-D61 VanDerWaalsContact CG-O 3.25Å; K18-D61 WeakPolarHBondContact CG-O 3.14Å; D59-D61 PolarHBondContact O-N 3.35Å; D59-D61 VanDerWaalsContact O-N 3.14Å
62	Q	75.3	Confident	68.9	Low	118 Å²	118	84.8 Å²	84.8	55%	0.551	48%	0.478	S	S	*	.			trans	-125.6	56.5	-177.4	-56.8	-159.6	71.6	0	0	113	V16 D59 V64	V16-Q62 HydrophobicContact CG1-CB 4.09Å; D59-Q62 HydrophobicContact CB-CB 3.91Å; D59-Q62 HydrophobicContact CB-CG 3.92Å; D59-Q62 PolarHBondContact O-N 2.92Å; D59-Q62 PolarHBondContact OD2-NE2 2.99Å; Q62-V64 PolarHBondContact O-N 3.14Å
63	I	76.3	Confident	66.3	Low	8 Å²	8	94.1 Å²	94.1	4%	0.041	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	116.2	178.1	-61.8	174.1	0	0	0	110.4	V16 R17 L19 L22 E30 L49 I53 L65	V16-I63 CarbonylContact C-O 3.51Å; V16-I63 WeakPolarHBondContact CA-O 3.42Å; R17-I63 PolarHBondContact N-O 3.03Å; R17-I63 WeakPolarHBondContact O-CB 3.44Å; R17-I63 PolarHBondContact O-N 2.88Å; L19-I63 HydrophobicContact CD2-CD1 3.49Å; L19-I63 VanDerWaalsContact CD2-CD1 3.49Å; L19-I63 HydrophobicContact CG-CD1 3.59Å; L22-I63 HydrophobicContact CD1-CD1 3.54Å; L22-I63 HydrophobicContact CD1-CG2 4.47Å; E30-I63 HydrophobicContact CG-CG2 4.32Å; L49-I63 HydrophobicContact CD2-CD1 4.07Å; I53-I63 HydrophobicContact CD1-CD1 3.43Å; I53-I63 VanDerWaalsContact CD1-CD1 3.43Å; I53-I63 HydrophobicContact CD1-CG1 3.58Å; I63-L65 HydrophobicContact CG2-CD2 4.07Å; I63-L65 HydrophobicContact CG2-CG 4.42Å; I63-L65 PolarHBondContact O-N 2.86Å
64	V	74	Confident	63.7	Low	66 Å²	66	99.4 Å²	99.4	40%	0.4	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.8	100.6	169	-178.5	0	0	0	0	110	M10 A14 V16 Q62 I66	M10-V64 HydrophobicContact CE-CG1 3.8Å; M10-V64 HydrophobicContact CE-CG2 4.27Å; A14-V64 HydrophobicContact CB-CG1 3.83Å; V16-V64 HydrophobicContact CG2-CG2 4.31Å; Q62-V64 PolarHBondContact O-N 3.14Å; V64-I66 HydrophobicContact CG1-CG1 4.5Å; V64-I66 PolarHBondContact O-N 3.11Å
65	L	72.9	Confident	61.2	Low	18 Å²	18	100.9 Å²	100.9	9%	0.094	57%	0.57	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.4	106.2	171.7	-68.4	180	0	0	0	110.9	A14 E15 R17 L22 E30 I63 P67	A14-L65 WeakPolarHBondContact CA-O 3.36Å; E15-L65 PolarHBondContact N-O 2.8Å; E15-L65 WeakPolarHBondContact O-CB 3.34Å; E15-L65 PolarHBondContact O-N 2.71Å; R17-L65 HydrophobicContact CG-CD1 4.34Å; R17-L65 VanDerWaalsContact NH1-CD1 3.32Å; L22-L65 HydrophobicContact CD2-CD1 3.62Å; L22-L65 HydrophobicContact CD2-CD2 4.11Å; L22-L65 HydrophobicContact CD2-CG 4.07Å; E30-L65 HydrophobicContact CG-CD2 3.76Å; I63-L65 HydrophobicContact CG2-CD2 4.07Å; I63-L65 HydrophobicContact CG2-CG 4.42Å; I63-L65 PolarHBondContact O-N 2.86Å; L65-P67 WeakPolarHBondContact O-CD 3.16Å
66	I	68.9	Low	58.8	Low	83 Å²	83	100.1 Å²	100.1	43%	0.426	58%	0.577	S	S	.	*			trans	-79.2	121.1	162.7	-51.2	171.4	0	0	0	108.3	P11 A14 K33 V64	P11-I66 HydrophobicContact CG-CD1 3.73Å; P11-I66 HydrophobicContact CG-CG1 3.84Å; P11-I66 HydrophobicContact CG-CG2 4.13Å; A14-I66 HydrophobicContact CB-CG1 4.22Å; K33-I66 PolarHBondContact NZ-O 2.91Å; V64-I66 HydrophobicContact CG1-CG1 4.5Å; V64-I66 PolarHBondContact O-N 3.11Å
67	P	60.9	Low	56.3	Low	79 Å²	79	104.4 Å²	104.4	51%	0.513	59%	0.594	S	S	.	*			trans	-80.6	126.8	178.9	31	-33.3	0	0	0	112.3	G13 L65 S69	G13-P67 WeakPolarHBondContact O-CD 3.44Å; L65-P67 WeakPolarHBondContact O-CD 3.16Å; P67-S69 PolarHBondContact O-N 3.44Å; P67-S69 VanDerWaalsContact O-N 3.08Å
68	D	49.3	Very low	54.1	Low	140 Å²	140	112.7 Å²	112.7	75%	0.749	60%	0.604	S	S	*	*			trans	-65.4	107	177.8	-68.5	-33.3	0	0	0	111.7	N70	D68-N70 PolarHBondContact O-N 2.73Å
69	S	41.4	Very low	51.9	Low	123 Å²	123	117.8 Å²	117.8	86%	0.86	63%	0.628	S	S	*	*			trans	-78.2	79.9	-176.3	53.3	0	0	0	0	113.2	P67	P67-S69 PolarHBondContact O-N 3.44Å; P67-S69 VanDerWaalsContact O-N 3.08Å
70	N	33.7	Very low	49.7	Very low	140 Å²	140	118.2 Å²	118.2	75%	0.749	65%	0.645	S	S	*	*			trans	-126.2	107.9	173.9	-158.7	-25.7	0	0	0	111.9	D68	D68-N70 PolarHBondContact O-N 2.73Å
71	P	43.5	Very low	47.6	Very low	110 Å²	110	126 Å²	126	71%	0.714	68%	0.676	S	S	*	*			trans	-86.2	131.6	-163.3	31.7	-35.3	0	0	0	114.5
72	K	34.2	Very low	45.5	Very low	198 Å²	198	127.9 Å²	127.9	86%	0.861	69%	0.686	S	S	*	*			trans	-155.6	98.4	154.8	-107.2	132.8	-169.5	169.5	0	114.4
73	K	33.6	Very low	43.3	Very low	207 Å²	207	126.7 Å²	126.7	90%	0.9	69%	0.691	S	S	*	*			trans	46.7	106	152.1	-64.2	-171.2	174.9	-175.1	0	118.8
74	S	34.3	Very low	41.1	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	73%	0.731	S	S	*	*			trans	-69.8	163.9	156.2	50.5	0	0	0	0	112.6
75	T	34.2	Very low	39	Very low	130 Å²	130	142.4 Å²	142.4	80%	0.798	75%	0.75	S	S	*	*			trans	-126.2	150	160.7	50.8	0	0	0	0	109
76	P	36.7	Very low	37	Very low	130 Å²	130	147.7 Å²	147.7	84%	0.844	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.1	137.7	-162.2	28.4	-35.3	0	0	0	113.4
77	K	32.1	Very low	35.4	Very low	204 Å²	204	153 Å²	153	89%	0.887	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.4	134	162.4	-90.1	-174.6	172.8	-178.3	0	109.8
78	R	31.4	Very low	34.1	Very low	243 Å²	243	157.8 Å²	157.8	92%	0.917	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.3	142	161.8	-71.6	168.4	60.2	168.8	-1.1	109.3
79	T	31	Very low	33.4	Very low	144 Å²	144	155.3 Å²	155.3	88%	0.883	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77.9	150.4	172.7	41.8	0	0	0	0	111.4
80	A	31.3	Very low	33.1	Very low	105 Å²	105	158.1 Å²	158.1	87%	0.868	82%	0.815	S	S	*	*			trans	-161.4	97.9	169.6	0	0	0	0	0	109.4
81	K	29.7	Very low	32.9	Very low	190 Å²	190	160.1 Å²	160.1	83%	0.826	82%	0.82	S	S	*	*			trans	-173.4	141.1	175.7	-173	163.4	-167.4	-168.5	0	107.2
82	D	30	Very low	32.4	Very low	133 Å²	133	161.4 Å²	161.4	71%	0.711	83%	0.825	S	S	*	*			cis	-138.7	-174.6	-8.1	-138.9	-32.5	0	0	0	110.4
83	S	29.4	Very low	32.9	Very low	93 Å²	93	157 Å²	157	65%	0.65	82%	0.817	S	S	*	*			trans	-121.6	122	172.8	61.8	0	0	0	0	114.6
84	R	30.4	Very low	32.9	Very low	235 Å²	235	153.3 Å²	153.3	89%	0.887	81%	0.807	S	S	*	*			trans	60.7	123.8	157.2	-59.7	177.2	177	172	-3.6	118.3
85	Q	30.3	Very low	33	Very low	168 Å²	168	155.7 Å²	155.7	79%	0.785	81%	0.805	S	S	*	*				-170.1	121.2	95.9	-82	-163.7	-79.1	0	0	106.4
86	D	31.2	Very low	33.1	Very low	129 Å²	129	157.8 Å²	157.8	69%	0.69	81%	0.806	S	S	*	*				77	117.5	92.1	-58.5	-29.7	0	0	0	112.8
87	E	34.7	Very low	32.6	Very low	194 Å²	194	158.1 Å²	158.1	91%	0.907	80%	0.8	S	S	*	*			trans	176.9	170.4	150.5	-93.3	-65.5	135.7	0	0	107.9
88	E	33.1	Very low	33	Very low	181 Å²	181	154.3 Å²	154.3	85%	0.846	80%	0.799	S	S	*	*			trans	-110.9	174.7	-149.3	-164.2	167.8	-166.5	0	0	116.7
89	A	35.1	Very low	33.1	Very low	88 Å²	88	153 Å²	153	73%	0.727	80%	0.795	S	S	*	*			trans	73.9	150	168.5	0	0	0	0	0	118.6
90	E	35	Very low	33.3	Very low	181 Å²	181	154 Å²	154	85%	0.846	79%	0.794	S	S	*	*			cis	-163	-178.5	-21.7	-104.8	-123.3	116.3	0	0	109
91	E	29.9	Very low	33.5	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	79%	0.786	S	S	*	*			trans	68.1	114.2	167	-62.5	-168.6	161.1	0	0	120.8
92	V	33.6	Very low	33.9	Very low	137 Å²	137	151.4 Å²	151.4	83%	0.83	79%	0.785	S	S	*	*			trans	-95.8	167.5	150.2	-115.5	0	0	0	0	107.8
93	P	44.5	Very low	34	Very low	107 Å²	107	152.2 Å²	152.2	70%	0.695	79%	0.785	S	S	*	*			cis	-153.1	-155.9	46.4	35.1	-7.7	0	0	0	116.3
94	L	33.3	Very low	34.4	Very low	129 Å²	129	154.2 Å²	154.2	68%	0.675	79%	0.788	S	S	*	*			trans	82.5	104.1	167.4	-50.6	175.4	0	0	0	115.2
95	E	36	Very low	34.5	Very low	166 Å²	166	151 Å²	151	78%	0.776	78%	0.781	S	S	*	*				91.5	148.9	76.4	-82.2	167.9	-159.7	0	0	111.6
96	E	35.6	Very low	34.6	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	78%	0.776	S	S	*	*			cis	-146.9	-175.9	15.6	-144.3	176.2	-178.7	0	0	112.3
97	D	28	Very low	34.7	Very low	137 Å²	137	149.8 Å²	149.8	73%	0.733	78%	0.779	S	S	*	*			trans	-66.7	155.3	-172.6	-82.3	-69.2	0	0	0	117.7
98	S	38.6	Very low	34.7	Very low	124 Å²	124	148.4 Å²	148.4	87%	0.867	77%	0.772	S	S	*	*				-171.7	157.6	120.5	-82.5	0	0	0	0	113.6
99	R	34.7	Very low	34.7	Very low	216 Å²	216	146.7 Å²	146.7	82%	0.815	77%	0.774	S	S	*	*			trans	-118.8	-167.4	-164.5	-62.5	166.3	79.1	175.4	4.8	113
100	D	34.8	Very low	34.5	Very low	163 Å²	163	149.2 Å²	149.2	87%	0.872	78%	0.775	S	S	*	*			trans	92.3	141	163.2	-48.1	-20	0	0	0	115.4
101	G	35.9	Very low	34.4	Very low	68 Å²	68	146.5 Å²	146.5	70%	0.701	76%	0.764	S	S	*	*			cis	156	131.3	-0.2	0	0	0	0	0	107.7
102	Q	37.4	Very low	34.5	Very low	173 Å²	173	145.4 Å²	145.4	81%	0.808	76%	0.759	S	S	*	*			cis	88.8	116.4	45.4	-166.2	165.9	28.7	0	0	112.5
103	E	32.9	Very low	34.4	Very low	150 Å²	150	144.6 Å²	144.6	70%	0.701	75%	0.75	S	S	*	*			cis	-162.8	179.2	-5.2	-125.3	156.7	-172.1	0	0	112.3
104	D	37.6	Very low	34	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	76%	0.756	S	S	*	*			trans	81.2	150.6	147.7	-84.4	-13.9	0	0	0	127.4
105	F	31.4	Very low	34	Very low	169 Å²	169	149.3 Å²	149.3	74%	0.741	76%	0.764	S	S	*	*			trans	64	121.6	154.9	-88.1	-123.7	0	0	0	121.4
106	L	33.8	Very low	34.3	Very low	130 Å²	130	149.2 Å²	149.2	68%	0.681	76%	0.763	S	S	*	*				76.8	125.9	70.9	-85.4	160.9	0	0	0	114
107	D	33.2	Very low	34.6	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	75%	0.752	S	S	*	*				-163.5	-175.4	67.1	-165.2	12.8	0	0	0	114.2
108	H	33.5	Very low	35.2	Very low	165 Å²	165	146.3 Å²	146.3	76%	0.764	75%	0.751	S	S	*	*			trans	-74.8	164.4	-178.9	-77.6	-100	0	0	0	116.7
109	V	34.8	Very low	35.4	Very low	145 Å²	145	149.4 Å²	149.4	88%	0.879	75%	0.751	S	S	*	*				-178.6	158.9	110	151.4	0	0	0	0	111
110	N	31	Very low	35.4	Very low	140 Å²	140	145.6 Å²	145.6	75%	0.749	75%	0.747	S	S	*	*			trans	-128.8	151.5	-170.7	169.6	72.5	0	0	0	111.3
111	M	32.9	Very low	35.3	Very low	124 Å²	124	145.4 Å²	145.4	61%	0.611	74%	0.743	S	S	*	*			trans	151.8	172.7	145.2	-82.7	-156.3	93.2	0	0	113.1
112	Q	31.5	Very low	35.1	Very low	160 Å²	160	148.1 Å²	148.1	75%	0.748	74%	0.741	S	S	*	*			trans	71.6	95.3	-175.2	-70.2	72.6	68.8	0	0	111.8
113	D	32.1	Very low	35	Very low	120 Å²	120	147.8 Å²	147.8	64%	0.642	74%	0.743	S	S	*	*			cis	68.1	153	34.9	-50.5	-61.3	0	0	0	115
114	D	34.7	Very low	35.2	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	76%	0.755	S	S	*	*			trans	72.6	89.6	-170.6	-56.6	-30.7	0	0	0	115
115	H	33.3	Very low	35	Very low	183 Å²	183	149.4 Å²	149.4	85%	0.847	76%	0.756	S	S	*	*				49.3	114.8	79.5	-93	-95.9	0	0	0	114.8
116	E	43.2	Very low	35.1	Very low	164 Å²	164	149.1 Å²	149.1	77%	0.766	76%	0.759	S	S	*	*				-172.6	130.7	113	-97.6	-152.3	-137.1	0	0	109.1
117	N	41.9	Very low	35	Very low	109 Å²	109	149.5 Å²	149.5	58%	0.583	76%	0.762	S	S	*	*				83.8	142	82.6	-146.1	24.6	0	0	0	111.2
118	M	40.7	Very low	35.2	Very low	142 Å²	142	148.4 Å²	148.4	70%	0.7	76%	0.76	S	S	*	*			cis	-156.1	136.4	4.5	-162.2	165.4	-136.8	0	0	109.6
119	Q	41.3	Very low	35.4	Very low	188 Å²	188	147.4 Å²	147.4	88%	0.879	76%	0.759	S	S	*	*			trans	162.6	85.2	148.3	-92.1	159.2	39	0	0	111.3
120	D	35.3	Very low	35.3	Very low	137 Å²	137	146.8 Å²	146.8	73%	0.733	75%	0.751	S	S	*	*			trans	-75.2	-167.6	160.6	-54	-86.1	0	0	0	111
121	M	32.8	Very low	35.6	Very low	159 Å²	159	148.3 Å²	148.3	78%	0.783	75%	0.754	S	S	*	*			trans	73.6	126.7	168.9	-40.7	-52.9	-80.6	0	0	115
122	D	32.2	Very low	35.8	Very low	124 Å²	124	147.8 Å²	147.8	66%	0.663	76%	0.757	S	S	*	*			cis	-150.6	156.5	-2.8	-82	-46.4	0	0	0	110.5
123	I	35.5	Very low	35.9	Very low	167 Å²	167	147.9 Å²	147.9	86%	0.856	76%	0.758	S	S	*	*	S	Bend	trans	178.8	72.1	141.8	-93.8	155.8	0	0	0	109.3
124	L	36.7	Very low	36	Very low	180 Å²	180	149.2 Å²	149.2	94%	0.942	77%	0.765	S	S	*	*			trans	-150.4	63.2	155.4	-85.4	-169.5	0	0	0	109
125	D	33.3	Very low	36.2	Very low	138 Å²	138	151.5 Å²	151.5	74%	0.738	77%	0.771	S	S	*	*			trans	-145.6	112.2	155.7	-146.5	-16.7	0	0	0	113
126	M	33.5	Very low	36.2	Very low	163 Å²	163	148.1 Å²	148.1	80%	0.803	77%	0.768	S	S	*	*	S	Bend	trans	178.9	89.5	158.4	-105.5	-87.4	74.1	0	0	107.5
127	N	32.3	Very low	35.7	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	76%	0.764	S	S	*	*			trans	151.6	59.9	140.8	-74.5	3.9	0	0	0	112.4
128	V	37.8	Very low	35.2	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.715	78%	0.782	S	S	*	*			trans	-151.9	120.5	167.2	172.2	0	0	0	0	103.6
129	L	36.6	Very low	35.1	Very low	143 Å²	143	146.4 Å²	146.4	75%	0.749	79%	0.785	S	S	*	*			cis	-122.7	-179.9	-5.1	-87.8	148.4	0	0	0	107.5
130	D	33.9	Very low	35.1	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	79%	0.785	S	S	*	*			cis	-147.6	172.5	32.4	-116	-28.1	0	0	0	109.4
131	E	36.9	Very low	35	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	79%	0.79	S	S	*	*			cis	-126.4	169.2	14.8	-64.8	175.3	126.7	0	0	113.3
132	T	36.1	Very low	35	Very low	112 Å²	112	141.8 Å²	141.8	69%	0.687	79%	0.794	S	S	*	*			trans	-66.7	169.9	159.3	48.8	0	0	0	0	111
133	E	34.3	Very low	36.2	Very low	162 Å²	162	140.6 Å²	140.6	76%	0.757	79%	0.793	S	S	*	*			cis	-152.8	173.9	33.9	-61.3	-179.5	143	0	0	113.4
134	N	33.1	Very low	36.4	Very low	149 Å²	149	140.6 Å²	140.6	80%	0.797	79%	0.791	S	S	*	*			trans	122.8	70.2	155.1	-68	-70.3	0	0	0	117.5
135	E	38.8	Very low	36.4	Very low	199 Å²	199	138.9 Å²	138.9	93%	0.93	78%	0.783	S	S	*	*			trans	-133.1	85.1	142.5	-169.6	174.7	-158.1	0	0	111.6
136	S	34.1	Very low	36.5	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	79%	0.787	S	S	*	*			trans	-165.4	148.3	148.4	40.1	0	0	0	0	107.5
137	G	32.6	Very low	36.7	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	79%	0.786	S	S	*	*			cis	98.7	74	18.5	0	0	0	0	0	109.3	P139	G137-P139 WeakPolarHBondContact O-CD 3.32Å
138	M	30.8	Very low	36.7	Very low	197 Å²	197	136.8 Å²	136.8	97%	0.97	79%	0.787	S	S	*	*			trans	-50	134.6	-174.3	-78.4	-173.8	167.9	0	0	113.3
139	P	40	Very low	36.7	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	78%	0.781	S	S	*	*				-126.2	131.6	125.7	36.1	-29.5	0	0	0	112.8	G137	G137-P139 WeakPolarHBondContact O-CD 3.32Å
140	T	40.7	Very low	36.5	Very low	145 Å²	145	138.9 Å²	138.9	89%	0.89	78%	0.782	S	S	*	*			trans	-6.1	121.9	156.5	54.4	0	0	0	0	118.9
141	G	33	Very low	36.5	Very low	80 Å²	80	138.8 Å²	138.8	83%	0.825	78%	0.781	S	S	*	*			trans	-177	131.8	163.5	0	0	0	0	0	111.8
142	D	32.3	Very low	36.4	Very low	162 Å²	162	140 Å²	140	87%	0.866	78%	0.778	S	S	*	*			trans	-102.7	176.7	177.6	-133.8	-7.4	0	0	0	109.4
143	P	58.4	Low	36.3	Very low	99 Å²	99	140.1 Å²	140.1	64%	0.643	78%	0.775	S	S	*	*				-113.9	-174	-116.9	42	-29.5	0	0	0	113.9
144	M	39.2	Very low	36.2	Very low	167 Å²	167	139.8 Å²	139.8	82%	0.823	78%	0.778	S	S	*	*				-176.4	158.8	129.9	-87.8	-40.1	-109.3	0	0	110.5
145	D	36.6	Very low	36.5	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	78%	0.778	S	S	*	*			trans	-87	165.9	-175.6	-35.8	-95.8	0	0	0	113.6
146	D	35.7	Very low	36.4	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	77%	0.765	S	S	*	*				-169.4	159.5	122.8	-154	17.1	0	0	0	113.8
147	E	37	Very low	36.4	Very low	166 Å²	166	136.2 Å²	136.2	78%	0.776	76%	0.761	S	S	*	*			trans	-35.6	165.6	174.7	-76.2	-74.5	172	0	0	121.3
148	G	33.6	Very low	36.5	Very low	74 Å²	74	141.4 Å²	141.4	76%	0.763	77%	0.773	S	S	*	*			trans	165.6	49.6	168.4	0	0	0	0	0	120
149	N	36.2	Very low	36.6	Very low	110 Å²	110	139.6 Å²	139.6	59%	0.588	76%	0.762	S	S	*	*			trans	-69.2	173.6	-178.4	-167.9	21.4	0	0	0	115.6
150	Y	33.4	Very low	36.2	Very low	196 Å²	196	140.8 Å²	140.8	77%	0.769	76%	0.762	S	S	*	*			trans	82.3	155.1	165	-50.8	-70.2	0	0	0	118.6
151	D	34.3	Very low	35.9	Very low	130 Å²	130	142.2 Å²	142.2	70%	0.695	76%	0.759	S	S	*	*			cis	-174.5	152.8	-41.3	-135.1	-36.5	0	0	0	108.7
152	R	34.7	Very low	36	Very low	197 Å²	197	146.4 Å²	146.4	74%	0.743	76%	0.762	S	S	*	*			trans	69	124.6	133.4	-159.6	165.5	-174.8	142.1	21.5	125.8
153	D	33.7	Very low	36.1	Very low	116 Å²	116	146.1 Å²	146.1	62%	0.62	76%	0.761	S	S	*	*			trans	61	173	142.1	-58.1	-7.7	0	0	0	124.3
154	D	33.2	Very low	34.7	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	76%	0.762	S	S	*	*			trans	73.1	140.1	175.3	-63.2	-33	0	0	0	119.4
155	E	38.1	Very low	34.4	Very low	171 Å²	171	147 Å²	147	80%	0.799	76%	0.761	S	S	*	*			cis	147.5	168.1	-19.8	-103.2	-71.5	-176.5	0	0	108.4
156	A	37.5	Very low	34.1	Very low	79 Å²	79	148.1 Å²	148.1	65%	0.653	76%	0.762	S	S	*	*			trans	71.3	148.8	176.9	0	0	0	0	0	115.9
157	L	32.8	Very low	33.9	Very low	136 Å²	136	150.5 Å²	150.5	71%	0.712	77%	0.765	S	S	*	*			cis	-142.8	148.6	4.1	-163.2	76.1	0	0	0	110.4
158	L	34.7	Very low	33.6	Very low	176 Å²	176	145.6 Å²	145.6	92%	0.921	76%	0.759	S	S	*	*			trans	-126.8	106.1	170.5	-83.5	176.3	0	0	0	111.4
159	E	32.8	Very low	33.3	Very low	158 Å²	158	148.2 Å²	148.2	74%	0.738	77%	0.766	S	S	*	*			trans	-149.3	140.3	171	-76.9	-174.7	-179.8	0	0	106.6
160	D	32	Very low	33	Very low	141 Å²	141	146.5 Å²	146.5	75%	0.754	77%	0.774	S	S	*	*			cis	-160.7	177.1	-5.1	-152	-10.4	0	0	0	112.1
161	E	35.6	Very low	32.8	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	78%	0.781	S	S	*	*			trans	71.2	151.3	160.1	-64.1	-158.4	130.5	0	0	121.3
162	N	33.5	Very low	32.5	Very low	168 Å²	168	148.6 Å²	148.6	90%	0.898	79%	0.787	S	S	*	*			trans	-114.5	167.8	-170.9	-84.1	-84.5	0	0	0	113
163	D	34.6	Very low	33.4	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	78%	0.78	S	S	*	*			trans	-70.8	172	174.7	-172.1	24.4	0	0	0	113.4
164	F	30.1	Very low	33	Very low	152 Å²	152	147 Å²	147	67%	0.667	79%	0.792	S	S	*	*			trans	100	127.3	155.2	-160.1	-100.8	0	0	0	119.4
165	T	31.8	Very low	32.5	Very low	133 Å²	133	143 Å²	143	82%	0.816	79%	0.788	S	S	*	*			trans	-165.6	125.9	132.3	10.3	0	0	0	0	112.6
166	E	31.6	Very low	33.3	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	79%	0.787	S	S	*	*			trans	-128.3	145	142.7	-170.1	164.4	-167	0	0	109
167	F	31.2	Very low	32.9	Very low	204 Å²	204	145.7 Å²	145.7	90%	0.895	80%	0.797	S	S	*	*			trans	-65	157.4	-171.8	-106.8	-126.1	0	0	0	113.8
168	G	30.9	Very low	33	Very low	63 Å²	63	146.5 Å²	146.5	65%	0.649	80%	0.802	S	S	*	*			cis	139.2	118	-5.1	0	0	0	0	0	114.2
169	S	27.4	Very low	33.8	Very low	129 Å²	129	143.8 Å²	143.8	90%	0.902	80%	0.795	S	S	*	*			trans	-175.1	138	167.2	57	0	0	0	0	110.7
170	G	30.1	Very low	33.5	Very low	74 Å²	74	143.8 Å²	143.8	76%	0.763	80%	0.8	S	S	*	*			cis	162.3	133.1	-9.3	0	0	0	0	0	113
171	Q	29.3	Very low	33.6	Very low	195 Å²	195	144.5 Å²	144.5	91%	0.911	80%	0.804	S	S	*	*			trans	65.9	99.4	163.7	-94.2	163.4	-10.4	0	0	121.4
172	E	27.2	Very low	33.3	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	80%	0.799	S	S	*	*				5.4	168.5	106.2	-97	-156.7	140.9	0	0	121.2
173	P	53.9	Low	33.1	Very low	92 Å²	92	136 Å²	136	60%	0.597	79%	0.794	S	S	*	*			cis	-139.3	-168	-4.1	27.1	-1.6	0	0	0	115.9
174	Q	24.4	Very low	32.8	Very low	187 Å²	187	137.4 Å²	137.4	87%	0.874	80%	0.795	S	S	*	*			trans	95.8	128.6	157.8	-52.1	-174.5	11.9	0	0	118.8
175	G	24.1	Very low	32.7	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	81%	0.807	S	S	*	*			trans	-105.8	-139.7	162.5	0	0	0	0	0	110.1
176	P	53.5	Low	32.4	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	81%	0.806	S	S	*	*			cis	-120.9	-177.4	-6.6	42.4	-29.5	0	0	0	112.7
177	E	29.3	Very low	32.1	Very low	185 Å²	185	136.5 Å²	136.5	86%	0.864	81%	0.809	S	S	*	*			trans	-175.3	166.9	137	-105.2	167.5	-139.8	0	0	113
178	N	35.5	Very low	31.9	Very low	152 Å²	152	134 Å²	134	81%	0.813	81%	0.81	S	S	*	*			trans	-93	-171.3	-164.8	-52.7	-65.7	0	0	0	113.2
179	P	50.3	Low	32.1	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	82%	0.819	S	S	*	*				-132.9	179.3	-64.3	38.9	-23.6	0	0	0	112.6
180	D	27.7	Very low	33.2	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	81%	0.805	S	S	*	*				-162.7	150.8	123.8	-155.8	13.8	0	0	0	110.5
181	D	34.5	Very low	33.1	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	81%	0.805	S	S	*	*			trans	-151.2	137.9	-171.7	-116.7	-38.7	0	0	0	112.3
182	G	28.5	Very low	33.6	Very low	68 Å²	68	140.1 Å²	140.1	70%	0.701	80%	0.798	S	S	*	*			trans	68.9	125.5	144.1	0	0	0	0	0	122.9
183	A	28.8	Very low	33.8	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	79%	0.791	S	S	*	*				68.8	132.3	123.7	0	0	0	0	0	124.1
184	E	28.8	Very low	33	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	79%	0.794	S	S	*	*			trans	67.7	162.3	136	-67.8	-164.3	142.3	0	0	124.7
185	E	28.1	Very low	33.5	Very low	195 Å²	195	138.7 Å²	138.7	91%	0.911	79%	0.787	S	S	*	*			trans	65.4	150.6	174.4	-58.5	-155.8	177.2	0	0	120.1
186	G	25.1	Very low	33.9	Very low	77 Å²	77	141.2 Å²	141.2	79%	0.794	78%	0.783	S	S	*	*			trans	151.2	37.7	171.1	0	0	0	0	0	121.6
187	L	26.3	Very low	32.6	Very low	163 Å²	163	143.5 Å²	143.5	85%	0.853	78%	0.783	S	S	*	*			trans	-17.9	131.3	167.3	-58.3	162.5	0	0	0	118.7
188	T	27.1	Very low	32.5	Very low	152 Å²	152	139.5 Å²	139.5	93%	0.933	78%	0.776	S	S	*	*				172.4	159.8	114.8	33	0	0	0	0	116.3
189	E	33.7	Very low	33.4	Very low	176 Å²	176	137 Å²	137	82%	0.822	77%	0.768	S	S	*	*			trans	-89.9	-169.6	-174.7	-118.4	-161.1	161.4	0	0	113.7
190	P	50.9	Low	32.2	Very low	94 Å²	94	139.3 Å²	139.3	61%	0.61	77%	0.768	S	S	*	*			cis	-139.6	-172.2	-4.8	27.3	-1.7	0	0	0	117.6
191	L	29	Very low	32.3	Very low	147 Å²	147	140.1 Å²	140.1	77%	0.77	77%	0.767	S	S	*	*			trans	98.6	103.8	159.3	-53.5	178.5	0	0	0	115.8
192	K	38.5	Very low	32.1	Very low	173 Å²	173	139.8 Å²	139.8	75%	0.752	76%	0.761	S	S	*	*				79.5	139.3	70.9	-75.9	-170.1	168.2	-153.3	0	113.4
193	E	32.8	Very low	32.1	Very low	147 Å²	147	144.9 Å²	144.9	69%	0.687	77%	0.766	S	S	*	*			cis	-153	146.2	29.3	-144.1	148.8	-126.5	0	0	112
194	D	36.5	Very low	32	Very low	124 Å²	124	145 Å²	145	66%	0.663	77%	0.767	S	S	*	*			trans	39.1	152.9	149.4	-59.1	-14.6	0	0	0	122.7
195	Q	33.7	Very low	32	Very low	152 Å²	152	141.3 Å²	141.3	71%	0.71	77%	0.768	S	S	*	*			cis	-179	161.8	-11	-101.9	164.9	43.8	0	0	104.6
196	D	33.6	Very low	31.9	Very low	125 Å²	125	135.8 Å²	135.8	67%	0.668	76%	0.763	S	S	*	*			cis	-166.5	-178	-13.9	-117.5	38.6	0	0	0	105.8
197	Q	26.7	Very low	32	Very low	169 Å²	169	135 Å²	135	79%	0.79	76%	0.756	S	S	*	*			cis	-157.2	-175.6	9.2	-146	152.7	75.8	0	0	110.2
198	S	26.9	Very low	32.3	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	76%	0.758	S	S	*	*			trans	-156.8	-156.5	169.6	66.4	0	0	0	0	108.3
199	P	52.8	Low	32.4	Very low	99 Å²	99	136.6 Å²	136.6	64%	0.643	75%	0.753	S	S	*	*			cis	-93.9	-138.6	-3.8	42.3	-38	0	0	0	112.5
200	E	26.5	Very low	32.3	Very low	169 Å²	169	131.1 Å²	131.1	79%	0.79	74%	0.744	S	S	*	*			cis	-150.1	157	8.9	-119.7	147.4	-128.1	0	0	106.4
201	E	29.9	Very low	31.2	Very low	175 Å²	175	133 Å²	133	82%	0.818	75%	0.753	S	S	*	*			cis	75.9	135.9	40.1	-76.8	-174.2	-151.4	0	0	116
202	E	29.9	Very low	31.3	Very low	150 Å²	150	131.2 Å²	131.2	70%	0.701	75%	0.754	S	S	*	*			cis	-162.6	-171.7	-17.7	-144.4	-157.2	-169.9	0	0	111.5
203	Q	27.5	Very low	30.8	Very low	174 Å²	174	131 Å²	131	81%	0.813	76%	0.761	S	S	*	*			trans	75.1	173.3	155.2	-81.5	163.5	51.2	0	0	122.2
204	A	26.8	Very low	30.6	Very low	97 Å²	97	128.4 Å²	128.4	80%	0.802	77%	0.765	S	S	*	*			trans	-157.8	174.8	-151	0	0	0	0	0	115.8
205	A	28.9	Very low	30	Very low	108 Å²	108	126 Å²	126	89%	0.893	77%	0.768	S	S	*	*			trans	76.8	139.1	156.9	0	0	0	0	0	122.2
206	G	25.9	Very low	29.8	Very low	79 Å²	79	123.4 Å²	123.4	81%	0.814	77%	0.774	S	S	*	*			trans	112.7	122	139.1	0	0	0	0	0	119.9
207	G	28.6	Very low	29.4	Very low	62 Å²	62	127.3 Å²	127.3	64%	0.639	78%	0.784	S	S	*	*			trans	72.6	125.4	166.7	0	0	0	0	0	116
208	E	31.1	Very low	29.4	Very low	193 Å²	193	123.4 Å²	123.4	90%	0.902	78%	0.781	S	S	*	*			cis	66.2	132.4	49.4	98.6	-159.9	127.3	0	0	113.3
209	D	29.9	Very low	29.5	Very low	154 Å²	154	123.5 Å²	123.5	82%	0.824	78%	0.782	S	S	*	*			cis	-149	175.1	27.7	-169.5	2	0	0	0	111.4
210	G	30.9	Very low	28.2	Very low	62 Å²	62	124.2 Å²	124.2	64%	0.639	79%	0.789	S	S	*	*			trans	139.8	62.4	160.4	0	0	0	0	0	121.5
211	V	29.6	Very low	28.2	Very low	132 Å²	132	120.4 Å²	120.4	80%	0.8	79%	0.787	S	S	*	*			trans	31	116	138.7	-176.4	0	0	0	0	120.2
212	S	30.5	Very low	28	Very low	111 Å²	111	116.6 Å²	116.6	78%	0.776	79%	0.785	S	S	*	*				178.8	110.2	108.6	40.6	0	0	0	0	117.3
213	N	28.4	Very low	27.9	Very low	168 Å²	168	114.9 Å²	114.9	90%	0.898	79%	0.79	S	S	*	*			trans	58.4	144.2	137.1	-147.9	11	0	0	0	123.1
214	A	27.2	Very low	28.1	Very low	93 Å²	93	110.8 Å²	110.8	77%	0.769	79%	0.785	S	S	*	*			trans	-95.9	172.2	-178.2	0	0	0	0	0	113.8
215	G	25.6	Very low	28.1	Very low	72 Å²	72	114.4 Å²	114.4	74%	0.742	79%	0.792	S	S	*	*			trans	166.4	121.9	158.5	0	0	0	0	0	117.3
216	A	28.3	Very low	28.1	Very low	99 Å²	99	112.3 Å²	112.3	82%	0.818	78%	0.78	S	S	*	*			trans	49.8	123.4	161.6	0	0	0	0	0	119.3
217	K	25.5	Very low	28.4	Very low	206 Å²	206	116.7 Å²	116.7	90%	0.896	79%	0.785	S	S	*	*				63.9	127.9	60.6	-79.4	-169.9	172.1	177	0	116.9
218	A	26.6	Very low	28.4	Very low	88 Å²	88	121 Å²	121	73%	0.727	79%	0.794	S	S	*	*			trans	96.1	94.5	141.1	0	0	0	0	0	120.3
219	S	28.4	Very low	28.7	Very low	102 Å²	102	115.6 Å²	115.6	71%	0.713	78%	0.781	S	S	*	*				66.4	131.1	120.2	64.5	0	0	0	0	122.8
220	S	26.1	Very low	28.8	Very low	115 Å²	115	117 Å²	117	80%	0.804	78%	0.78	S	S	*	*			trans	68.3	155.4	143.1	65.2	0	0	0	0	119
221	A	26.5	Very low	28.8	Very low	89 Å²	89	120.3 Å²	120.3	74%	0.736	78%	0.779	S	S	*	*			cis	-173.7	161.5	-27	0	0	0	0	0	107.8
222	A	26.7	Very low	28.8	Very low	95 Å²	95	120.6 Å²	120.6	79%	0.785	78%	0.781	S	S	*	*			trans	65.3	156.3	171.5	0	0	0	0	0	115.6
223	S	26.7	Very low	28.8	Very low	114 Å²	114	119 Å²	119	80%	0.797	78%	0.782	S	S	*	*			cis	-164.8	157.4	-19.5	-100.8	0	0	0	0	110.1
224	A	32.4	Very low	28.7	Very low	87 Å²	87	118 Å²	118	72%	0.719	78%	0.777	S	S	*	*			trans	55.5	120.9	150.6	0	0	0	0	0	121
225	D	26.6	Very low	28.8	Very low	174 Å²	174	119.1 Å²	119.1	93%	0.93	77%	0.774	S	S	*	*			trans	179.5	156	132.5	-85.6	-26.1	0	0	0	106.5
226	G	29.6	Very low	29	Very low	64 Å²	64	122 Å²	122	66%	0.66	77%	0.773	S	S	*	*			cis	159	127.6	-4.5	0	0	0	0	0	111.2
227	D	30.6	Very low	28.8	Very low	171 Å²	171	122.8 Å²	122.8	91%	0.914	77%	0.767	S	S	*	*			trans	104.3	146.7	158.1	-63.8	-35.7	0	0	0	124.8
228	D	30.2	Very low	29.1	Very low	153 Å²	153	119 Å²	119	82%	0.818	76%	0.761	S	S	*	*			trans	71.4	85.7	154.8	-110.7	-123.1	0	0	0	126.1
229	A	35.4	Very low	29.9	Very low	78 Å²	78	120 Å²	120	65%	0.645	76%	0.761	S	S	*	*				79.8	147.8	106.7	0	0	0	0	0	125.6
230	K	33.3	Very low	29.8	Very low	184 Å²	184	123.1 Å²	123.1	80%	0.8	76%	0.764	S	S	*	*			trans	73	145.7	161.8	-75.3	-176.3	169.4	-83.4	0	120.1
231	E	30.6	Very low	30	Very low	131 Å²	131	125.4 Å²	125.4	61%	0.612	76%	0.761	S	S	*	*			cis	-167.9	148.9	-25.7	-150.3	-179.5	139.9	0	0	110.9
232	T	29.6	Very low	30	Very low	138 Å²	138	126.1 Å²	126.1	85%	0.847	76%	0.757	S	S	*	*			trans	63.7	159.6	171.6	73.1	0	0	0	0	116.4
233	G	29.8	Very low	30.3	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	76%	0.756	S	S	*	*			cis	-173.8	154.7	-4.7	0	0	0	0	0	110.7
234	D	26.1	Very low	30.5	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	75%	0.753	S	S	*	*			trans	-90.2	163	-171	-175.6	-109.8	0	0	0	114.8
235	V	30.6	Very low	30.7	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.715	76%	0.756	S	S	*	*			trans	151.2	108.4	137.1	167.2	0	0	0	0	114.8
236	N	28.7	Very low	31.2	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	75%	0.753	S	S	*	*			trans	44.1	121.2	141.8	-67.2	-37.3	0	0	0	125.7
237	T	24.7	Very low	31.3	Very low	115 Å²	115	136.4 Å²	136.4	71%	0.706	77%	0.765	S	S	*	*				85.2	107.1	119.8	-56.9	0	0	0	0	123.5
238	V	32.2	Very low	31.6	Very low	127 Å²	127	137.3 Å²	137.3	77%	0.77	76%	0.76	S	S	*	*				43.3	125.5	127.4	-170.7	0	0	0	0	118.6
239	P	43.3	Very low	31.5	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	76%	0.76	S	S	*	*				-159.6	-171.3	71.3	46.9	-26	0	0	0	119.8
240	E	25.8	Very low	31.8	Very low	166 Å²	166	137.8 Å²	137.8	78%	0.776	76%	0.759	S	S	*	*			trans	68.8	126.1	160.7	-59.4	-159.7	164.7	0	0	120.2
241	E	30.7	Very low	31.6	Very low	163 Å²	163	137.5 Å²	137.5	76%	0.762	76%	0.76	S	S	*	*				75	150.5	85.5	-53.2	-148.6	167.6	0	0	114.1
242	T	27.1	Very low	31.5	Very low	104 Å²	104	134.7 Å²	134.7	64%	0.638	76%	0.76	S	S	*	*			cis	-159.4	153.3	35.7	39.7	0	0	0	0	112.3
243	L	32.4	Very low	31.4	Very low	148 Å²	148	134.6 Å²	134.6	78%	0.775	76%	0.759	S	S	*	*			trans	49.6	160.8	138.1	-58	174	0	0	0	121.3
244	D	30.3	Very low	31.4	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	75%	0.754	S	S	*	*			cis	-143.8	176	2.1	-101.9	-48.6	0	0	0	107.1
245	S	36.3	Very low	31.5	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	76%	0.757	S	S	*	*			cis	-153.2	153.2	20.5	-36.2	0	0	0	0	112
246	E	37.5	Very low	31.5	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.874	76%	0.755	S	S	*	*			trans	-124.6	144.9	152.3	-79.2	-164.4	112.9	0	0	110.2
247	N	31.9	Very low	31.7	Very low	169 Å²	169	136.8 Å²	136.8	90%	0.904	76%	0.762	S	S	*	*			trans	-96.6	146.5	176.8	-166.4	16	0	0	0	111.9
248	K	38.1	Very low	32	Very low	190 Å²	190	141.2 Å²	141.2	83%	0.826	78%	0.775	S	S	*	*			trans	-110.9	153.6	-162.4	-63.1	167.8	-176.8	167.7	0	112.7
249	N	26.8	Very low	31.6	Very low	152 Å²	152	139.1 Å²	139.1	81%	0.813	78%	0.779	S	S	*	*			trans	-139.6	146.1	144.9	-161.6	7.3	0	0	0	111.6
250	S	42	Very low	30.7	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	78%	0.779	S	S	*	*			trans	-51.3	165.5	-178.5	-29.3	0	0	0	0	115.3
251	Q	29.7	Very low	30.6	Very low	179 Å²	179	135.6 Å²	135.6	84%	0.836	79%	0.786	S	S	*	*			cis	-161.7	126.6	12.3	-150.8	167.7	-80.1	0	0	114.5
252	A	28.2	Very low	30.4	Very low	72 Å²	72	131.4 Å²	131.4	60%	0.595	79%	0.787	S	S	*	*			trans	56.9	132.6	136.8	0	0	0	0	0	125.5
253	V	27.7	Very low	30.4	Very low	136 Å²	136	135.1 Å²	135.1	82%	0.824	80%	0.797	S	S	*	*			trans	67.8	141.4	138.6	-61	0	0	0	0	121.8
254	S	29.8	Very low	30.2	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	80%	0.795	S	S	*	*			cis	-166.6	150.2	-6.3	-110.3	0	0	0	0	115.8
255	V	26.8	Very low	30.1	Very low	140 Å²	140	132.1 Å²	132.1	85%	0.848	79%	0.794	S	S	*	*			trans	72.6	162.9	143	176.6	0	0	0	0	118.7
256	S	32.5	Very low	29.7	Very low	96 Å²	96	133.5 Å²	133.5	67%	0.671	79%	0.792	S	S	*	*			trans	-131.5	167.8	-147.4	50.3	0	0	0	0	115.4
257	E	33	Very low	29.5	Very low	184 Å²	184	129.2 Å²	129.2	86%	0.86	78%	0.783	S	S	*	*			trans	34.5	114.2	155.1	-65.7	-174.8	107.8	0	0	121.3
258	Q	29.2	Very low	29.4	Very low	208 Å²	208	127.9 Å²	127.9	97%	0.972	77%	0.772	S	S	*	*				-157.8	161.1	126.5	-112.9	173.4	1.4	0	0	109.7
259	G	24.8	Very low	28.9	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	77%	0.769	S	S	*	*			trans	-132.3	173.2	-175.6	0	0	0	0	0	114.1
260	G	24.3	Very low	28.9	Very low	68 Å²	68	123 Å²	123	70%	0.701	76%	0.761	S	S	*	*			trans	146.2	119.5	165.2	0	0	0	0	0	117.2
261	S	23.9	Very low	28.3	Very low	133 Å²	133	124.7 Å²	124.7	93%	0.93	77%	0.773	S	S	*	*			trans	62.8	150.3	146.4	60.1	0	0	0	0	122.5
262	G	26.3	Very low	28.3	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	77%	0.771	S	S	*	*			trans	100.9	105.8	175.4	0	0	0	0	0	112.2
263	E	26.1	Very low	28.2	Very low	183 Å²	183	130.7 Å²	130.7	86%	0.855	78%	0.783	S	S	*	*			cis	82.8	96.3	22	-158.6	176.9	123.9	0	0	116.8
264	S	29.3	Very low	28.1	Very low	105 Å²	105	127.8 Å²	127.8	73%	0.734	78%	0.781	S	S	*	*			trans	-157.3	125.7	144.6	45.1	0	0	0	0	107.6
265	V	29.1	Very low	28.1	Very low	117 Å²	117	129.9 Å²	129.9	71%	0.709	78%	0.78	S	S	*	*				60.4	125.6	61.9	-45.1	0	0	0	0	113.2
266	D	27	Very low	28.2	Very low	138 Å²	138	131.1 Å²	131.1	74%	0.738	77%	0.774	S	S	*	*			cis	-157.8	151.5	-1.6	-152.7	-121.3	0	0	0	113.5
267	S	34	Very low	28.1	Very low	98 Å²	98	133 Å²	133	69%	0.685	78%	0.776	S	S	*	*			trans	43.9	175.9	148.6	-61.7	0	0	0	0	121.5
268	E	28.8	Very low	28	Very low	141 Å²	141	131.2 Å²	131.2	66%	0.659	77%	0.768	S	S	*	*			cis	-138.9	138.2	8.4	-111.1	-154.7	140.4	0	0	111.8
269	K	28	Very low	28.1	Very low	176 Å²	176	128.8 Å²	128.8	77%	0.765	75%	0.754	S	S	*	*				37.9	132.6	117.9	175.8	-159.9	-171.8	-171.4	0	119
270	G	26.2	Very low	28.2	Very low	64 Å²	64	130.6 Å²	130.6	66%	0.66	75%	0.749	S	S	*	*			cis	144.5	173.5	0.4	0	0	0	0	0	112.9
271	S	30.6	Very low	28.6	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	75%	0.752	S	S	*	*			trans	69.6	164.8	170.5	-68.4	0	0	0	0	119.3
272	K	29.1	Very low	29	Very low	183 Å²	183	134.5 Å²	134.5	80%	0.796	75%	0.747	S	S	*	*			cis	-177.1	150.5	-35.5	-163.2	170.2	-172.4	171	0	109.8
273	K	26	Very low	29	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	75%	0.749	S	S	*	*			trans	67.7	155.6	-179.6	-63.5	-174.8	171.4	-171.5	0	113.9
274	G	25.5	Very low	29	Very low	76 Å²	76	135.6 Å²	135.6	78%	0.784	75%	0.745	S	S	*	*			cis	113.4	153.2	15.3	0	0	0	0	0	109.9
275	E	29.8	Very low	28.8	Very low	143 Å²	143	135 Å²	135	67%	0.668	75%	0.747	S	S	*	*			cis	-173.2	161.2	7.9	-173.6	-173	121.9	0	0	107.3
276	K	28.6	Very low	28.8	Very low	166 Å²	166	134 Å²	134	72%	0.722	75%	0.751	S	S	*	*			trans	67	161.9	165.9	-83.1	159.2	175	141.5	0	118.3
277	D	31.4	Very low	28.6	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	75%	0.753	S	S	*	*			cis	-167.3	170.5	-35.9	-133	-50.1	0	0	0	110.1
278	E	30.4	Very low	28.6	Very low	147 Å²	147	134 Å²	134	69%	0.687	75%	0.749	S	S	*	*			trans	60.4	161.4	165.5	-73.1	-153.2	133.7	0	0	118
279	K	30.8	Very low	28.5	Very low	157 Å²	157	132.8 Å²	132.8	68%	0.683	75%	0.752	S	S	*	*			cis	-174.3	-177.7	-25.9	-175.7	162.1	177.5	-176.9	0	109
280	T	28.1	Very low	28.6	Very low	123 Å²	123	129.2 Å²	129.2	76%	0.755	75%	0.749	S	S	*	*			trans	72.6	121.1	-179.4	68.5	0	0	0	0	113.4
281	V	32.4	Very low	28.6	Very low	126 Å²	126	130.5 Å²	130.5	76%	0.764	75%	0.754	S	S	*	*				68.8	101.2	56.9	-180	0	0	0	0	111.5
282	D	30.5	Very low	28.7	Very low	156 Å²	156	131.4 Å²	131.4	83%	0.834	75%	0.748	S	S	*	*				-162.2	-169.9	101.2	-132.4	-49.8	0	0	0	113.3
283	K	27.7	Very low	28.9	Very low	189 Å²	189	130.2 Å²	130.2	82%	0.822	74%	0.743	S	S	*	*			trans	-123.9	163.5	-163.4	171.6	-178	173.3	-176.1	0	112.6
284	A	26	Very low	28.8	Very low	93 Å²	93	127.9 Å²	127.9	77%	0.769	74%	0.735	S	S	*	*			trans	71.6	161.2	169.4	0	0	0	0	0	115.4
285	A	24.4	Very low	29.1	Very low	93 Å²	93	129.4 Å²	129.4	77%	0.769	73%	0.734	S	S	*	*			cis	-165.9	-177.5	-26.3	0	0	0	0	0	108.7
286	A	29.1	Very low	29.1	Very low	96 Å²	96	127.8 Å²	127.8	79%	0.793	74%	0.738	S	S	*	*			trans	67.7	124.3	-172.4	0	0	0	0	0	113.4
287	D	23.3	Very low	29	Very low	146 Å²	146	125.2 Å²	125.2	78%	0.781	74%	0.741	S	S	*	*			cis	85.2	135	38.3	-167.4	12.4	0	0	0	113.1
288	S	33	Very low	28.9	Very low	88 Å²	88	124.8 Å²	124.8	62%	0.615	74%	0.743	S	S	*	*			trans	68.8	139.4	165.8	-66	0	0	0	0	117.9
289	T	27.7	Very low	28.8	Very low	117 Å²	117	126.9 Å²	126.9	72%	0.718	75%	0.753	S	S	*	*			cis	-165.5	169.6	-15.4	18.7	0	0	0	0	108.2
290	S	29.2	Very low	28.7	Very low	101 Å²	101	123 Å²	123	71%	0.706	76%	0.757	S	S	*	*			trans	51.3	112.2	149	58.4	0	0	0	0	118.3
291	A	27.9	Very low	28.6	Very low	91 Å²	91	124.7 Å²	124.7	75%	0.752	76%	0.762	S	S	*	*				70.1	150.3	85.1	0	0	0	0	0	113.4
292	L	32.5	Very low	28.7	Very low	142 Å²	142	125.3 Å²	125.3	74%	0.743	76%	0.76	S	S	*	*			cis	-165.8	173.6	33.1	-141.8	150.5	0	0	0	109.1
293	K	31.9	Very low	28.9	Very low	157 Å²	157	126.5 Å²	126.5	68%	0.683	76%	0.761	S	S	*	*			trans	80.2	123.4	165.8	-60.4	-157.5	169.2	-67.3	0	115.8
294	E	25.2	Very low	29	Very low	145 Å²	145	124.4 Å²	124.4	68%	0.678	76%	0.759	S	S	*	*				75.9	144.4	60.4	-71.3	173.2	149.4	0	0	113.1
295	S	30.9	Very low	29.3	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	76%	0.761	S	S	*	*			cis	-173	149.1	-16.8	51	0	0	0	0	110.9
296	S	30.4	Very low	29.5	Very low	110 Å²	110	129.2 Å²	129.2	77%	0.769	76%	0.758	S	S	*	*			trans	-163.8	115.2	155.3	53.8	0	0	0	0	108.3
297	S	25.8	Very low	29.6	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	76%	0.759	S	S	*	*				72.6	128.8	59.4	-167.5	0	0	0	0	111.6
298	V	29.8	Very low	29.8	Very low	125 Å²	125	132 Å²	132	76%	0.758	76%	0.763	S	S	*	*			cis	161.8	169.5	-16.5	140.1	0	0	0	0	104.5
299	E	28.6	Very low	29.8	Very low	191 Å²	191	135.1 Å²	135.1	89%	0.893	77%	0.768	S	S	*	*			trans	79	142	-177.2	-43.4	-163.7	152.7	0	0	115.3
300	G	27.4	Very low	30.1	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	77%	0.765	S	S	*	*			cis	169.7	175.7	-8.3	0	0	0	0	0	115.6
301	D	28	Very low	30	Very low	160 Å²	160	139.2 Å²	139.2	86%	0.856	77%	0.77	S	S	*	*			trans	79.6	142.4	165.3	-129.9	-124.7	0	0	0	121.5
302	D	32.6	Very low	30.1	Very low	138 Å²	138	138.2 Å²	138.2	74%	0.738	77%	0.768	S	S	*	*			trans	-81.3	173.6	-173.1	-87	-106	0	0	0	114.5
303	Q	34.8	Very low	29.9	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	77%	0.77	S	S	*	*				-176.3	86.8	118.4	-80.5	-115.1	-6.2	0	0	113.2
304	N	29.8	Very low	30	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	78%	0.778	S	S	*	*			trans	31.1	156	132.6	-146.7	-10.6	0	0	0	123.9
305	K	32.4	Very low	30.3	Very low	187 Å²	187	140.3 Å²	140.3	81%	0.813	78%	0.784	S	S	*	*			trans	83.4	147	169.5	-69.8	-167.8	174.6	-175.6	0	119.2
306	S	29.7	Very low	30.6	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	79%	0.786	S	S	*	*			cis	-177.4	136.6	-22.7	52	0	0	0	0	112.3
307	S	30.6	Very low	30.7	Very low	117 Å²	117	145.9 Å²	145.9	82%	0.818	79%	0.792	S	S	*	*			trans	-177.5	134.9	150.3	54.4	0	0	0	0	113.6
308	E	28.7	Very low	31.3	Very low	184 Å²	184	147.9 Å²	147.9	86%	0.86	79%	0.793	S	S	*	*			trans	-80.1	173.5	161.2	-66.3	124.3	112.8	0	0	110.9
309	E	32.4	Very low	31.8	Very low	153 Å²	153	150.1 Å²	150.1	72%	0.715	80%	0.796	S	S	*	*			cis	-136.8	176.7	24.9	-76	-145.2	100.8	0	0	114.7
310	K	32.9	Very low	32.2	Very low	154 Å²	154	150.4 Å²	150.4	67%	0.67	79%	0.794	S	S	*	*			trans	10	152.2	147.8	-57.5	-169	-165.9	87.9	0	120.4
311	D	28.5	Very low	32.9	Very low	149 Å²	149	151.4 Å²	151.4	80%	0.797	80%	0.795	S	S	*	*			cis	-145.3	-176.4	28.3	-139.6	-60.9	0	0	0	114.5
312	G	28.6	Very low	33.7	Very low	70 Å²	70	148 Å²	148	72%	0.722	78%	0.784	S	S	*	*			trans	-69.5	130.3	-155.9	0	0	0	0	0	117.7
313	K	29.7	Very low	35	Very low	182 Å²	182	145.2 Å²	145.2	79%	0.791	78%	0.775	S	S	*	*			trans	-92.8	134.2	163.3	-173.5	-179.7	179.2	-173.2	0	110.3	E315	K313-E315 PolarHBondContact O-N 3.22Å
314	T	34.2	Very low	36.8	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	74%	0.74	S	S	*	*			trans	-71.7	110.9	178.4	33.4	0	0	0	0	112.2
315	E	31.4	Very low	39.7	Very low	169 Å²	169	136.4 Å²	136.4	79%	0.79	73%	0.726	S	S	*	*			trans	-106	111.2	170.1	-64.1	-157.8	152.8	0	0	111.6	K313 K317	K313-E315 PolarHBondContact O-N 3.22Å; E315-K317 PolarHBondContact O-N 3.25Å
316	T	35.8	Very low	42.5	Very low	131 Å²	131	129.9 Å²	129.9	80%	0.804	70%	0.7	S	S	*	*			trans	-65.8	121.4	176.2	46.7	0	0	0	0	111.5
317	K	33.8	Very low	45.5	Very low	203 Å²	203	125.1 Å²	125.1	88%	0.883	67%	0.666	S	S	*	*			trans	-114.2	43.2	-174.9	-153.4	169.1	-174.4	167.8	0	114.9	E315	E315-K317 PolarHBondContact O-N 3.25Å
318	D	38.3	Very low	48.5	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	64%	0.641	S	S	*	*			trans	-101.9	23.8	168.5	-101.3	-56.8	0	0	0	112.9	K320	D318-K320 PolarHBondContact O-N 3.2Å
319	E	39.6	Very low	51.5	Low	173 Å²	173	114.4 Å²	114.4	81%	0.808	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	51.4	-179.6	-93.1	-68.1	114.7	0	0	114.1
320	K	37.7	Very low	54.4	Low	196 Å²	196	108 Å²	108	85%	0.852	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155	37.1	151.8	-131.8	157.1	-167.4	155.9	0	116.6	D318 S322	D318-K320 PolarHBondContact O-N 3.2Å; K320-S322 PolarHBondContact O-N 3.05Å
321	A	42	Very low	57	Low	95 Å²	95	101.9 Å²	101.9	79%	0.785	55%	0.552	S	S	*	*			trans	-64.1	76.3	159.1	0	0	0	0	0	110.7	S323	A321-S323 PolarHBondContact O-N 2.74Å
322	S	43.8	Very low	60	Low	90 Å²	90	94.9 Å²	94.9	63%	0.629	52%	0.515	S	S	*	.			trans	-45.9	128.1	-175.8	-177.1	0	0	0	0	111.1	K320 S324	K320-S322 PolarHBondContact O-N 3.05Å; S322-S324 PolarHBondContact O-N 3.18Å
323	S	61.2	Low	62.9	Low	78 Å²	78	91.9 Å²	91.9	55%	0.545	48%	0.483	S	S	.	.			trans	-71.5	64.7	-170.8	51	0	0	0	0	111.9	A321 R325 S376	A321-S323 PolarHBondContact O-N 2.74Å; S323-R325 PolarHBondContact O-N 2.92Å; S323-S376 WeakPolarHBondContact O-CB 3.34Å
324	S	72.6	Confident	65.5	Low	15 Å²	15	85.9 Å²	85.9	11%	0.105	46%	0.464	C	S	.	.			trans	-68.8	118.4	-168.6	60.3	0	0	0	0	111.2	S322 N326	S322-S324 PolarHBondContact O-N 3.18Å; S324-N326 PolarHBondContact O-N 2.7Å
325	R	89.4	Confident	68	Low	127 Å²	127	83.4 Å²	83.4	48%	0.479	45%	0.448	S	S	.	.			trans	-69	-4.5	171.5	-53.6	-169.7	-78.5	165.2	-2	113.3	S323 T372 M373 S374	S323-R325 PolarHBondContact O-N 2.92Å; R325-T372 CarbonylContact O-C 3.57Å; R325-T372 WeakPolarHBondContact O-CA 3.24Å; R325-M373 PolarHBondContact O-N 2.86Å; R325-S374 WeakPolarHBondContact CD-O 3.23Å; R325-S374 PolarHBondContact NH1-O 2.99Å
326	N	91.9	Very high	70.7	Confident	50 Å²	50	75.7 Å²	75.7	27%	0.267	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.1	-178.4	-68.6	-27.1	0	0	0	109.6	S324 T372 A401 N403	S324-N326 PolarHBondContact O-N 2.7Å; N326-T372 WeakPolarHBondContact OD1-CB 3.28Å; N326-T372 WeakPolarHBondContact OD1-CG2 3.33Å; N326-T372 PolarHBondContact OD1-OG1 3.4Å; N326-A401 HydrophobicContact CB-CB 3.78Å; N326-A401 VanDerWaalsContact O-CB 3.27Å; N326-A401 WeakPolarHBondContact O-CB 3.46Å; N326-A401 PolarHBondContact O-N 2.72Å; N326-N403 PolarHBondContact ND2-OD1 2.64Å
327	L	92.4	Very high	73.3	Confident	0 Å²	0	78 Å²	78	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.2	177.2	-60.2	179.2	0	0	0	109.4	F345 F370 V371 M373 A379 C382 I383 V398 E399	L327-F345 HydrophobicContact CD1-CD1 4.04Å; L327-F345 HydrophobicContact CD1-CE1 3.67Å; L327-F370 WeakPolarHBondContact O-CA 3.23Å; L327-V371 HydrophobicContact CB-CB 4.39Å; L327-V371 PolarHBondContact N-O 2.99Å; L327-V371 PolarHBondContact O-N 3.12Å; L327-M373 HydrophobicContact CD1-CG 3.95Å; L327-A379 HydrophobicContact CD1-CB 4.19Å; L327-A379 HydrophobicContact CD2-CB 3.98Å; L327-A379 HydrophobicContact CG-CB 4.14Å; L327-C382 HydrophobicContact CD1-CB 3.57Å; L327-I383 HydrophobicContact CD2-CD1 3.54Å; L327-I383 HydrophobicContact CD2-CG1 3.64Å; L327-V398 HydrophobicContact CB-CG1 4.21Å; L327-V398 HydrophobicContact CD1-CG1 4.08Å; L327-V398 HydrophobicContact CD2-CG1 4.49Å; L327-E399 WeakPolarHBondContact CA-O 3.17Å
328	W	93.1	Very high	76	Confident	77 Å²	77	70.1 Å²	70.1	29%	0.292	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.5	167.6	-180	54.8	0	0	0	108.6	F368 F370 V398 E399 A401	W328-F368 AromaticContact CE2-CD1 3.94Å; W328-F368 AromaticContact CZ2-CD1 3.59Å; W328-F368 HydrophobicContact CZ2-CD1 3.59Å; W328-F368 AromaticContact CZ2-CE1 3.71Å; W328-F368 HydrophobicContact CZ2-CE1 3.71Å; W328-F368 AromaticContact NE1-CD1 3.8Å; W328-F370 HydrophobicContact CB-CE1 4.5Å; W328-F370 AromaticContact CD1-CE1 3.6Å; W328-F370 AromaticContact CD1-CZ 3.83Å; W328-F370 HydrophobicContact CG-CE1 4.33Å; W328-V398 WeakPolarHBondContact O-CA 3.49Å; W328-E399 HydrophobicContact CE3-CB 4.17Å; W328-E399 WeakPolarHBondContact CZ3-OE2 3.27Å; W328-E399 PolarHBondContact N-O 3.08Å; W328-E399 PolarHBondContact O-N 3.37Å; W328-A401 HydrophobicContact CB-CB 4.33Å
329	V	93.1	Very high	78.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116.4	-179.7	-170.3	0	0	0	0	108.3	L332 L341 F345 F368 G369 V371 I396 F397 V398	V329-L332 HydrophobicContact CB-CD1 4.38Å; V329-L332 HydrophobicContact CG1-CD1 4.18Å; V329-L332 HydrophobicContact CG1-CD2 4.08Å; V329-L332 HydrophobicContact CG1-CG 4.11Å; V329-L341 HydrophobicContact CG1-CD2 4.12Å; V329-F345 HydrophobicContact CG2-CE1 4.33Å; V329-F345 HydrophobicContact CG2-CE2 4.22Å; V329-F345 HydrophobicContact CG2-CZ 3.59Å; V329-F368 CarbonylContact O-C 3.53Å; V329-F368 WeakPolarHBondContact O-CA 3.47Å; V329-G369 PolarHBondContact N-O 3.08Å; V329-G369 PolarHBondContact O-N 3.19Å; V329-V371 HydrophobicContact CG2-CG2 3.92Å; V329-I396 HydrophobicContact CG1-CB 4.18Å; V329-I396 HydrophobicContact CG1-CD1 4.01Å; V329-F397 WeakPolarHBondContact CA-O 3.44Å; V329-V398 HydrophobicContact CG1-CG2 4.46Å
330	S	91.7	Very high	81.1	Confident	19 Å²	19	61 Å²	61	13%	0.133	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	172.3	175	70.9	0	0	0	0	111.1	L332 I396 F397	S330-L332 VanDerWaalsContact C-N 3.32Å; S330-L332 PolarHBondContact O-N 3.21Å; S330-I396 CarbonylContact O-C 3.54Å; S330-I396 VanDerWaalsContact O-CA 3.29Å; S330-I396 WeakPolarHBondContact O-CA 3.29Å; S330-F397 PolarHBondContact N-O 2.74Å; S330-F397 PolarHBondContact O-N 2.92Å
331	G	88.7	Confident	83.6	Confident	24 Å²	24	51.7 Å²	51.7	25%	0.247	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	82.6	0.4	-177.6	0	0	0	0	0	115.4	K394	G331-K394 WeakPolarHBondContact O-CB 3.29Å
332	L	91	Very high	86	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	145.6	-176.3	-66.2	164.2	0	0	0	113	V329 S330 L341 C367 L391 I396	V329-L332 HydrophobicContact CB-CD1 4.38Å; V329-L332 HydrophobicContact CG1-CD1 4.18Å; V329-L332 HydrophobicContact CG1-CD2 4.08Å; V329-L332 HydrophobicContact CG1-CG 4.11Å; S330-L332 VanDerWaalsContact C-N 3.32Å; S330-L332 PolarHBondContact O-N 3.21Å; L332-L341 HydrophobicContact CD1-CD1 3.97Å; L332-L341 HydrophobicContact CD2-CD1 4.48Å; L332-L341 HydrophobicContact CD2-CD2 3.79Å; L332-L341 HydrophobicContact CD2-CG 4.27Å; L332-C367 HydrophobicContact CB-CB 4.11Å; L332-L391 HydrophobicContact CD2-CD1 4.23Å; L332-I396 HydrophobicContact CD2-CG2 3.61Å; L332-I396 HydrophobicContact CG-CG2 4.22Å
333	S	88.7	Confident	88.3	Confident	7 Å²	7	51.2 Å²	51.2	5%	0.049	28%	0.281	C	S	.	.			trans	-70.1	156.1	171	-166.2	0	0	0	0	111.2	T335 S336 K394	S333-T335 WeakPolarHBondContact CB-OG1 3.46Å; S333-T335 PolarHBondContact O-N 3.07Å; S333-T335 PolarHBondContact OG-OG1 3.02Å; S333-T335 VanDerWaalsContact OG-OG1 3.05Å; S333-S336 WeakPolarHBondContact CB-OG 3.41Å; S333-S336 PolarHBondContact N-OG 3.1Å; S333-S336 VanDerWaalsContact N-OG 3.11Å; S333-S336 WeakPolarHBondContact O-CB 3.45Å; S333-S336 PolarHBondContact O-N 3.35Å; S333-S336 PolarHBondContact O-OG 3.22Å; S333-K394 WeakPolarHBondContact OG-CE 3.43Å
334	S	85.6	Confident	89.7	Confident	56 Å²	56	49.4 Å²	49.4	39%	0.392	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.4	169.5	42.3	0	0	0	0	112.2	P363	S334-P363 WeakPolarHBondContact CB-O 3.49Å
335	T	86.7	Confident	90.6	Very high	85 Å²	85	48.8 Å²	48.8	52%	0.521	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.8	172.3	53.6	0	0	0	0	114.1	S333 R337	S333-T335 WeakPolarHBondContact CB-OG1 3.46Å; S333-T335 PolarHBondContact O-N 3.07Å; S333-T335 PolarHBondContact OG-OG1 3.02Å; S333-T335 VanDerWaalsContact OG-OG1 3.05Å; T335-R337 WeakPolarHBondContact O-CG 3.49Å; T335-R337 PolarHBondContact O-N 2.8Å
336	S	88	Confident	90.8	Very high	7 Å²	7	45.7 Å²	45.7	5%	0.049	26%	0.258	C	S	.	.			trans	-70.2	112.8	-176.3	-61.3	0	0	0	0	111.6	S333	S333-S336 WeakPolarHBondContact CB-OG 3.41Å; S333-S336 PolarHBondContact N-OG 3.1Å; S333-S336 VanDerWaalsContact N-OG 3.11Å; S333-S336 WeakPolarHBondContact O-CB 3.45Å; S333-S336 PolarHBondContact O-N 3.35Å; S333-S336 PolarHBondContact O-OG 3.22Å
337	R	90	Very high	90.7	Very high	180 Å²	180	50.9 Å²	50.9	68%	0.679	28%	0.278	S	S	*	.			trans	-95.6	163.4	179.5	-52.7	-176.7	86	173.9	4.9	111.4	T335 T339 D340 L341	T335-R337 WeakPolarHBondContact O-CG 3.49Å; T335-R337 PolarHBondContact O-N 2.8Å; R337-T339 WeakPolarHBondContact CB-OG1 3.46Å; R337-T339 PolarHBondContact O-N 2.87Å; R337-D340 PolarHBondContact N-OD2 3.29Å; R337-D340 PolarHBondContact O-N 2.85Å; R337-D340 VanDerWaalsContact O-N 3.11Å; R337-L341 PolarHBondContact O-N 2.74Å
338	A	90.8	Very high	90.5	Very high	38 Å²	38	53.5 Å²	53.5	31%	0.314	29%	0.29	S	S	.	.	H	α-helix	trans	-63.2	-25.4	177.2	0	0	0	0	0	113.1	K342 V354 V356	A338-K342 WeakPolarHBondContact O-CB 3.34Å; A338-K342 PolarHBondContact O-N 3.15Å; A338-V354 HydrophobicContact CB-CB 4.23Å; A338-V354 HydrophobicContact CB-CG1 3.81Å; A338-V356 HydrophobicContact CB-CG2 3.99Å
339	T	92.4	Very high	90.2	Very high	93 Å²	93	50.4 Å²	50.4	57%	0.571	28%	0.283	S	S	*	.	H	α-helix	trans	-60.1	-45.8	170.7	38.2	0	0	0	0	112.2	R337 K342 A343	R337-T339 WeakPolarHBondContact CB-OG1 3.46Å; R337-T339 PolarHBondContact O-N 2.87Å; T339-K342 WeakPolarHBondContact O-CB 3.49Å; T339-K342 PolarHBondContact O-N 3.2Å; T339-A343 PolarHBondContact O-N 3.35Å
340	D	91.6	Very high	90.2	Very high	40 Å²	40	57.9 Å²	57.9	21%	0.214	32%	0.315	C	S	.	.	H	α-helix	trans	-70.4	-49.7	-170.9	-37.4	-8.8	0	0	0	108.5	R337 K342 A343 L344 H392	R337-D340 PolarHBondContact N-OD2 3.29Å; R337-D340 PolarHBondContact O-N 2.85Å; R337-D340 VanDerWaalsContact O-N 3.11Å; D340-K342 VanDerWaalsContact C-N 3.29Å; D340-K342 PolarHBondContact O-N 3.06Å; D340-A343 PolarHBondContact O-N 2.76Å; D340-A343 VanDerWaalsContact O-N 3.15Å; D340-L344 VanDerWaalsContact O-CD1 3.24Å; D340-L344 WeakPolarHBondContact O-CD1 3.16Å; D340-L344 VanDerWaalsContact O-CG 3.28Å; D340-L344 WeakPolarHBondContact O-CG 3.31Å; D340-L344 PolarHBondContact O-N 2.85Å; D340-H392 IonicContact OD2-CD2 3.35Å; D340-H392 IonicContact OD2-CE1 3.92Å; D340-H392 IonicContact OD2-NE2 3.33Å; D340-H392 PolarHBondContact OD2-NE2 2.93Å
341	L	91.7	Very high	90.3	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-51.9	-45.8	169.2	-79.9	179.1	0	0	0	112	V329 L332 R337 L344 F345 V354 V356 L391	V329-L341 HydrophobicContact CG1-CD2 4.12Å; L332-L341 HydrophobicContact CD1-CD1 3.97Å; L332-L341 HydrophobicContact CD2-CD1 4.48Å; L332-L341 HydrophobicContact CD2-CD2 3.79Å; L332-L341 HydrophobicContact CD2-CG 4.27Å; R337-L341 PolarHBondContact O-N 2.74Å; L341-L344 PolarHBondContact O-N 3.11Å; L341-F345 HydrophobicContact CD2-CD2 4.34Å; L341-F345 HydrophobicContact CD2-CE2 3.82Å; L341-F345 VanDerWaalsContact O-CD2 3.23Å; L341-F345 WeakPolarHBondContact O-CD2 3.11Å; L341-F345 PolarHBondContact O-N 3.35Å; L341-V354 HydrophobicContact CB-CG1 3.77Å; L341-V354 HydrophobicContact CD1-CG1 3.73Å; L341-V354 HydrophobicContact CG-CG1 4.44Å; L341-V356 HydrophobicContact CD1-CG2 3.62Å; L341-L391 HydrophobicContact CD2-CD1 4.41Å
342	K	92.4	Very high	90.4	Very high	111 Å²	111	61.4 Å²	61.4	48%	0.483	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-49.4	177.8	-169.2	179.6	179.9	-176.9	0	110.8	A338 T339 D340 L344 F345 S346 V351 V354	A338-K342 WeakPolarHBondContact O-CB 3.34Å; A338-K342 PolarHBondContact O-N 3.15Å; T339-K342 WeakPolarHBondContact O-CB 3.49Å; T339-K342 PolarHBondContact O-N 3.2Å; D340-K342 VanDerWaalsContact C-N 3.29Å; D340-K342 PolarHBondContact O-N 3.06Å; K342-L344 VanDerWaalsContact C-N 3.27Å; K342-L344 PolarHBondContact O-N 3.27Å; K342-F345 PolarHBondContact O-N 3.24Å; K342-S346 WeakPolarHBondContact O-CB 3.36Å; K342-S346 PolarHBondContact O-N 3.06Å; K342-S346 PolarHBondContact O-OG 3.05Å; K342-V351 HydrophobicContact CG-CB 4.18Å; K342-V351 HydrophobicContact CG-CG1 4.29Å; K342-V354 HydrophobicContact CB-CG2 3.96Å; K342-V354 HydrophobicContact CG-CG2 4.46Å
343	A	92	Very high	90.3	Very high	65 Å²	65	62.8 Å²	62.8	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-60.2	-34.6	-179.1	0	0	0	0	0	113.4	T339 D340	T339-A343 PolarHBondContact O-N 3.35Å; D340-A343 PolarHBondContact O-N 2.76Å; D340-A343 VanDerWaalsContact O-N 3.15Å
344	L	90.9	Very high	90.5	Very high	40 Å²	40	64.2 Å²	64.2	21%	0.209	35%	0.354	C	S	.	.	H	α-helix	trans	-76.5	-49.1	179.7	-67.2	155	0	0	0	112.3	D340 L341 K342 S346 K347 L391	D340-L344 VanDerWaalsContact O-CD1 3.24Å; D340-L344 WeakPolarHBondContact O-CD1 3.16Å; D340-L344 VanDerWaalsContact O-CG 3.28Å; D340-L344 WeakPolarHBondContact O-CG 3.31Å; D340-L344 PolarHBondContact O-N 2.85Å; L341-L344 PolarHBondContact O-N 3.11Å; K342-L344 VanDerWaalsContact C-N 3.27Å; K342-L344 PolarHBondContact O-N 3.27Å; L344-S346 VanDerWaalsContact C-N 3.25Å; L344-S346 PolarHBondContact O-N 2.85Å; L344-K347 WeakPolarHBondContact O-CB 3.44Å; L344-K347 PolarHBondContact O-N 3.27Å; L344-K347 VanDerWaalsContact O-N 3.13Å; L344-L391 HydrophobicContact CD1-CD1 3.36Å; L344-L391 HydrophobicContact CD1-CD2 3.33Å; L344-L391 HydrophobicContact CD1-CG 3.97Å; L344-L391 HydrophobicContact CD2-CD2 3.85Å; L344-L391 HydrophobicContact CG-CD2 4.22Å
345	F	91.4	Very high	90.8	Very high	1 Å²	1	68.1 Å²	68.1	0%	0.004	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-27.8	178.6	-75.9	-111.3	0	0	0	111.2	L327 V329 L341 K342 K347 H348 G349 V351 V371 M373 C382 L386 V398	L327-F345 HydrophobicContact CD1-CD1 4.04Å; L327-F345 HydrophobicContact CD1-CE1 3.67Å; V329-F345 HydrophobicContact CG2-CE1 4.33Å; V329-F345 HydrophobicContact CG2-CE2 4.22Å; V329-F345 HydrophobicContact CG2-CZ 3.59Å; L341-F345 HydrophobicContact CD2-CD2 4.34Å; L341-F345 HydrophobicContact CD2-CE2 3.82Å; L341-F345 VanDerWaalsContact O-CD2 3.23Å; L341-F345 WeakPolarHBondContact O-CD2 3.11Å; L341-F345 PolarHBondContact O-N 3.35Å; K342-F345 PolarHBondContact O-N 3.24Å; F345-K347 PolarHBondContact O-N 3.31Å; F345-K347 VanDerWaalsContact O-N 3.12Å; F345-H348 PolarHBondContact O-N 2.88Å; F345-G349 PolarHBondContact O-N 3.24Å; F345-G349 VanDerWaalsContact O-N 3.1Å; F345-V351 HydrophobicContact CB-CG2 3.6Å; F345-V371 HydrophobicContact CB-CG1 4.25Å; F345-V371 HydrophobicContact CD1-CB 4.29Å; F345-V371 HydrophobicContact CD1-CG1 3.8Å; F345-V371 HydrophobicContact CD1-CG2 4.41Å; F345-V371 HydrophobicContact CD2-CG2 4.48Å; F345-V371 HydrophobicContact CE1-CB 4.36Å; F345-V371 HydrophobicContact CE1-CG1 4.35Å; F345-V371 HydrophobicContact CE1-CG2 4.34Å; F345-V371 HydrophobicContact CE2-CG2 4.41Å; F345-V371 HydrophobicContact CG-CG1 4.03Å; F345-V371 HydrophobicContact CG-CG2 4.48Å; F345-V371 HydrophobicContact CZ-CG2 4.34Å; F345-M373 HydrophobicContact CB-SD 4.22Å; F345-M373 HydrophobicContact CD1-SD 4.06Å; F345-C382 HydrophobicContact CD1-CB 3.93Å; F345-C382 HydrophobicContact CE1-CB 4.04Å; F345-L386 HydrophobicContact CB-CD1 4.39Å; F345-L386 HydrophobicContact CD1-CD1 3.78Å; F345-L386 HydrophobicContact CD2-CD1 3.69Å; F345-L386 HydrophobicContact CE1-CD1 3.89Å; F345-L386 HydrophobicContact CE2-CD1 3.81Å; F345-L386 HydrophobicContact CG-CD1 3.69Å; F345-L386 HydrophobicContact CZ-CD1 3.9Å; F345-V398 HydrophobicContact CE1-CG1 3.97Å; F345-V398 HydrophobicContact CE1-CG2 4.4Å; F345-V398 HydrophobicContact CZ-CG1 4.06Å; F345-V398 HydrophobicContact CZ-CG2 3.74Å
346	S	92.6	Very high	91.1	Very high	63 Å²	63	65.8 Å²	65.8	44%	0.441	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.1	170.1	-77.1	0	0	0	0	115.3	K342 L344 H348 G349	K342-S346 WeakPolarHBondContact O-CB 3.36Å; K342-S346 PolarHBondContact O-N 3.06Å; K342-S346 PolarHBondContact O-OG 3.05Å; L344-S346 VanDerWaalsContact C-N 3.25Å; L344-S346 PolarHBondContact O-N 2.85Å; S346-H348 VanDerWaalsContact C-N 3.33Å; S346-G349 WeakPolarHBondContact CA-O 3.22Å
347	K	90.2	Very high	91.1	Very high	158 Å²	158	68.6 Å²	68.6	69%	0.687	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-24.3	170.4	-61.9	-178.3	178.8	-176.3	0	113.4	L344 F345	L344-K347 WeakPolarHBondContact O-CB 3.44Å; L344-K347 PolarHBondContact O-N 3.27Å; L344-K347 VanDerWaalsContact O-N 3.13Å; F345-K347 PolarHBondContact O-N 3.31Å; F345-K347 VanDerWaalsContact O-N 3.12Å
348	H	86.9	Confident	90.9	Very high	55 Å²	55	64 Å²	64	26%	0.255	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-6.9	-170.9	-62.2	-82.2	0	0	0	113.3	F345 S346 I381 H385	F345-H348 PolarHBondContact O-N 2.88Å; S346-H348 VanDerWaalsContact C-N 3.33Å; H348-I381 HydrophobicContact CB-CG2 4.14Å; H348-H385 VanDerWaalsContact CE1-CB 3.43Å; H348-H385 WeakPolarHBondContact CE1-CB 3.44Å; H348-H385 AromaticContact CE1-CG 3.78Å; H348-H385 AromaticContact ND1-CG 3.91Å
349	G	88.6	Confident	90.5	Very high	13 Å²	13	65.6 Å²	65.6	13%	0.134	36%	0.362	C	S	.	.	S	Bend	trans	174	170	173.5	0	0	0	0	0	113.9	F345 S346 V351 M373 E378	F345-G349 PolarHBondContact O-N 3.24Å; F345-G349 VanDerWaalsContact O-N 3.1Å; S346-G349 WeakPolarHBondContact CA-O 3.22Å; G349-V351 PolarHBondContact O-N 2.97Å; G349-M373 VanDerWaalsContact C-CE 3.49Å; G349-E378 VanDerWaalsContact CA-OE1 3.27Å; G349-E378 WeakPolarHBondContact CA-OE1 3.42Å
350	K	91.7	Very high	89.6	Confident	157 Å²	157	66.2 Å²	66.2	68%	0.683	38%	0.376	S	S	*	.			trans	-73.4	118.6	177.1	-67	171.8	-176.3	171.8	0	110	M373 S374 E378	K350-M373 CarbonylContact O-C 3.31Å; K350-S374 WeakPolarHBondContact O-CB 3.43Å; K350-S374 PolarHBondContact O-N 3.1Å; K350-E378 VanDerWaalsContact N-CD 3.34Å; K350-E378 PolarHBondContact N-OE1 3.05Å
351	V	93.6	Very high	88.7	Confident	19 Å²	19	73.4 Å²	73.4	12%	0.115	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	113.7	-179.5	-175.5	0	0	0	0	110.3	K342 F345 G349 V354 V371 M373	K342-V351 HydrophobicContact CG-CB 4.18Å; K342-V351 HydrophobicContact CG-CG1 4.29Å; F345-V351 HydrophobicContact CB-CG2 3.6Å; G349-V351 PolarHBondContact O-N 2.97Å; V351-V354 HydrophobicContact CG1-CG2 3.56Å; V351-V371 HydrophobicContact CG1-CG1 3.82Å; V351-M373 HydrophobicContact CG2-CE 4.05Å; V351-M373 HydrophobicContact CG2-SD 3.98Å
352	V	91.8	Very high	87.7	Confident	98 Å²	98	76.2 Å²	76.2	59%	0.594	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	-37.6	177.7	177.3	0	0	0	0	111.3	T372 M373	V352-T372 HydrophobicContact CB-CG2 4.06Å; V352-T372 WeakPolarHBondContact CB-O 3.27Å; V352-T372 HydrophobicContact CG1-CG2 4.39Å; V352-T372 PolarHBondContact N-O 3.03Å; V352-M373 WeakPolarHBondContact CG2-O 3.33Å
353	G	88.3	Confident	86.2	Confident	32 Å²	32	76.4 Å²	76.4	33%	0.33	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	151	179.8	0	0	0	0	0	113.4	V371 T372	G353-V371 WeakPolarHBondContact O-CA 3.4Å; G353-T372 PolarHBondContact N-O 2.99Å; G353-T372 PolarHBondContact O-N 3.23Å
354	V	93.9	Very high	84.8	Confident	37 Å²	37	76.1 Å²	76.1	22%	0.224	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.6	173	-177.6	0	0	0	0	108.8	A338 L341 K342 V351 V356 F370 V371	A338-V354 HydrophobicContact CB-CB 4.23Å; A338-V354 HydrophobicContact CB-CG1 3.81Å; L341-V354 HydrophobicContact CB-CG1 3.77Å; L341-V354 HydrophobicContact CD1-CG1 3.73Å; L341-V354 HydrophobicContact CG-CG1 4.44Å; K342-V354 HydrophobicContact CB-CG2 3.96Å; K342-V354 HydrophobicContact CG-CG2 4.46Å; V351-V354 HydrophobicContact CG1-CG2 3.56Å; V354-V356 HydrophobicContact CG1-CG2 4.46Å; V354-F370 WeakPolarHBondContact CA-O 3.34Å; V354-V371 HydrophobicContact CG1-CG2 4.33Å; V354-V371 HydrophobicContact CG2-CG1 4.38Å; V354-V371 HydrophobicContact CG2-CG2 4.36Å
355	K	92.3	Very high	83.8	Confident	137 Å²	137	75.9 Å²	75.9	60%	0.596	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	108.6	174.2	179.3	-176	177	-175.4	0	109.2	V357 G369 F370	K355-V357 HydrophobicContact CG-CG2 4.39Å; K355-G369 CarbonylContact O-C 3.6Å; K355-G369 WeakPolarHBondContact O-CA 3.15Å; K355-F370 PolarHBondContact N-O 3.13Å; K355-F370 PolarHBondContact O-N 3.33Å
356	V	91.6	Very high	83.1	Confident	37 Å²	37	85.5 Å²	85.5	22%	0.224	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.8	168.7	-179.4	0	0	0	0	109.1	A338 L341 V354 T358 F368	A338-V356 HydrophobicContact CB-CG2 3.99Å; L341-V356 HydrophobicContact CD1-CG2 3.62Å; V354-V356 HydrophobicContact CG1-CG2 4.46Å; V356-T358 HydrophobicContact CG1-CG2 3.89Å; V356-F368 CarbonylContact C-O 3.57Å; V356-F368 WeakPolarHBondContact CA-O 3.38Å
357	V	89	Confident	82.8	Confident	66 Å²	66	82.6 Å²	82.6	40%	0.4	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	109.5	173.3	-177.8	0	0	0	0	107.4	K355 F368 F370	K355-V357 HydrophobicContact CG-CG2 4.39Å; V357-F368 PolarHBondContact N-O 2.9Å; V357-F368 PolarHBondContact O-N 2.62Å; V357-F370 HydrophobicContact CG2-CD2 4.43Å; V357-F370 HydrophobicContact CG2-CE2 4.31Å
358	T	85.1	Confident	82.9	Confident	84 Å²	84	78.7 Å²	78.7	52%	0.515	44%	0.444	S	S	.	.			trans	-100.4	151.1	173	64.8	0	0	0	0	109.5	V356 A360 C367	V356-T358 HydrophobicContact CG1-CG2 3.89Å; T358-A360 PolarHBondContact O-N 3.35Å; T358-C367 HydrophobicContact CG2-CB 4.36Å
359	N	82.9	Confident	83.1	Confident	71 Å²	71	76 Å²	76	38%	0.38	43%	0.432	S	S	.	.			trans	-82.6	101.6	178.8	-178.1	0.7	0	0	0	110.7	K361 S362 A365	N359-K361 PolarHBondContact O-N 2.79Å; N359-K361 PolarHBondContact OD1-N 2.75Å; N359-K361 VanDerWaalsContact OD1-N 3.07Å; N359-S362 CarbonylContact O-C 3.43Å; N359-S362 PolarHBondContact O-N 3.08Å; N359-A365 HydrophobicContact CB-CB 4.04Å
360	A	73	Confident	83.3	Confident	105 Å²	105	79.6 Å²	79.6	87%	0.868	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.5	-179.9	0	0	0	0	0	115.1	T358	T358-A360 PolarHBondContact O-N 3.35Å
361	K	73	Confident	83.4	Confident	191 Å²	191	72.2 Å²	72.2	83%	0.83	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.9	174.9	-66.1	-174.4	176.5	-177.5	0	113.9	N359	N359-K361 PolarHBondContact O-N 2.79Å; N359-K361 PolarHBondContact OD1-N 2.75Å; N359-K361 VanDerWaalsContact OD1-N 3.07Å
362	S	70.1	Confident	83.4	Confident	60 Å²	60	73.3 Å²	73.3	42%	0.42	42%	0.418	S	S	.	.			trans	-158	94.9	-175.2	-55.6	0	0	0	0	110	N359 G364 A365	N359-S362 CarbonylContact O-C 3.43Å; N359-S362 PolarHBondContact O-N 3.08Å; S362-G364 PolarHBondContact O-N 2.84Å; S362-A365 VanDerWaalsContact O-CB 3.31Å; S362-A365 WeakPolarHBondContact O-CB 3.26Å; S362-A365 PolarHBondContact O-N 3.36Å
363	P	60.7	Low	83.6	Confident	116 Å²	116	68.6 Å²	68.6	75%	0.753	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.9	-169.5	24.7	-34	0	0	0	115.4	S334	S334-P363 WeakPolarHBondContact CB-O 3.49Å
364	G	63.3	Low	83.7	Confident	59 Å²	59	68.8 Å²	68.8	61%	0.608	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.1	170.9	0	0	0	0	0	115.4	S362	S362-G364 PolarHBondContact O-N 2.84Å
365	A	70.3	Confident	83.6	Confident	34 Å²	34	69.7 Å²	69.7	28%	0.281	39%	0.392	S	S	.	.	S	Bend	trans	-72.2	160.6	-176.1	0	0	0	0	0	113	N359 S362 C367	N359-A365 HydrophobicContact CB-CB 4.04Å; S362-A365 VanDerWaalsContact O-CB 3.31Å; S362-A365 WeakPolarHBondContact O-CB 3.26Å; S362-A365 PolarHBondContact O-N 3.36Å; A365-C367 PolarHBondContact O-N 2.84Å; A365-C367 PolarHBondContact O-SG 2.81Å
366	R	76.7	Confident	83.6	Confident	204 Å²	204	64.4 Å²	64.4	77%	0.77	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-52.1	124.9	179.1	-68.9	-179.6	173.7	116	-1.9	110.8	F368	R366-F368 HydrophobicContact CB-CE2 4.43Å; R366-F368 HydrophobicContact CB-CZ 4.24Å
367	C	86.9	Confident	83.5	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	151.7	179	-66.9	0	0	0	0	110.4	L332 T358 A365	L332-C367 HydrophobicContact CB-CB 4.11Å; T358-C367 HydrophobicContact CG2-CB 4.36Å; A365-C367 PolarHBondContact O-N 2.84Å; A365-C367 PolarHBondContact O-SG 2.81Å
368	F	90.9	Very high	83.6	Confident	75 Å²	75	65.6 Å²	65.6	33%	0.329	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.8	-177.3	-58.8	-80	0	0	0	110.7	W328 V329 V356 V357 R366	W328-F368 AromaticContact CE2-CD1 3.94Å; W328-F368 AromaticContact CZ2-CD1 3.59Å; W328-F368 HydrophobicContact CZ2-CD1 3.59Å; W328-F368 AromaticContact CZ2-CE1 3.71Å; W328-F368 HydrophobicContact CZ2-CE1 3.71Å; W328-F368 AromaticContact NE1-CD1 3.8Å; V329-F368 CarbonylContact O-C 3.53Å; V329-F368 WeakPolarHBondContact O-CA 3.47Å; V356-F368 CarbonylContact C-O 3.57Å; V356-F368 WeakPolarHBondContact CA-O 3.38Å; V357-F368 PolarHBondContact N-O 2.9Å; V357-F368 PolarHBondContact O-N 2.62Å; R366-F368 HydrophobicContact CB-CE2 4.43Å; R366-F368 HydrophobicContact CB-CZ 4.24Å
369	G	91.9	Very high	83.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148	177.3	0	0	0	0	0	111.3	V329 K355	V329-G369 PolarHBondContact N-O 3.08Å; V329-G369 PolarHBondContact O-N 3.19Å; K355-G369 CarbonylContact O-C 3.6Å; K355-G369 WeakPolarHBondContact O-CA 3.15Å
370	F	93.4	Very high	84.3	Confident	88 Å²	88	60.8 Å²	60.8	39%	0.386	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.3	160.8	-62.8	-86.7	0	0	0	107.7	L327 W328 V354 K355 V357	L327-F370 WeakPolarHBondContact O-CA 3.23Å; W328-F370 HydrophobicContact CB-CE1 4.5Å; W328-F370 AromaticContact CD1-CE1 3.6Å; W328-F370 AromaticContact CD1-CZ 3.83Å; W328-F370 HydrophobicContact CG-CE1 4.33Å; V354-F370 WeakPolarHBondContact CA-O 3.34Å; K355-F370 PolarHBondContact N-O 3.13Å; K355-F370 PolarHBondContact O-N 3.33Å; V357-F370 HydrophobicContact CG2-CD2 4.43Å; V357-F370 HydrophobicContact CG2-CE2 4.31Å
371	V	93.9	Very high	85.2	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.8	180	-178.9	0	0	0	0	108.1	L327 V329 F345 V351 G353 V354 M373	L327-V371 HydrophobicContact CB-CB 4.39Å; L327-V371 PolarHBondContact N-O 2.99Å; L327-V371 PolarHBondContact O-N 3.12Å; V329-V371 HydrophobicContact CG2-CG2 3.92Å; F345-V371 HydrophobicContact CB-CG1 4.25Å; F345-V371 HydrophobicContact CD1-CB 4.29Å; F345-V371 HydrophobicContact CD1-CG1 3.8Å; F345-V371 HydrophobicContact CD1-CG2 4.41Å; F345-V371 HydrophobicContact CD2-CG2 4.48Å; F345-V371 HydrophobicContact CE1-CB 4.36Å; F345-V371 HydrophobicContact CE1-CG1 4.35Å; F345-V371 HydrophobicContact CE1-CG2 4.34Å; F345-V371 HydrophobicContact CE2-CG2 4.41Å; F345-V371 HydrophobicContact CG-CG1 4.03Å; F345-V371 HydrophobicContact CG-CG2 4.48Å; F345-V371 HydrophobicContact CZ-CG2 4.34Å; V351-V371 HydrophobicContact CG1-CG1 3.82Å; G353-V371 WeakPolarHBondContact O-CA 3.4Å; V354-V371 HydrophobicContact CG1-CG2 4.33Å; V354-V371 HydrophobicContact CG2-CG1 4.38Å; V354-V371 HydrophobicContact CG2-CG2 4.36Å; V371-M373 HydrophobicContact CG1-SD 3.79Å
372	T	93.4	Very high	86	Confident	42 Å²	42	50 Å²	50	26%	0.258	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.7	172.8	-58.1	0	0	0	0	108.6	R325 N326 V352 G353	R325-T372 CarbonylContact O-C 3.57Å; R325-T372 WeakPolarHBondContact O-CA 3.24Å; N326-T372 WeakPolarHBondContact OD1-CB 3.28Å; N326-T372 WeakPolarHBondContact OD1-CG2 3.33Å; N326-T372 PolarHBondContact OD1-OG1 3.4Å; V352-T372 HydrophobicContact CB-CG2 4.06Å; V352-T372 WeakPolarHBondContact CB-O 3.27Å; V352-T372 HydrophobicContact CG1-CG2 4.39Å; V352-T372 PolarHBondContact N-O 3.03Å; G353-T372 PolarHBondContact N-O 2.99Å; G353-T372 PolarHBondContact O-N 3.23Å
373	M	94.4	Very high	87	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	167.5	173.2	-56.8	-52.6	-66.5	0	0	111.3	R325 L327 F345 G349 K350 V351 V352 V371 E378 A379 C382	R325-M373 PolarHBondContact O-N 2.86Å; L327-M373 HydrophobicContact CD1-CG 3.95Å; F345-M373 HydrophobicContact CB-SD 4.22Å; F345-M373 HydrophobicContact CD1-SD 4.06Å; G349-M373 VanDerWaalsContact C-CE 3.49Å; K350-M373 CarbonylContact O-C 3.31Å; V351-M373 HydrophobicContact CG2-CE 4.05Å; V351-M373 HydrophobicContact CG2-SD 3.98Å; V352-M373 WeakPolarHBondContact CG2-O 3.33Å; V371-M373 HydrophobicContact CG1-SD 3.79Å; M373-E378 HydrophobicContact CB-CB 4.23Å; M373-E378 HydrophobicContact CE-CB 4.07Å; M373-A379 HydrophobicContact CB-CB 4.1Å; M373-A379 HydrophobicContact CG-CB 3.88Å; M373-C382 VanDerWaalsContact CE-SG 3.58Å
374	S	91.7	Very high	88.4	Confident	35 Å²	35	47.5 Å²	47.5	25%	0.245	27%	0.265	C	S	.	.	S	Bend	trans	-79.7	-37.4	-179.3	85.7	0	0	0	0	112.1	R325 K350 E378	R325-S374 WeakPolarHBondContact CD-O 3.23Å; R325-S374 PolarHBondContact NH1-O 2.99Å; K350-S374 WeakPolarHBondContact O-CB 3.43Å; K350-S374 PolarHBondContact O-N 3.1Å; S374-E378 WeakPolarHBondContact CA-OE2 3.48Å; S374-E378 WeakPolarHBondContact CB-OE2 3.41Å; S374-E378 PolarHBondContact N-OE2 2.72Å; S374-E378 VanDerWaalsContact N-OE2 3.08Å; S374-E378 PolarHBondContact OG-OE1 2.78Å; S374-E378 PolarHBondContact OG-OE2 2.92Å
375	T	92	Very high	89.6	Confident	57 Å²	57	50 Å²	50	35%	0.35	26%	0.261	S	S	.	.	S	Bend	trans	-116.5	169.9	173.4	73.5	0	0	0	0	112	D377 E378	T375-D377 VanDerWaalsContact C-N 3.26Å; T375-D377 PolarHBondContact OG1-N 2.84Å; T375-E378 PolarHBondContact N-OE2 3.47Å; T375-E378 WeakPolarHBondContact OG1-CB 3.44Å; T375-E378 VanDerWaalsContact OG1-CG 3.23Å; T375-E378 WeakPolarHBondContact OG1-CG 3.37Å; T375-E378 PolarHBondContact OG1-N 3Å; T375-E378 VanDerWaalsContact OG1-N 3.13Å; T375-E378 PolarHBondContact OG1-OE2 3.3Å
376	S	91.3	Very high	90.5	Very high	25 Å²	25	48.9 Å²	48.9	18%	0.175	25%	0.25	C	C	.	.	H	α-helix	trans	-70.3	-25	172	40.1	0	0	0	0	112.9	S323 A379 T380	S323-S376 WeakPolarHBondContact O-CB 3.34Å; S376-A379 WeakPolarHBondContact O-CB 3.39Å; S376-A379 PolarHBondContact O-N 3.37Å; S376-T380 WeakPolarHBondContact O-CG2 3.33Å; S376-T380 PolarHBondContact O-N 3.03Å
377	D	90.2	Very high	91.2	Very high	96 Å²	96	42.4 Å²	42.4	51%	0.513	23%	0.228	S	C	.	.	H	α-helix	trans	-97.6	-37.1	-161.7	-41.9	-33.6	0	0	0	109.6	T375 A379 T380 I381	T375-D377 VanDerWaalsContact C-N 3.26Å; T375-D377 PolarHBondContact OG1-N 2.84Å; D377-A379 PolarHBondContact O-N 3.25Å; D377-T380 PolarHBondContact O-N 2.78Å; D377-T380 VanDerWaalsContact O-N 3.07Å; D377-T380 PolarHBondContact O-OG1 3.21Å; D377-I381 VanDerWaalsContact O-CG1 3.31Å; D377-I381 WeakPolarHBondContact O-CG1 3.41Å; D377-I381 PolarHBondContact O-N 2.7Å
378	E	91.5	Very high	91.4	Very high	32 Å²	32	50.2 Å²	50.2	15%	0.15	26%	0.257	C	S	.	.	H	α-helix	trans	-49.2	-39.5	156.9	-71.2	173.8	145.6	0	0	111	G349 K350 M373 S374 T375 I381 C382	G349-E378 VanDerWaalsContact CA-OE1 3.27Å; G349-E378 WeakPolarHBondContact CA-OE1 3.42Å; K350-E378 VanDerWaalsContact N-CD 3.34Å; K350-E378 PolarHBondContact N-OE1 3.05Å; M373-E378 HydrophobicContact CB-CB 4.23Å; M373-E378 HydrophobicContact CE-CB 4.07Å; S374-E378 WeakPolarHBondContact CA-OE2 3.48Å; S374-E378 WeakPolarHBondContact CB-OE2 3.41Å; S374-E378 PolarHBondContact N-OE2 2.72Å; S374-E378 VanDerWaalsContact N-OE2 3.08Å; S374-E378 PolarHBondContact OG-OE1 2.78Å; S374-E378 PolarHBondContact OG-OE2 2.92Å; T375-E378 PolarHBondContact N-OE2 3.47Å; T375-E378 WeakPolarHBondContact OG1-CB 3.44Å; T375-E378 VanDerWaalsContact OG1-CG 3.23Å; T375-E378 WeakPolarHBondContact OG1-CG 3.37Å; T375-E378 PolarHBondContact OG1-N 3Å; T375-E378 VanDerWaalsContact OG1-N 3.13Å; T375-E378 PolarHBondContact OG1-OE2 3.3Å; E378-I381 PolarHBondContact O-N 3.45Å; E378-C382 WeakPolarHBondContact O-CB 3.26Å; E378-C382 PolarHBondContact O-N 3.11Å; E378-C382 PolarHBondContact O-SG 3.25Å
379	A	91.3	Very high	91.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-71.4	-30.5	-179.8	0	0	0	0	0	113.1	L327 M373 S376 D377 I383	L327-A379 HydrophobicContact CD1-CB 4.19Å; L327-A379 HydrophobicContact CD2-CB 3.98Å; L327-A379 HydrophobicContact CG-CB 4.14Å; M373-A379 HydrophobicContact CB-CB 4.1Å; M373-A379 HydrophobicContact CG-CB 3.88Å; S376-A379 WeakPolarHBondContact O-CB 3.39Å; S376-A379 PolarHBondContact O-N 3.37Å; D377-A379 PolarHBondContact O-N 3.25Å; A379-I383 WeakPolarHBondContact O-CD1 3.24Å; A379-I383 WeakPolarHBondContact O-CG1 3.2Å; A379-I383 PolarHBondContact O-N 3.33Å
380	T	91.4	Very high	91.2	Very high	54 Å²	54	55.3 Å²	55.3	33%	0.331	29%	0.285	S	S	.	.	H	α-helix	trans	-72.8	-41.7	173	74.1	0	0	0	0	111.2	S376 D377 C382 I383 S384	S376-T380 WeakPolarHBondContact O-CG2 3.33Å; S376-T380 PolarHBondContact O-N 3.03Å; D377-T380 PolarHBondContact O-N 2.78Å; D377-T380 VanDerWaalsContact O-N 3.07Å; D377-T380 PolarHBondContact O-OG1 3.21Å; T380-C382 VanDerWaalsContact C-N 3.34Å; T380-C382 PolarHBondContact O-N 3.13Å; T380-I383 PolarHBondContact O-N 3.44Å; T380-I383 VanDerWaalsContact O-N 3.11Å; T380-S384 PolarHBondContact O-N 3.24Å; T380-S384 PolarHBondContact O-OG 3.39Å
381	I	90.8	Very high	90.8	Very high	70 Å²	70	52 Å²	52	36%	0.359	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-42.1	176.3	-63.3	164.6	0	0	0	110.4	H348 D377 E378 I383 S384 H385	H348-I381 HydrophobicContact CB-CG2 4.14Å; D377-I381 VanDerWaalsContact O-CG1 3.31Å; D377-I381 WeakPolarHBondContact O-CG1 3.41Å; D377-I381 PolarHBondContact O-N 2.7Å; E378-I381 PolarHBondContact O-N 3.45Å; I381-I383 VanDerWaalsContact C-N 3.35Å; I381-I383 PolarHBondContact O-N 3.29Å; I381-S384 PolarHBondContact O-N 2.89Å; I381-S384 PolarHBondContact O-OG 3.26Å; I381-S384 VanDerWaalsContact O-OG 3.12Å; I381-H385 WeakPolarHBondContact O-CB 3.35Å; I381-H385 PolarHBondContact O-N 3.29Å; I381-H385 PolarHBondContact O-ND1 3.34Å
382	C	89.5	Confident	90.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-40.5	172.1	-77.2	0	0	0	0	112.8	L327 F345 M373 E378 T380 L386	L327-C382 HydrophobicContact CD1-CB 3.57Å; F345-C382 HydrophobicContact CD1-CB 3.93Å; F345-C382 HydrophobicContact CE1-CB 4.04Å; M373-C382 VanDerWaalsContact CE-SG 3.58Å; E378-C382 WeakPolarHBondContact O-CB 3.26Å; E378-C382 PolarHBondContact O-N 3.11Å; E378-C382 PolarHBondContact O-SG 3.25Å; T380-C382 VanDerWaalsContact C-N 3.34Å; T380-C382 PolarHBondContact O-N 3.13Å; C382-L386 HydrophobicContact CB-CD1 4.3Å; C382-L386 WeakPolarHBondContact O-CB 3.27Å; C382-L386 PolarHBondContact O-N 3.22Å
383	I	91.9	Very high	89.9	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.195	32%	0.318	C	S	.	.	H	α-helix	trans	-65.5	-47.4	177.3	-68.4	160.9	0	0	0	110.4	L327 A379 T380 I381 H385 H387 V398 R400	L327-I383 HydrophobicContact CD2-CD1 3.54Å; L327-I383 HydrophobicContact CD2-CG1 3.64Å; A379-I383 WeakPolarHBondContact O-CD1 3.24Å; A379-I383 WeakPolarHBondContact O-CG1 3.2Å; A379-I383 PolarHBondContact O-N 3.33Å; T380-I383 PolarHBondContact O-N 3.44Å; T380-I383 VanDerWaalsContact O-N 3.11Å; I381-I383 VanDerWaalsContact C-N 3.35Å; I381-I383 PolarHBondContact O-N 3.29Å; I383-H385 PolarHBondContact O-N 2.86Å; I383-H387 WeakPolarHBondContact O-CB 3.42Å; I383-H387 PolarHBondContact O-N 3.45Å; I383-V398 HydrophobicContact CG1-CG1 3.93Å; I383-R400 HydrophobicContact CD1-CB 4.43Å; I383-R400 HydrophobicContact CD1-CG 3.46Å; I383-R400 VanDerWaalsContact CD1-CG 3.46Å
384	S	90.6	Very high	89.6	Confident	86 Å²	86	62.6 Å²	62.6	60%	0.601	34%	0.336	S	S	*	.	H	α-helix	trans	-68.1	-30.8	-177.1	55.9	0	0	0	0	114	T380 I381	T380-S384 PolarHBondContact O-N 3.24Å; T380-S384 PolarHBondContact O-OG 3.39Å; I381-S384 PolarHBondContact O-N 2.89Å; I381-S384 PolarHBondContact O-OG 3.26Å; I381-S384 VanDerWaalsContact O-OG 3.12Å
385	H	87.5	Confident	89.6	Confident	111 Å²	111	64.9 Å²	64.9	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-100.6	-24.6	-175.9	-64.1	77.7	0	0	0	115.1	H348 I381 I383 T389	H348-H385 VanDerWaalsContact CE1-CB 3.43Å; H348-H385 WeakPolarHBondContact CE1-CB 3.44Å; H348-H385 AromaticContact CE1-CG 3.78Å; H348-H385 AromaticContact ND1-CG 3.91Å; I381-H385 WeakPolarHBondContact O-CB 3.35Å; I381-H385 PolarHBondContact O-N 3.29Å; I381-H385 PolarHBondContact O-ND1 3.34Å; I383-H385 PolarHBondContact O-N 2.86Å; H385-T389 WeakPolarHBondContact O-CG2 3.31Å
386	L	89.9	Confident	89.6	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-107.5	-12.8	-176.1	-57.4	174.1	0	0	0	113.9	F345 C382 R388 T389 V398	F345-L386 HydrophobicContact CB-CD1 4.39Å; F345-L386 HydrophobicContact CD1-CD1 3.78Å; F345-L386 HydrophobicContact CD2-CD1 3.69Å; F345-L386 HydrophobicContact CE1-CD1 3.89Å; F345-L386 HydrophobicContact CE2-CD1 3.81Å; F345-L386 HydrophobicContact CG-CD1 3.69Å; F345-L386 HydrophobicContact CZ-CD1 3.9Å; C382-L386 HydrophobicContact CB-CD1 4.3Å; C382-L386 WeakPolarHBondContact O-CB 3.27Å; C382-L386 PolarHBondContact O-N 3.22Å; L386-R388 PolarHBondContact O-N 3.01Å; L386-T389 PolarHBondContact O-N 3.24Å; L386-T389 PolarHBondContact O-OG1 2.8Å; L386-V398 HydrophobicContact CB-CG2 3.93Å
387	H	91.6	Very high	89.6	Confident	69 Å²	69	65 Å²	65	32%	0.319	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	127.7	171.9	-175.8	103.6	0	0	0	110.3	I383 F397 V398	I383-H387 WeakPolarHBondContact O-CB 3.42Å; I383-H387 PolarHBondContact O-N 3.45Å; H387-F397 AromaticContact CE1-CD1 3.87Å; H387-F397 AromaticContact NE2-CD1 3.83Å; H387-V398 HydrophobicContact CB-CB 4.36Å; H387-V398 PolarHBondContact ND1-N 3.42Å; H387-V398 PolarHBondContact ND1-O 3.39Å
388	R	89.1	Confident	89.8	Confident	165 Å²	165	60.5 Å²	60.5	62%	0.623	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	38.7	-171.7	-58.6	162.4	-164	-153.2	2.9	113.8	L386 M395 I396 F397	L386-R388 PolarHBondContact O-N 3.01Å; R388-M395 VanDerWaalsContact C-SD 3.54Å; R388-M395 HydrophobicContact CB-CE 4.17Å; R388-M395 HydrophobicContact CB-SD 4.33Å; R388-M395 WeakPolarHBondContact O-CE 3.29Å; R388-I396 VanDerWaalsContact CA-O 3.25Å; R388-I396 WeakPolarHBondContact CA-O 3.43Å; R388-I396 PolarHBondContact N-O 3.1Å; R388-F397 HydrophobicContact CG-CD1 3.99Å; R388-F397 HydrophobicContact CG-CE1 3.69Å
389	T	88.6	Confident	89.8	Confident	40 Å²	40	62.9 Å²	62.9	25%	0.245	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	149.7	165.2	55.5	0	0	0	0	111.4	H385 L386 M395 I396	H385-T389 WeakPolarHBondContact O-CG2 3.31Å; L386-T389 PolarHBondContact O-N 3.24Å; L386-T389 PolarHBondContact O-OG1 2.8Å; T389-M395 WeakPolarHBondContact O-CA 3.45Å; T389-I396 WeakPolarHBondContact O-CG1 3.49Å; T389-I396 PolarHBondContact O-N 3.45Å; T389-I396 WeakPolarHBondContact OG1-CG1 3.4Å
390	E	90.8	Very high	89.7	Confident	143 Å²	143	67.8 Å²	67.8	67%	0.668	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.6	-179.8	-67.3	-170.9	175	0	0	112.2	K394 M395	E390-K394 WeakPolarHBondContact CA-O 3.38Å; E390-M395 HydrophobicContact CG-CG 4.3Å; E390-M395 HydrophobicContact CG-SD 3.66Å
391	L	85.5	Confident	89.5	Confident	19 Å²	19	65.7 Å²	65.7	10%	0.099	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.8	172.6	-54.1	-171.3	0	0	0	110.5	L332 L341 L344 G393 K394 I396	L332-L391 HydrophobicContact CD2-CD1 4.23Å; L341-L391 HydrophobicContact CD2-CD1 4.41Å; L344-L391 HydrophobicContact CD1-CD1 3.36Å; L344-L391 HydrophobicContact CD1-CD2 3.33Å; L344-L391 HydrophobicContact CD1-CG 3.97Å; L344-L391 HydrophobicContact CD2-CD2 3.85Å; L344-L391 HydrophobicContact CG-CD2 4.22Å; L391-G393 PolarHBondContact O-N 3.34Å; L391-K394 PolarHBondContact N-O 3.02Å; L391-K394 PolarHBondContact O-N 3.36Å; L391-I396 HydrophobicContact CB-CG2 4.19Å; L391-I396 HydrophobicContact CD1-CD1 3.72Å; L391-I396 HydrophobicContact CD1-CG1 4.15Å; L391-I396 HydrophobicContact CD1-CG2 3.82Å; L391-I396 HydrophobicContact CG-CD1 4.13Å; L391-I396 HydrophobicContact CG-CG1 4.09Å; L391-I396 HydrophobicContact CG-CG2 3.94Å
392	H	84	Confident	88.8	Confident	107 Å²	107	71.1 Å²	71.1	50%	0.495	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	42.1	-179.5	-57.6	-44.9	0	0	0	113	D340	D340-H392 IonicContact OD2-CD2 3.35Å; D340-H392 IonicContact OD2-CE1 3.92Å; D340-H392 IonicContact OD2-NE2 3.33Å; D340-H392 PolarHBondContact OD2-NE2 2.93Å
393	G	84.4	Confident	87.2	Confident	72 Å²	72	75.3 Å²	75.3	74%	0.742	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	18.5	-179.4	0	0	0	0	0	115.5	L391	L391-G393 PolarHBondContact O-N 3.34Å
394	K	87.7	Confident	84.7	Confident	86 Å²	86	82 Å²	82	37%	0.374	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.1	174.9	-55.2	-167.2	-165.6	-177.5	0	112.2	G331 S333 E390 L391 I396	G331-K394 WeakPolarHBondContact O-CB 3.29Å; S333-K394 WeakPolarHBondContact OG-CE 3.43Å; E390-K394 WeakPolarHBondContact CA-O 3.38Å; L391-K394 PolarHBondContact N-O 3.02Å; L391-K394 PolarHBondContact O-N 3.36Å; K394-I396 PolarHBondContact O-N 2.84Å
395	M	91.3	Very high	82.5	Confident	83 Å²	83	82.8 Å²	82.8	41%	0.409	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	121.3	171.4	-77.8	-66.6	-139.3	0	0	111.3	R388 T389 E390 F397	R388-M395 VanDerWaalsContact C-SD 3.54Å; R388-M395 HydrophobicContact CB-CE 4.17Å; R388-M395 HydrophobicContact CB-SD 4.33Å; R388-M395 WeakPolarHBondContact O-CE 3.29Å; T389-M395 WeakPolarHBondContact O-CA 3.45Å; E390-M395 HydrophobicContact CG-CG 4.3Å; E390-M395 HydrophobicContact CG-SD 3.66Å; M395-F397 HydrophobicContact CB-CE2 4.16Å; M395-F397 HydrophobicContact CB-CZ 4.33Å
396	I	93	Very high	80.5	Confident	2 Å²	2	82.3 Å²	82.3	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	148.1	170.4	63.1	153.1	0	0	0	112.1	V329 S330 L332 R388 T389 L391 K394 V398	V329-I396 HydrophobicContact CG1-CB 4.18Å; V329-I396 HydrophobicContact CG1-CD1 4.01Å; S330-I396 CarbonylContact O-C 3.54Å; S330-I396 VanDerWaalsContact O-CA 3.29Å; S330-I396 WeakPolarHBondContact O-CA 3.29Å; L332-I396 HydrophobicContact CD2-CG2 3.61Å; L332-I396 HydrophobicContact CG-CG2 4.22Å; R388-I396 VanDerWaalsContact CA-O 3.25Å; R388-I396 WeakPolarHBondContact CA-O 3.43Å; R388-I396 PolarHBondContact N-O 3.1Å; T389-I396 WeakPolarHBondContact O-CG1 3.49Å; T389-I396 PolarHBondContact O-N 3.45Å; T389-I396 WeakPolarHBondContact OG1-CG1 3.4Å; L391-I396 HydrophobicContact CB-CG2 4.19Å; L391-I396 HydrophobicContact CD1-CD1 3.72Å; L391-I396 HydrophobicContact CD1-CG1 4.15Å; L391-I396 HydrophobicContact CD1-CG2 3.82Å; L391-I396 HydrophobicContact CG-CD1 4.13Å; L391-I396 HydrophobicContact CG-CG1 4.09Å; L391-I396 HydrophobicContact CG-CG2 3.94Å; K394-I396 PolarHBondContact O-N 2.84Å; I396-V398 HydrophobicContact CD1-CG2 4Å
397	F	91.7	Very high	78.2	Confident	83 Å²	83	85.6 Å²	85.6	36%	0.364	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119	175.6	-58.9	-94.3	0	0	0	108.4	V329 S330 H387 R388 M395	V329-F397 WeakPolarHBondContact CA-O 3.44Å; S330-F397 PolarHBondContact N-O 2.74Å; S330-F397 PolarHBondContact O-N 2.92Å; H387-F397 AromaticContact CE1-CD1 3.87Å; H387-F397 AromaticContact NE2-CD1 3.83Å; R388-F397 HydrophobicContact CG-CD1 3.99Å; R388-F397 HydrophobicContact CG-CE1 3.69Å; M395-F397 HydrophobicContact CB-CE2 4.16Å; M395-F397 HydrophobicContact CB-CZ 4.33Å
398	V	93.1	Very high	75.8	Confident	1 Å²	1	92.2 Å²	92.2	1%	0.006	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.5	178.2	-171.1	0	0	0	0	108.1	L327 W328 V329 F345 I383 L386 H387 I396	L327-V398 HydrophobicContact CB-CG1 4.21Å; L327-V398 HydrophobicContact CD1-CG1 4.08Å; L327-V398 HydrophobicContact CD2-CG1 4.49Å; W328-V398 WeakPolarHBondContact O-CA 3.49Å; V329-V398 HydrophobicContact CG1-CG2 4.46Å; F345-V398 HydrophobicContact CE1-CG1 3.97Å; F345-V398 HydrophobicContact CE1-CG2 4.4Å; F345-V398 HydrophobicContact CZ-CG1 4.06Å; F345-V398 HydrophobicContact CZ-CG2 3.74Å; I383-V398 HydrophobicContact CG1-CG1 3.93Å; L386-V398 HydrophobicContact CB-CG2 3.93Å; H387-V398 HydrophobicContact CB-CB 4.36Å; H387-V398 PolarHBondContact ND1-N 3.42Å; H387-V398 PolarHBondContact ND1-O 3.39Å; I396-V398 HydrophobicContact CD1-CG2 4Å
399	E	91.7	Very high	73.5	Confident	81 Å²	81	93.8 Å²	93.8	38%	0.379	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	157.1	178.6	-164.2	-174.4	151.1	0	0	108.9	L327 W328 A401 K402	L327-E399 WeakPolarHBondContact CA-O 3.17Å; W328-E399 HydrophobicContact CE3-CB 4.17Å; W328-E399 WeakPolarHBondContact CZ3-OE2 3.27Å; W328-E399 PolarHBondContact N-O 3.08Å; W328-E399 PolarHBondContact O-N 3.37Å; E399-A401 PolarHBondContact O-N 3.46Å; E399-K402 IonicContact OE1-NZ 2.66Å
400	R	90.6	Very high	71.2	Confident	103 Å²	103	98 Å²	98	39%	0.389	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	128.9	165.8	-67.6	-170.5	-174.2	-85.5	10.3	108.6	I383 K402	I383-R400 HydrophobicContact CD1-CB 4.43Å; I383-R400 HydrophobicContact CD1-CG 3.46Å; I383-R400 VanDerWaalsContact CD1-CG 3.46Å; R400-K402 PolarHBondContact O-N 3.12Å
401	A	85.6	Confident	68.7	Low	11 Å²	11	95.9 Å²	95.9	9%	0.091	53%	0.533	C	S	.	.			trans	-66.5	123.8	173	0	0	0	0	0	109.2	N326 W328 E399 N403	N326-A401 HydrophobicContact CB-CB 3.78Å; N326-A401 VanDerWaalsContact O-CB 3.27Å; N326-A401 WeakPolarHBondContact O-CB 3.46Å; N326-A401 PolarHBondContact O-N 2.72Å; W328-A401 HydrophobicContact CB-CB 4.33Å; E399-A401 PolarHBondContact O-N 3.46Å; A401-N403 PolarHBondContact O-N 3.34Å
402	K	76.1	Confident	66.4	Low	184 Å²	184	102.7 Å²	102.7	80%	0.8	57%	0.57	S	S	*	*			trans	-66.4	103.6	171.6	-67.4	179	-174.9	173.7	0	107.9	E399 R400 E404	E399-K402 IonicContact OE1-NZ 2.66Å; R400-K402 PolarHBondContact O-N 3.12Å; K402-E404 PolarHBondContact O-N 2.86Å; K402-E404 VanDerWaalsContact O-N 3.08Å
403	N	56.7	Low	64	Low	88 Å²	88	107.9 Å²	107.9	47%	0.471	59%	0.591	S	S	.	*			trans	-87.3	82.7	-162	-149.7	68.4	0	0	0	110	N326 A401 P405	N326-N403 PolarHBondContact ND2-OD1 2.64Å; A401-N403 PolarHBondContact O-N 3.34Å; N403-P405 VanDerWaalsContact O-CD 3.22Å; N403-P405 WeakPolarHBondContact O-CD 3.21Å; N403-P405 VanDerWaalsContact O-N 3.1Å
404	E	39.1	Very low	61.6	Low	177 Å²	177	109.1 Å²	109.1	83%	0.827	59%	0.594	S	S	*	*			trans	-50.4	111.2	163.6	-90.4	-76.5	117.6	0	0	109	K402 A406	K402-E404 PolarHBondContact O-N 2.86Å; K402-E404 VanDerWaalsContact O-N 3.08Å; E404-A406 PolarHBondContact O-N 3.32Å
405	P	44.3	Very low	59	Low	103 Å²	103	109.9 Å²	109.9	67%	0.669	62%	0.616	S	S	*	*			trans	-78.1	111	-176.6	30.4	-31	0	0	0	109.3	N403 G407	N403-P405 VanDerWaalsContact O-CD 3.22Å; N403-P405 WeakPolarHBondContact O-CD 3.21Å; N403-P405 VanDerWaalsContact O-N 3.1Å; P405-G407 WeakPolarHBondContact O-CA 3.35Å; P405-G407 PolarHBondContact O-N 2.94Å; P405-G407 VanDerWaalsContact O-N 3.1Å
406	A	45.6	Very low	56.2	Low	102 Å²	102	111.5 Å²	111.5	84%	0.843	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-49.2	121	174.9	0	0	0	0	0	110.4	E404	E404-A406 PolarHBondContact O-N 3.32Å
407	G	42.8	Very low	53.3	Low	79 Å²	79	116.6 Å²	116.6	81%	0.814	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.3	139.6	-146.3	0	0	0	0	0	116.8	P405	P405-G407 WeakPolarHBondContact O-CA 3.35Å; P405-G407 PolarHBondContact O-N 2.94Å; P405-G407 VanDerWaalsContact O-N 3.1Å
408	K	40.9	Very low	50.6	Low	207 Å²	207	121.3 Å²	121.3	90%	0.9	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-98.5	126.2	157.1	-65.7	-176.1	177.6	-175	0	108.5
409	K	39.7	Very low	48.1	Very low	199 Å²	199	130 Å²	130	87%	0.865	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-87.8	145.3	159.4	-72.9	-170.2	174.8	-171.6	0	108.8
410	P	41.1	Very low	45.3	Very low	129 Å²	129	133.9 Å²	133.9	84%	0.838	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-66.2	150.2	167.5	30.4	-34.1	0	0	0	110
411	A	38.8	Very low	42.5	Very low	98 Å²	98	133.1 Å²	133.1	81%	0.81	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-100.6	157.3	174.5	0	0	0	0	0	110.9
412	D	36.9	Very low	39.9	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-69.1	150.8	-168.7	-52.4	-92.2	0	0	0	114.7
413	K	33.2	Very low	37.7	Very low	215 Å²	215	135.6 Å²	135.6	94%	0.935	76%	0.764	S	S	*	*			trans	-132.3	131.8	154.3	-99	-169.6	173.2	-174.6	0	108.6
414	A	33	Very low	36.7	Very low	98 Å²	98	136 Å²	136	81%	0.81	77%	0.774	S	S	*	*			trans	-132.2	164.4	-176.6	0	0	0	0	0	112
415	A	33.7	Very low	36.4	Very low	102 Å²	102	137 Å²	137	84%	0.843	78%	0.775	S	S	*	*			trans	79.1	154.3	170.6	0	0	0	0	0	118.7
416	S	33.6	Very low	35.7	Very low	117 Å²	117	137.6 Å²	137.6	82%	0.818	78%	0.782	S	S	*	*			trans	79.7	117.1	-176.5	-160	0	0	0	0	116.5
417	D	30.9	Very low	35.1	Very low	110 Å²	110	142 Å²	142	59%	0.588	79%	0.785	S	S	*	*			cis	-159.7	163.6	-19.6	-141.1	-1.6	0	0	0	113
418	R	35.3	Very low	34.6	Very low	181 Å²	181	146.1 Å²	146.1	68%	0.683	78%	0.781	S	S	*	*			trans	10.8	148.6	151	-67.6	156.1	-144.8	-153.6	0.2	121
419	R	40.8	Very low	34.4	Very low	184 Å²	184	143.1 Å²	143.1	69%	0.694	77%	0.774	S	S	*	*			cis	-163.9	155.3	-0.9	-98.7	156.9	-175	-176.9	0.8	107.9
420	H	33.1	Very low	34.1	Very low	163 Å²	163	140.3 Å²	140.3	76%	0.755	77%	0.769	S	S	*	*				159.6	165.6	99.4	-103	-67.4	0	0	0	107.7
421	S	32.6	Very low	34	Very low	87 Å²	87	143.6 Å²	143.6	61%	0.608	77%	0.77	S	S	*	*			cis	-173.1	165.4	-12.7	-131.9	0	0	0	0	107.1
422	T	30.3	Very low	34.5	Very low	110 Å²	110	143.6 Å²	143.6	68%	0.675	76%	0.762	S	S	*	*			cis	-163.1	153.3	-16.4	-3.8	0	0	0	0	107.9
423	D	29.7	Very low	34.2	Very low	136 Å²	136	145 Å²	145	73%	0.727	76%	0.763	S	S	*	*			trans	60	149.8	156	-94.1	-90	0	0	0	121.3
424	S	34.6	Very low	33.9	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	76%	0.759	S	S	*	*			cis	-138.5	138.2	-8.5	-52.7	0	0	0	0	106.8
425	K	33	Very low	33.9	Very low	197 Å²	197	143.8 Å²	143.8	86%	0.857	77%	0.766	S	S	*	*				66.6	103.7	60.3	-170.1	175.5	-178.4	175.8	0	116.3
426	S	30.7	Very low	33.7	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	76%	0.76	S	S	*	*				-170.1	130.8	127	51.8	0	0	0	0	112.1
427	E	32.6	Very low	33.7	Very low	194 Å²	194	146.7 Å²	146.7	91%	0.907	76%	0.764	S	S	*	*			trans	-117.7	154.4	167.7	-61.1	168.8	124.7	0	0	108.8
428	K	33.2	Very low	33.9	Very low	167 Å²	167	148.8 Å²	148.8	73%	0.726	78%	0.775	S	S	*	*			trans	-163.1	131.1	135.9	-148.3	-171	169.7	-73.8	0	112.3	D430	K428-D430 IonicContact NZ-OD1 2.8Å; K428-D430 PolarHBondContact NZ-OD1 2.86Å; K428-D430 IonicContact NZ-OD2 3.94Å; K428-D430 PolarHBondContact NZ-OD2 3.26Å
429	D	35.4	Very low	34	Very low	143 Å²	143	147.8 Å²	147.8	77%	0.765	78%	0.784	S	S	*	*			trans	-80.4	150.9	161.1	-78.1	-80.1	0	0	0	112
430	D	33.6	Very low	33.7	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	78%	0.782	S	S	*	*			trans	-157.6	154.3	143.6	-84.7	-43.7	0	0	0	109.3	K428	K428-D430 IonicContact NZ-OD1 2.8Å; K428-D430 PolarHBondContact NZ-OD1 2.86Å; K428-D430 IonicContact NZ-OD2 3.94Å; K428-D430 PolarHBondContact NZ-OD2 3.26Å
431	K	38.2	Very low	33.8	Very low	197 Å²	197	147 Å²	147	86%	0.857	79%	0.791	S	S	*	*			trans	-155	171.1	-173.2	-120.4	-173.4	175	-178.9	0	108.3
432	P	50.9	Low	34	Very low	98 Å²	98	148 Å²	148	64%	0.636	79%	0.787	S	S	*	*			cis	-137.2	-160.1	-0.3	29.1	-2.6	0	0	0	114.6
433	E	29	Very low	34.3	Very low	193 Å²	193	150.5 Å²	150.5	90%	0.902	80%	0.796	S	S	*	*			trans	84.7	144.2	159.8	-49	-163.6	174.7	0	0	119.6
434	G	28.5	Very low	34.7	Very low	81 Å²	81	150.4 Å²	150.4	84%	0.835	79%	0.791	S	S	*	*			trans	140.9	104.8	-176.9	0	0	0	0	0	113.5
435	E	31.8	Very low	35.2	Very low	206 Å²	206	154.6 Å²	154.6	96%	0.963	79%	0.792	S	S	*	*			trans	-66.4	158.8	-175.8	-49.4	173.1	133.2	0	0	115
436	G	30.7	Very low	35.7	Very low	69 Å²	69	150.9 Å²	150.9	71%	0.711	79%	0.786	S	S	*	*			trans	143.3	81.8	142.6	0	0	0	0	0	121.8
437	K	33.2	Very low	36.4	Very low	210 Å²	210	150.6 Å²	150.6	91%	0.913	78%	0.779	S	S	*	*			trans	64.8	127.1	143.6	-60.5	179.2	179.2	177.7	0	121.7
438	D	34.3	Very low	37.1	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	77%	0.774	S	S	*	*			trans	-79.8	144.9	160.1	-50.4	-97.6	0	0	0	113.4
439	D	37.8	Very low	38	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	78%	0.776	S	S	*	*			trans	-172.2	114.9	145.3	-99.7	-37	0	0	0	106.2
440	K	34.5	Very low	38.9	Very low	153 Å²	153	146 Å²	146	67%	0.665	77%	0.77	S	S	*	*			cis	93.4	43.8	38.9	-152.9	-140.5	-165.1	-157	0	115.5	Q442	K440-Q442 PolarHBondContact O-N 2.87Å
441	D	36	Very low	40	Very low	176 Å²	176	149.1 Å²	149.1	94%	0.941	78%	0.777	S	S	*	*			trans	-68.3	94	165.8	-99.8	-31.9	0	0	0	112.1
442	Q	35.1	Very low	41	Very low	110 Å²	110	144 Å²	144	51%	0.514	77%	0.765	S	S	.	*			trans	-89.5	106.4	167.5	-72.9	-175	-104.4	0	0	110.9	K440 E444	K440-Q442 PolarHBondContact O-N 2.87Å; Q442-E444 VanDerWaalsContact C-N 3.34Å; Q442-E444 HydrophobicContact CB-CG 3.98Å; Q442-E444 PolarHBondContact NE2-OE1 2.84Å; Q442-E444 PolarHBondContact O-N 2.77Å
443	N	37.5	Very low	41.2	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	77%	0.772	S	S	*	*			trans	-81.4	78.8	170.7	-173.3	19.4	0	0	0	110.9	R445	N443-R445 PolarHBondContact O-N 2.73Å
444	E	39.2	Very low	42.3	Very low	134 Å²	134	142.9 Å²	142.9	63%	0.626	77%	0.773	S	S	*	*			trans	-72.6	107.8	-174.8	-61.2	-167.2	175.1	0	0	112.6	Q442 T446	Q442-E444 VanDerWaalsContact C-N 3.34Å; Q442-E444 HydrophobicContact CB-CG 3.98Å; Q442-E444 PolarHBondContact NE2-OE1 2.84Å; Q442-E444 PolarHBondContact O-N 2.77Å; E444-T446 PolarHBondContact O-N 3.37Å
445	R	44.6	Very low	43.6	Very low	186 Å²	186	147.2 Å²	147.2	70%	0.702	77%	0.771	S	S	*	*			trans	-89.8	77.2	-175.2	-169	-177.2	-177.6	-169.8	0.5	111.8	N443 V447	N443-R445 PolarHBondContact O-N 2.73Å; R445-V447 PolarHBondContact O-N 2.9Å
446	T	43.8	Very low	44.2	Very low	118 Å²	118	143.3 Å²	143.3	72%	0.724	76%	0.764	S	S	*	*			trans	-65.1	115.3	177.4	56.6	0	0	0	0	112.1	E444	E444-T446 PolarHBondContact O-N 3.37Å
447	V	45.1	Very low	44.6	Very low	111 Å²	111	146.1 Å²	146.1	67%	0.673	77%	0.767	S	S	*	*			trans	-93.8	107.5	171	180	0	0	0	0	108.8	R445	R445-V447 PolarHBondContact O-N 2.9Å
448	V	46.2	Very low	45	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-92.7	125.8	174.8	-178.7	0	0	0	0	109
449	M	53.2	Low	45.5	Very low	156 Å²	156	138.4 Å²	138.4	77%	0.768	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-85.9	120.4	176.2	-69.1	-72.4	-169.3	0	0	110.7
450	D	53.3	Low	45.7	Very low	119 Å²	119	137 Å²	137	64%	0.636	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-87.8	122.8	156.3	-170.8	-38.4	0	0	0	108	S452	D450-S452 PolarHBondContact O-N 2.82Å; D450-S452 VanDerWaalsContact OD1-CB 3.32Å; D450-S452 WeakPolarHBondContact OD1-CB 3.42Å; D450-S452 PolarHBondContact OD1-N 3.07Å; D450-S452 PolarHBondContact OD1-OG 3.12Å
451	K	57.3	Low	45.8	Very low	208 Å²	208	139.3 Å²	139.3	90%	0.904	75%	0.754	S	S	*	*	S	Bend	trans	-80.9	2.4	-174.8	-69	-174.1	175.5	-177.7	0	114
452	S	58.6	Low	46.1	Very low	88 Å²	88	137.2 Å²	137.2	62%	0.615	75%	0.748	S	S	*	*	S	Bend	trans	-99.1	-25.3	-170.5	68	0	0	0	0	115.9	D450	D450-S452 PolarHBondContact O-N 2.82Å; D450-S452 VanDerWaalsContact OD1-CB 3.32Å; D450-S452 WeakPolarHBondContact OD1-CB 3.42Å; D450-S452 PolarHBondContact OD1-N 3.07Å; D450-S452 PolarHBondContact OD1-OG 3.12Å
453	K	55.5	Low	46.1	Very low	180 Å²	180	141.2 Å²	141.2	78%	0.783	76%	0.764	S	S	*	*	S	Bend	trans	-146	115.4	179	-63.2	-170.3	-179.3	-175.1	0	111.5	E455	K453-E455 PolarHBondContact O-N 3.01Å
454	G	51.7	Low	46.3	Very low	89 Å²	89	138.9 Å²	138.9	92%	0.918	76%	0.76	S	S	*	*			trans	-86.3	87.4	-170.2	0	0	0	0	0	115.2
455	E	55.5	Low	46.1	Very low	171 Å²	171	141.6 Å²	141.6	80%	0.799	77%	0.77	S	S	*	*			trans	-156.5	125.8	157.5	-122.2	177	-137.8	0	0	110.9	K453 V457	K453-E455 PolarHBondContact O-N 3.01Å; E455-V457 PolarHBondContact O-N 3.47Å
456	P	44.6	Very low	45.7	Very low	124 Å²	124	137.9 Å²	137.9	81%	0.805	77%	0.772	S	S	*	*			trans	-86.7	93	-169	32.8	-35.1	0	0	0	113.7
457	V	39.6	Very low	45.3	Very low	128 Å²	128	144 Å²	144	78%	0.776	78%	0.782	S	S	*	*			trans	-85.1	113.1	177.6	-177	0	0	0	0	112.1	E455	E455-V457 PolarHBondContact O-N 3.47Å
458	V	42.4	Very low	44.8	Very low	91 Å²	91	147.1 Å²	147.1	55%	0.552	79%	0.79	S	S	*	*			trans	-82.3	118.3	174.2	179.1	0	0	0	0	110.1	V460	V458-V460 HydrophobicContact CG1-CG2 4.47Å
459	S	45.1	Very low	44.4	Very low	112 Å²	112	153 Å²	153	78%	0.783	80%	0.798	S	S	*	*			trans	-110.7	140.2	168.1	66.7	0	0	0	0	111.4
460	V	41.7	Very low	43.7	Very low	130 Å²	130	151 Å²	151	79%	0.788	80%	0.799	S	S	*	*			trans	-119.2	125.1	177.1	180	0	0	0	0	107.8	V458	V458-V460 HydrophobicContact CG1-CG2 4.47Å
461	K	35.9	Very low	43	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	81%	0.809	S	S	*	*			trans	-118.4	92.4	-170.2	-165.6	158.1	-171.7	165.7	0	112.3
462	T	42.3	Very low	42.1	Very low	133 Å²	133	150.7 Å²	150.7	82%	0.816	81%	0.807	S	S	*	*			trans	-73.2	152.3	168.7	55.2	0	0	0	0	110.8
463	K	35.3	Very low	41.1	Very low	193 Å²	193	151.8 Å²	151.8	84%	0.839	82%	0.815	S	S	*	*			trans	-147	107.4	-171.9	-176	-175.8	-177.5	-176.6	0	111.6
464	S	41.3	Very low	40.4	Very low	113 Å²	113	155.2 Å²	155.2	79%	0.79	82%	0.823	S	S	*	*			trans	155.4	163.9	136.3	-73.7	0	0	0	0	112.5
465	K	34.7	Very low	39.6	Very low	191 Å²	191	156.9 Å²	156.9	83%	0.83	82%	0.82	S	S	*	*			cis	-176	133.3	-42	-166	-179.2	-178.3	-174.2	0	107.4
466	S	36.5	Very low	39.4	Very low	107 Å²	107	160.7 Å²	160.7	75%	0.748	83%	0.828	S	S	*	*			trans	57.3	117.3	157.6	-171.4	0	0	0	0	121
467	R	34.7	Very low	38.8	Very low	246 Å²	246	160 Å²	160	93%	0.928	83%	0.832	S	S	*	*				-163.6	142.1	114.6	-123.4	172.3	177.6	145.9	-0.6	112.3
468	E	36.3	Very low	39.3	Very low	178 Å²	178	159.8 Å²	159.8	83%	0.832	84%	0.836	S	S	*	*			trans	-92.8	155.3	174.5	-54.4	173.7	121.4	0	0	111.8
469	R	37	Very low	39	Very low	254 Å²	254	161.3 Å²	161.3	96%	0.958	85%	0.851	S	S	*	*				-170.9	148	126.1	-103.9	157.4	-173.5	178.8	0.2	114.4
470	S	39.4	Very low	39.5	Very low	114 Å²	114	160.8 Å²	160.8	80%	0.797	85%	0.847	S	S	*	*			trans	-78.4	151.5	-179.3	173.2	0	0	0	0	113.6
471	S	37.8	Very low	40.1	Very low	121 Å²	121	164 Å²	164	85%	0.846	85%	0.851	S	S	*	*				-170.4	167.9	126.2	48.9	0	0	0	0	111.8
472	K	38.2	Very low	40.8	Very low	199 Å²	199	161.6 Å²	161.6	87%	0.865	84%	0.843	S	S	*	*			trans	-143.9	110.9	-164.6	-177.2	-166.4	-175	75	0	113.3
473	S	37.9	Very low	41.4	Very low	112 Å²	112	167.1 Å²	167.1	78%	0.783	85%	0.849	S	S	*	*			trans	-141.3	137.2	165.8	-51.7	0	0	0	0	107
474	R	40.8	Very low	42.4	Very low	251 Å²	251	165.5 Å²	165.5	95%	0.947	84%	0.841	S	S	*	*				50.7	124.1	60.3	-71.2	-179.2	168.7	163.4	-4.5	110.8
475	S	35.6	Very low	43.3	Very low	124 Å²	124	167 Å²	167	87%	0.867	84%	0.841	S	S	*	*			cis	-138.6	-174.2	24.6	56.5	0	0	0	0	113.7
476	R	49.7	Very low	44.9	Very low	252 Å²	252	165.7 Å²	165.7	95%	0.951	84%	0.841	S	S	*	*			trans	-91.1	138.5	176.5	-69.2	172.6	164.8	130.1	-8.5	111.3
477	A	33.5	Very low	46.3	Very low	109 Å²	109	164.1 Å²	164.1	90%	0.901	82%	0.824	S	S	*	*			trans	-155.5	158.1	153.5	0	0	0	0	0	109.1
478	S	48.8	Very low	48.3	Very low	123 Å²	123	156.1 Å²	156.1	86%	0.86	80%	0.803	S	S	*	*			trans	-136.8	136.8	-167.7	56.4	0	0	0	0	113.8
479	S	37.2	Very low	49.4	Very low	123 Å²	123	156.4 Å²	156.4	86%	0.86	80%	0.801	S	S	*	*			trans	-154.8	161.8	154	60.3	0	0	0	0	111.2
480	S	55.2	Low	51.2	Low	101 Å²	101	147.8 Å²	147.8	71%	0.706	78%	0.784	S	S	*	*			trans	-91.1	177.1	-171.4	55.6	0	0	0	0	114.3
481	K	54.4	Low	52.9	Low	197 Å²	197	146.9 Å²	146.9	86%	0.857	77%	0.768	S	S	*	*			trans	83.1	137.4	-169.5	-51.7	149.8	-173.6	175.9	0	111.1
482	E	50	Low	54.7	Low	153 Å²	153	144.7 Å²	144.7	72%	0.715	75%	0.746	S	S	*	*			cis	-147.2	144.5	19.4	-162.5	164.7	-121	0	0	110.9	K484	E482-K484 PolarHBondContact O-N 2.91Å
483	R	55.1	Low	56.7	Low	249 Å²	249	143.3 Å²	143.3	94%	0.94	74%	0.74	S	S	*	*			trans	-81.1	105.3	177.4	-82.8	-174.5	170.3	-168	-1.9	109.8
484	K	56.9	Low	58.7	Low	158 Å²	158	140.7 Å²	140.7	69%	0.687	73%	0.725	S	S	*	*			trans	-93.1	107.8	176	-62.5	-167.7	176.6	-171	0	112.1	E482 I486	E482-K484 PolarHBondContact O-N 2.91Å; K484-I486 PolarHBondContact O-N 2.85Å
485	D	60.3	Low	60.6	Low	146 Å²	146	133.7 Å²	133.7	78%	0.781	70%	0.703	S	S	*	*			trans	52.5	50.1	138.4	-47.5	-38	0	0	0	118.6	L487	D485-L487 PolarHBondContact O-N 2.98Å
486	I	66.6	Low	62.7	Low	162 Å²	162	136.7 Å²	136.7	83%	0.831	70%	0.695	S	S	*	*			trans	-77.3	100.1	150.6	-56.7	178.3	0	0	0	107	K484 T488	K484-I486 PolarHBondContact O-N 2.85Å; I486-T488 PolarHBondContact O-N 3.18Å
487	L	65.9	Low	64.3	Low	75 Å²	75	132.3 Å²	132.3	39%	0.393	68%	0.683	S	S	.	*			trans	-53.9	132	174.8	-72.4	163.2	0	0	0	110.2	D485 Q491 I492	D485-L487 PolarHBondContact O-N 2.98Å; L487-Q491 HydrophobicContact CB-CB 4.19Å; L487-Q491 HydrophobicContact CD2-CB 4.1Å; L487-I492 HydrophobicContact CB-CG1 3.96Å; L487-I492 VanDerWaalsContact O-CD1 3.26Å; L487-I492 WeakPolarHBondContact O-CD1 3.44Å
488	T	77.1	Confident	66.4	Low	78 Å²	78	135.5 Å²	135.5	48%	0.479	67%	0.671	S	S	.	*			trans	-60.7	155.8	-178.2	59.4	0	0	0	0	111.5	I486 A490 Q491 I492	I486-T488 PolarHBondContact O-N 3.18Å; T488-A490 PolarHBondContact O-N 2.75Å; T488-A490 VanDerWaalsContact O-N 3.09Å; T488-Q491 CarbonylContact O-C 3.59Å; T488-Q491 WeakPolarHBondContact O-CA 3.45Å; T488-Q491 PolarHBondContact O-N 2.78Å; T488-Q491 WeakPolarHBondContact OG1-CB 3.18Å; T488-Q491 WeakPolarHBondContact OG1-CG 3.45Å; T488-Q491 PolarHBondContact OG1-N 2.99Å; T488-Q491 PolarHBondContact OG1-OE1 3.45Å; T488-I492 PolarHBondContact O-N 2.92Å
489	F	59.6	Low	68	Low	184 Å²	184	135.2 Å²	135.2	81%	0.807	66%	0.657	S	S	*	*	H	α-helix	trans	-55	-31.7	175.6	-101.6	-86.9	0	0	0	113	K493	F489-K493 WeakPolarHBondContact O-CB 3.17Å; F489-K493 PolarHBondContact O-N 3.15Å
490	A	75.7	Confident	70.4	Confident	72 Å²	72	135.9 Å²	135.9	60%	0.595	64%	0.644	S	S	*	*	H	α-helix	trans	-65.9	-46.9	171.6	0	0	0	0	0	112.1	T488 K493 A494	T488-A490 PolarHBondContact O-N 2.75Å; T488-A490 VanDerWaalsContact O-N 3.09Å; A490-K493 PolarHBondContact O-N 2.93Å; A490-A494 VanDerWaalsContact O-CB 3.27Å; A490-A494 WeakPolarHBondContact O-CB 3.44Å; A490-A494 PolarHBondContact O-N 3.46Å
491	Q	75.3	Confident	71.7	Confident	96 Å²	96	137.3 Å²	137.3	45%	0.449	64%	0.64	S	S	.	*	H	α-helix	trans	-65.1	-38.4	175.1	-73.5	162.1	-46.6	0	0	112.6	L487 T488 A494 Q495	L487-Q491 HydrophobicContact CB-CB 4.19Å; L487-Q491 HydrophobicContact CD2-CB 4.1Å; T488-Q491 CarbonylContact O-C 3.59Å; T488-Q491 WeakPolarHBondContact O-CA 3.45Å; T488-Q491 PolarHBondContact O-N 2.78Å; T488-Q491 WeakPolarHBondContact OG1-CB 3.18Å; T488-Q491 WeakPolarHBondContact OG1-CG 3.45Å; T488-Q491 PolarHBondContact OG1-N 2.99Å; T488-Q491 PolarHBondContact OG1-OE1 3.45Å; Q491-A494 PolarHBondContact O-N 3.06Å; Q491-Q495 WeakPolarHBondContact O-CB 3.48Å; Q491-Q495 PolarHBondContact O-N 2.75Å
492	I	75.9	Confident	73.2	Confident	75 Å²	75	133.8 Å²	133.8	39%	0.385	62%	0.624	S	S	.	*	H	α-helix	trans	-65.5	-44.2	174.2	-65.5	172.4	0	0	0	110.2	L487 T488 A494 Q495 R496	L487-I492 HydrophobicContact CB-CG1 3.96Å; L487-I492 VanDerWaalsContact O-CD1 3.26Å; L487-I492 WeakPolarHBondContact O-CD1 3.44Å; T488-I492 PolarHBondContact O-N 2.92Å; I492-A494 VanDerWaalsContact C-N 3.33Å; I492-A494 PolarHBondContact O-N 2.81Å; I492-Q495 PolarHBondContact O-N 3.2Å; I492-R496 VanDerWaalsContact O-CB 3.27Å; I492-R496 WeakPolarHBondContact O-CB 3.4Å; I492-R496 PolarHBondContact O-N 3.48Å
493	K	79.6	Confident	74.7	Confident	170 Å²	170	131.5 Å²	131.5	74%	0.739	61%	0.613	S	S	*	*	H	α-helix	trans	-65.1	-37	176.6	-162.2	172.5	-172.6	178.7	0	111.4	F489 A490 K497	F489-K493 WeakPolarHBondContact O-CB 3.17Å; F489-K493 PolarHBondContact O-N 3.15Å; A490-K493 PolarHBondContact O-N 2.93Å; K493-K497 VanDerWaalsContact O-CB 3.26Å; K493-K497 WeakPolarHBondContact O-CB 3.29Å; K493-K497 PolarHBondContact O-N 2.74Å
494	A	79.3	Confident	75.8	Confident	57 Å²	57	127.5 Å²	127.5	47%	0.471	60%	0.598	S	S	.	*	H	α-helix	trans	-69.4	-42.3	173.3	0	0	0	0	0	112.6	A490 Q491 I492 K497 R498	A490-A494 VanDerWaalsContact O-CB 3.27Å; A490-A494 WeakPolarHBondContact O-CB 3.44Å; A490-A494 PolarHBondContact O-N 3.46Å; Q491-A494 PolarHBondContact O-N 3.06Å; I492-A494 VanDerWaalsContact C-N 3.33Å; I492-A494 PolarHBondContact O-N 2.81Å; A494-K497 PolarHBondContact O-N 3.32Å; A494-R498 VanDerWaalsContact O-CB 3.28Å; A494-R498 WeakPolarHBondContact O-CB 3.49Å; A494-R498 PolarHBondContact O-N 2.8Å
495	Q	81.3	Confident	76.9	Confident	104 Å²	104	124.5 Å²	124.5	49%	0.486	59%	0.587	S	S	.	*	H	α-helix	trans	-63.2	-45.7	175.3	-179.8	174.2	-6.4	0	0	110.6	Q491 I492 K497 R498 E499	Q491-Q495 WeakPolarHBondContact O-CB 3.48Å; Q491-Q495 PolarHBondContact O-N 2.75Å; I492-Q495 PolarHBondContact O-N 3.2Å; Q495-K497 VanDerWaalsContact C-N 3.34Å; Q495-K497 PolarHBondContact O-N 2.81Å; Q495-R498 CarbonylContact O-C 3.53Å; Q495-R498 PolarHBondContact O-N 2.91Å; Q495-E499 VanDerWaalsContact O-CB 3.24Å; Q495-E499 WeakPolarHBondContact O-CB 3.32Å; Q495-E499 PolarHBondContact O-N 3.09Å
496	R	79.5	Confident	77.9	Confident	187 Å²	187	125.9 Å²	125.9	71%	0.706	58%	0.581	S	S	*	*	H	α-helix	trans	-67.6	-31.9	176.3	-152.6	176.3	-157.5	179.7	5.9	112.4	I492 K500	I492-R496 VanDerWaalsContact O-CB 3.27Å; I492-R496 WeakPolarHBondContact O-CB 3.4Å; I492-R496 PolarHBondContact O-N 3.48Å; R496-K500 VanDerWaalsContact O-CB 3.27Å; R496-K500 WeakPolarHBondContact O-CB 3.46Å; R496-K500 PolarHBondContact O-N 3.39Å
497	K	82.4	Confident	78.6	Confident	160 Å²	160	122.4 Å²	122.4	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-67.7	-43.5	169.6	-172	177.7	-179.7	-177.1	0	111.2	K493 A494 Q495 E499 K500 Q501	K493-K497 VanDerWaalsContact O-CB 3.26Å; K493-K497 WeakPolarHBondContact O-CB 3.29Å; K493-K497 PolarHBondContact O-N 2.74Å; A494-K497 PolarHBondContact O-N 3.32Å; Q495-K497 VanDerWaalsContact C-N 3.34Å; Q495-K497 PolarHBondContact O-N 2.81Å; K497-E499 VanDerWaalsContact C-N 3.34Å; K497-K500 PolarHBondContact O-N 3.34Å; K497-Q501 VanDerWaalsContact O-CB 3.25Å; K497-Q501 WeakPolarHBondContact O-CB 3.36Å; K497-Q501 PolarHBondContact O-N 3.39Å
498	R	79.1	Confident	79.2	Confident	175 Å²	175	125.5 Å²	125.5	66%	0.66	58%	0.575	S	S	*	*	H	α-helix	trans	-68.3	-32.1	176.9	-165.8	176.2	-168.3	178.3	4.5	112.4	A494 Q495 K502	A494-R498 VanDerWaalsContact O-CB 3.28Å; A494-R498 WeakPolarHBondContact O-CB 3.49Å; A494-R498 PolarHBondContact O-N 2.8Å; Q495-R498 CarbonylContact O-C 3.53Å; Q495-R498 PolarHBondContact O-N 2.91Å; R498-K502 WeakPolarHBondContact O-CG 3.28Å; R498-K502 PolarHBondContact O-N 3.48Å
499	E	81.9	Confident	79.3	Confident	118 Å²	118	127.6 Å²	127.6	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-72.8	-47.4	173	-176	167.7	-122.8	0	0	111	Q495 K497 Q501 K502 Q503	Q495-E499 VanDerWaalsContact O-CB 3.24Å; Q495-E499 WeakPolarHBondContact O-CB 3.32Å; Q495-E499 PolarHBondContact O-N 3.09Å; K497-E499 VanDerWaalsContact C-N 3.34Å; E499-Q501 PolarHBondContact O-N 3.03Å; E499-K502 CarbonylContact O-C 3.54Å; E499-K502 PolarHBondContact O-N 3.11Å; E499-K502 VanDerWaalsContact O-N 3.15Å; E499-Q503 WeakPolarHBondContact O-CB 3.24Å; E499-Q503 PolarHBondContact O-N 3.22Å
500	K	87.3	Confident	80	Confident	137 Å²	137	125 Å²	125	60%	0.596	57%	0.565	S	S	*	*	H	α-helix	trans	-62.7	-28.2	171.5	-169.3	166.8	-175.8	171	0	112.6	R496 K497 R504	R496-K500 VanDerWaalsContact O-CB 3.27Å; R496-K500 WeakPolarHBondContact O-CB 3.46Å; R496-K500 PolarHBondContact O-N 3.39Å; K497-K500 PolarHBondContact O-N 3.34Å; K500-R504 WeakPolarHBondContact O-CB 3.23Å; K500-R504 WeakPolarHBondContact O-CG 3.42Å; K500-R504 PolarHBondContact O-N 2.82Å
501	Q	82.1	Confident	80	Confident	131 Å²	131	123.7 Å²	123.7	61%	0.612	55%	0.554	S	S	*	*	H	α-helix	trans	-72.3	-44.6	171.6	-172.5	175.4	6.3	0	0	111.7	K497 E499 Q503 R504 E505	K497-Q501 VanDerWaalsContact O-CB 3.25Å; K497-Q501 WeakPolarHBondContact O-CB 3.36Å; K497-Q501 PolarHBondContact O-N 3.39Å; E499-Q501 PolarHBondContact O-N 3.03Å; Q501-Q503 VanDerWaalsContact C-N 3.3Å; Q501-Q503 PolarHBondContact O-N 2.97Å; Q501-R504 CarbonylContact O-C 3.59Å; Q501-R504 PolarHBondContact O-N 3.36Å; Q501-E505 WeakPolarHBondContact O-CB 3.26Å; Q501-E505 PolarHBondContact O-N 3Å
502	K	85.7	Confident	79.8	Confident	122 Å²	122	125 Å²	125	53%	0.53	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-34	171.1	-77.6	178.5	174.9	-172	0	112.8	R498 E499 E505 R506	R498-K502 WeakPolarHBondContact O-CG 3.28Å; R498-K502 PolarHBondContact O-N 3.48Å; E499-K502 CarbonylContact O-C 3.54Å; E499-K502 PolarHBondContact O-N 3.11Å; E499-K502 VanDerWaalsContact O-N 3.15Å; K502-E505 PolarHBondContact O-N 3.07Å; K502-R506 WeakPolarHBondContact O-CG 3.33Å; K502-R506 PolarHBondContact O-N 3.35Å
503	Q	82.1	Confident	79.5	Confident	105 Å²	105	129.3 Å²	129.3	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-67.4	-49.2	173.7	-175.4	-179.9	-20.7	0	0	109.8	E499 Q501 E505 R506 E507	E499-Q503 WeakPolarHBondContact O-CB 3.24Å; E499-Q503 PolarHBondContact O-N 3.22Å; Q501-Q503 VanDerWaalsContact C-N 3.3Å; Q501-Q503 PolarHBondContact O-N 2.97Å; Q503-E505 VanDerWaalsContact C-N 3.26Å; Q503-E505 PolarHBondContact O-N 3.27Å; Q503-R506 CarbonylContact O-C 3.59Å; Q503-R506 WeakPolarHBondContact O-CA 3.31Å; Q503-R506 WeakPolarHBondContact O-CB 3.45Å; Q503-R506 PolarHBondContact O-N 2.84Å; Q503-E507 HydrophobicContact CG-CG 4.34Å; Q503-E507 VanDerWaalsContact CG-OE1 3.31Å; Q503-E507 WeakPolarHBondContact CG-OE1 3.48Å; Q503-E507 PolarHBondContact NE2-OE1 2.8Å; Q503-E507 WeakPolarHBondContact O-CB 3.23Å; Q503-E507 VanDerWaalsContact O-CG 3.31Å; Q503-E507 WeakPolarHBondContact O-CG 3.21Å; Q503-E507 PolarHBondContact O-N 2.8Å
504	R	78.1	Confident	78.8	Confident	165 Å²	165	127.7 Å²	127.7	62%	0.623	57%	0.565	S	S	*	*	H	α-helix	trans	-59.9	-31.9	172	-81.3	-177.4	165	-169.2	-6.1	113.6	K500 Q501 E507 M508	K500-R504 WeakPolarHBondContact O-CB 3.23Å; K500-R504 WeakPolarHBondContact O-CG 3.42Å; K500-R504 PolarHBondContact O-N 2.82Å; Q501-R504 CarbonylContact O-C 3.59Å; Q501-R504 PolarHBondContact O-N 3.36Å; R504-E507 WeakPolarHBondContact CA-OE2 3.44Å; R504-M508 WeakPolarHBondContact O-CB 3.31Å; R504-M508 PolarHBondContact O-N 2.82Å
505	E	81.1	Confident	78	Confident	95 Å²	95	133.4 Å²	133.4	44%	0.444	57%	0.574	S	S	.	*	H	α-helix	trans	-68.4	-39.3	173.3	-166.3	-158.8	150.9	0	0	111.5	Q501 K502 Q503 R509	Q501-E505 WeakPolarHBondContact O-CB 3.26Å; Q501-E505 PolarHBondContact O-N 3Å; K502-E505 PolarHBondContact O-N 3.07Å; Q503-E505 VanDerWaalsContact C-N 3.26Å; Q503-E505 PolarHBondContact O-N 3.27Å; E505-R509 VanDerWaalsContact O-CB 3.24Å; E505-R509 WeakPolarHBondContact O-CB 3.45Å; E505-R509 PolarHBondContact O-N 2.99Å; E505-R509 IonicContact OE1-CZ 3.84Å; E505-R509 IonicContact OE1-NH1 2.81Å; E505-R509 PolarHBondContact OE1-NH1 2.78Å; E505-R509 IonicContact OE1-NH2 3.33Å
506	R	80	Confident	77	Confident	175 Å²	175	134.8 Å²	134.8	66%	0.66	58%	0.579	S	S	*	*	H	α-helix	trans	-67.1	-50.1	172.2	-71.5	173.2	-175.8	-166.9	-0.2	111.3	K502 Q503 M508 R509 E510	K502-R506 WeakPolarHBondContact O-CG 3.33Å; K502-R506 PolarHBondContact O-N 3.35Å; Q503-R506 CarbonylContact O-C 3.59Å; Q503-R506 WeakPolarHBondContact O-CA 3.31Å; Q503-R506 WeakPolarHBondContact O-CB 3.45Å; Q503-R506 PolarHBondContact O-N 2.84Å; R506-M508 VanDerWaalsContact C-N 3.27Å; R506-M508 PolarHBondContact O-N 2.78Å; R506-R509 CarbonylContact O-C 3.52Å; R506-R509 PolarHBondContact O-N 3.37Å; R506-R509 VanDerWaalsContact O-N 3.12Å; R506-E510 VanDerWaalsContact O-CB 3.29Å; R506-E510 WeakPolarHBondContact O-CB 3.23Å; R506-E510 WeakPolarHBondContact O-CG 3.11Å; R506-E510 PolarHBondContact O-N 3.3Å
507	E	82.7	Confident	76	Confident	90 Å²	90	131 Å²	131	42%	0.421	57%	0.572	S	S	.	*	H	α-helix	trans	-57.9	-39.2	176.3	-69.2	163.7	171.7	0	0	111.2	Q503 R504 A511	Q503-E507 HydrophobicContact CG-CG 4.34Å; Q503-E507 VanDerWaalsContact CG-OE1 3.31Å; Q503-E507 WeakPolarHBondContact CG-OE1 3.48Å; Q503-E507 PolarHBondContact NE2-OE1 2.8Å; Q503-E507 WeakPolarHBondContact O-CB 3.23Å; Q503-E507 VanDerWaalsContact O-CG 3.31Å; Q503-E507 WeakPolarHBondContact O-CG 3.21Å; Q503-E507 PolarHBondContact O-N 2.8Å; R504-E507 WeakPolarHBondContact CA-OE2 3.44Å; E507-A511 WeakPolarHBondContact O-CB 3.11Å; E507-A511 PolarHBondContact O-N 2.75Å
508	M	77.8	Confident	75	Confident	139 Å²	139	127.6 Å²	127.6	69%	0.685	56%	0.562	S	S	*	*	H	α-helix	trans	-66.4	-47.4	173.4	-176.7	-170.3	-63	0	0	111.7	R504 R506 E510 A511 E512	R504-M508 WeakPolarHBondContact O-CB 3.31Å; R504-M508 PolarHBondContact O-N 2.82Å; R506-M508 VanDerWaalsContact C-N 3.27Å; R506-M508 PolarHBondContact O-N 2.78Å; M508-E510 VanDerWaalsContact C-N 3.31Å; M508-E510 PolarHBondContact O-N 2.91Å; M508-A511 PolarHBondContact O-N 3.29Å; M508-E512 VanDerWaalsContact O-CB 3.23Å; M508-E512 WeakPolarHBondContact O-CB 3.47Å; M508-E512 PolarHBondContact O-N 2.89Å
509	R	77.9	Confident	74	Confident	123 Å²	123	128.7 Å²	128.7	46%	0.464	57%	0.566	S	S	.	*	H	α-helix	trans	-71.2	-24.8	179.8	-175.5	171.2	-83	125.9	-8.7	112.8	E505 R506 R513	E505-R509 VanDerWaalsContact O-CB 3.24Å; E505-R509 WeakPolarHBondContact O-CB 3.45Å; E505-R509 PolarHBondContact O-N 2.99Å; E505-R509 IonicContact OE1-CZ 3.84Å; E505-R509 IonicContact OE1-NH1 2.81Å; E505-R509 PolarHBondContact OE1-NH1 2.78Å; E505-R509 IonicContact OE1-NH2 3.33Å; R506-R509 CarbonylContact O-C 3.52Å; R506-R509 PolarHBondContact O-N 3.37Å; R506-R509 VanDerWaalsContact O-N 3.12Å; R509-R513 WeakPolarHBondContact O-CB 3.49Å; R509-R513 WeakPolarHBondContact O-CD 3.31Å; R509-R513 WeakPolarHBondContact O-CG 3.31Å; R509-R513 PolarHBondContact O-N 2.83Å; R509-R513 VanDerWaalsContact O-N 3.08Å
510	E	76.2	Confident	72.8	Confident	130 Å²	130	128.3 Å²	128.3	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-82.2	-37.6	171.9	-74.4	177.3	174.8	0	0	111.4	R506 M508 E512 R513 F514	R506-E510 VanDerWaalsContact O-CB 3.29Å; R506-E510 WeakPolarHBondContact O-CB 3.23Å; R506-E510 WeakPolarHBondContact O-CG 3.11Å; R506-E510 PolarHBondContact O-N 3.3Å; M508-E510 VanDerWaalsContact C-N 3.31Å; M508-E510 PolarHBondContact O-N 2.91Å; E510-E512 VanDerWaalsContact C-N 3.32Å; E510-R513 CarbonylContact O-C 3.19Å; E510-R513 PolarHBondContact O-N 2.89Å; E510-F514 VanDerWaalsContact O-CB 3.29Å; E510-F514 WeakPolarHBondContact O-CB 3.41Å; E510-F514 PolarHBondContact O-N 3.04Å
511	A	75.2	Confident	71.3	Confident	43 Å²	43	130.7 Å²	130.7	36%	0.355	57%	0.573	S	S	.	*	H	α-helix	trans	-67.4	-32	169.6	0	0	0	0	0	112.3	E507 M508 F514 R515	E507-A511 WeakPolarHBondContact O-CB 3.11Å; E507-A511 PolarHBondContact O-N 2.75Å; M508-A511 PolarHBondContact O-N 3.29Å; A511-F514 PolarHBondContact O-N 3.42Å; A511-R515 WeakPolarHBondContact O-CB 3.45Å; A511-R515 VanDerWaalsContact O-CG 3.23Å; A511-R515 WeakPolarHBondContact O-CG 3.39Å; A511-R515 PolarHBondContact O-N 2.94Å
512	E	71.3	Confident	70.2	Confident	123 Å²	123	128.6 Å²	128.6	58%	0.575	57%	0.566	S	S	*	*	H	α-helix	trans	-67.2	-47.7	170.9	-179.5	178.4	-127	0	0	110.8	M508 E510 F514 R515 F516	M508-E512 VanDerWaalsContact O-CB 3.23Å; M508-E512 WeakPolarHBondContact O-CB 3.47Å; M508-E512 PolarHBondContact O-N 2.89Å; E510-E512 VanDerWaalsContact C-N 3.32Å; E512-F514 VanDerWaalsContact C-N 3.27Å; E512-F514 PolarHBondContact O-N 3.39Å; E512-R515 PolarHBondContact O-N 3.12Å; E512-F516 VanDerWaalsContact O-CB 3.29Å; E512-F516 WeakPolarHBondContact O-CB 3.27Å; E512-F516 PolarHBondContact O-N 3.28Å
513	R	68.9	Low	69.1	Low	167 Å²	167	127.1 Å²	127.1	63%	0.63	56%	0.564	S	S	*	*	H	α-helix	trans	-60	-36	170.5	-75.7	167.3	-177.1	-103.2	-1	112.4	R509 E510 N517	R509-R513 WeakPolarHBondContact O-CB 3.49Å; R509-R513 WeakPolarHBondContact O-CD 3.31Å; R509-R513 WeakPolarHBondContact O-CG 3.31Å; R509-R513 PolarHBondContact O-N 2.83Å; R509-R513 VanDerWaalsContact O-N 3.08Å; E510-R513 CarbonylContact O-C 3.19Å; E510-R513 PolarHBondContact O-N 2.89Å; R513-N517 VanDerWaalsContact O-CB 3.31Å; R513-N517 WeakPolarHBondContact O-CB 3.21Å; R513-N517 PolarHBondContact O-N 2.67Å
514	F	65	Low	68.4	Low	136 Å²	136	127 Å²	127	60%	0.596	57%	0.572	S	S	*	*	H	α-helix	trans	-66.1	-53.5	175.5	-170.9	-88.2	0	0	0	110.1	E510 A511 E512 F516 N517 D518	E510-F514 VanDerWaalsContact O-CB 3.29Å; E510-F514 WeakPolarHBondContact O-CB 3.41Å; E510-F514 PolarHBondContact O-N 3.04Å; A511-F514 PolarHBondContact O-N 3.42Å; E512-F514 VanDerWaalsContact C-N 3.27Å; E512-F514 PolarHBondContact O-N 3.39Å; F514-F516 VanDerWaalsContact C-N 3.26Å; F514-F516 PolarHBondContact O-N 2.91Å; F514-N517 CarbonylContact O-C 3.59Å; F514-N517 PolarHBondContact O-N 2.86Å; F514-N517 VanDerWaalsContact O-N 3.1Å; F514-D518 WeakPolarHBondContact O-CB 3.4Å; F514-D518 PolarHBondContact O-N 3.47Å
515	R	62.6	Low	67.9	Low	177 Å²	177	122.6 Å²	122.6	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-57.8	-35.4	174.9	-71.2	169.5	-173	-166.6	1.9	112.9	A511 E512 R519	A511-R515 WeakPolarHBondContact O-CB 3.45Å; A511-R515 VanDerWaalsContact O-CG 3.23Å; A511-R515 WeakPolarHBondContact O-CG 3.39Å; A511-R515 PolarHBondContact O-N 2.94Å; E512-R515 PolarHBondContact O-N 3.12Å; R515-R519 WeakPolarHBondContact O-CB 3.45Å; R515-R519 VanDerWaalsContact O-CG 3.31Å; R515-R519 WeakPolarHBondContact O-CG 3.04Å; R515-R519 PolarHBondContact O-N 3.46Å
516	F	60.1	Low	67.5	Low	132 Å²	132	123.1 Å²	123.1	58%	0.579	57%	0.569	S	S	*	*	H	α-helix	trans	-69.7	-45.4	174.3	-179.6	-96.7	0	0	0	111.6	E512 F514 D518 N520	E512-F516 VanDerWaalsContact O-CB 3.29Å; E512-F516 WeakPolarHBondContact O-CB 3.27Å; E512-F516 PolarHBondContact O-N 3.28Å; F514-F516 VanDerWaalsContact C-N 3.26Å; F514-F516 PolarHBondContact O-N 2.91Å; F516-D518 VanDerWaalsContact C-N 3.27Å; F516-D518 PolarHBondContact O-N 3.06Å; F516-N520 VanDerWaalsContact CE1-ND2 3.26Å; F516-N520 WeakPolarHBondContact CE1-ND2 3.27Å; F516-N520 VanDerWaalsContact CZ-ND2 3.33Å; F516-N520 WeakPolarHBondContact CZ-ND2 3.43Å; F516-N520 WeakPolarHBondContact O-CB 3.46Å; F516-N520 PolarHBondContact O-N 3.49Å; F516-N520 PolarHBondContact O-ND2 3.4Å
517	N	58.5	Low	67	Low	107 Å²	107	123 Å²	123	57%	0.572	57%	0.569	S	S	*	*	H	α-helix	trans	-66.1	-30.5	173.9	-83.1	19.5	0	0	0	112.3	R513 F514 N520 R521	R513-N517 VanDerWaalsContact O-CB 3.31Å; R513-N517 WeakPolarHBondContact O-CB 3.21Å; R513-N517 PolarHBondContact O-N 2.67Å; F514-N517 CarbonylContact O-C 3.59Å; F514-N517 PolarHBondContact O-N 2.86Å; F514-N517 VanDerWaalsContact O-N 3.1Å; N517-N520 CarbonylContact O-C 3.57Å; N517-N520 VanDerWaalsContact O-C 3.31Å; N517-N520 PolarHBondContact O-N 3.06Å; N517-R521 WeakPolarHBondContact O-CB 3.34Å; N517-R521 PolarHBondContact O-N 3.31Å
518	D	61.5	Low	66.7	Low	89 Å²	89	124.8 Å²	124.8	48%	0.476	58%	0.577	S	S	.	*	H	α-helix	trans	-74.4	-44.1	-179.8	-160.4	56.6	0	0	0	111.1	F514 F516 N520 R521 D522	F514-D518 WeakPolarHBondContact O-CB 3.4Å; F514-D518 PolarHBondContact O-N 3.47Å; F516-D518 VanDerWaalsContact C-N 3.27Å; F516-D518 PolarHBondContact O-N 3.06Å; D518-N520 VanDerWaalsContact C-N 3.26Å; D518-N520 PolarHBondContact O-N 3.45Å; D518-R521 CarbonylContact O-C 3.56Å; D518-R521 VanDerWaalsContact O-CA 3.27Å; D518-R521 WeakPolarHBondContact O-CA 3.32Å; D518-R521 WeakPolarHBondContact O-CB 3.35Å; D518-R521 PolarHBondContact O-N 3.44Å; D518-D522 PolarHBondContact O-N 2.75Å
519	R	58.8	Low	66.9	Low	199 Å²	199	127.2 Å²	127.2	75%	0.751	58%	0.579	S	S	*	*	H	α-helix	trans	-61	-31.3	166.6	-72.4	175	179.4	-177.8	-0.4	113.3	R515 R521	R515-R519 WeakPolarHBondContact O-CB 3.45Å; R515-R519 VanDerWaalsContact O-CG 3.31Å; R515-R519 WeakPolarHBondContact O-CG 3.04Å; R515-R519 PolarHBondContact O-N 3.46Å; R519-R521 VanDerWaalsContact C-N 3.28Å
520	N	55	Low	67.1	Low	110 Å²	110	126.3 Å²	126.3	59%	0.588	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-0.9	171.2	-71.5	-61.5	0	0	0	113.2	F516 N517 D518	F516-N520 VanDerWaalsContact CE1-ND2 3.26Å; F516-N520 WeakPolarHBondContact CE1-ND2 3.27Å; F516-N520 VanDerWaalsContact CZ-ND2 3.33Å; F516-N520 WeakPolarHBondContact CZ-ND2 3.43Å; F516-N520 WeakPolarHBondContact O-CB 3.46Å; F516-N520 PolarHBondContact O-N 3.49Å; F516-N520 PolarHBondContact O-ND2 3.4Å; N517-N520 CarbonylContact O-C 3.57Å; N517-N520 VanDerWaalsContact O-C 3.31Å; N517-N520 PolarHBondContact O-N 3.06Å; D518-N520 VanDerWaalsContact C-N 3.26Å; D518-N520 PolarHBondContact O-N 3.45Å
521	R	57.2	Low	67.4	Low	187 Å²	187	129.1 Å²	129.1	71%	0.706	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	24.2	170.4	-161.8	-178.9	-176.1	-179.6	0.6	110.5	N517 D518 R519 N523	N517-R521 WeakPolarHBondContact O-CB 3.34Å; N517-R521 PolarHBondContact O-N 3.31Å; D518-R521 CarbonylContact O-C 3.56Å; D518-R521 VanDerWaalsContact O-CA 3.27Å; D518-R521 WeakPolarHBondContact O-CA 3.32Å; D518-R521 WeakPolarHBondContact O-CB 3.35Å; D518-R521 PolarHBondContact O-N 3.44Å; R519-R521 VanDerWaalsContact C-N 3.28Å; R521-N523 PolarHBondContact O-N 2.86Å
522	D	58.1	Low	67.8	Low	86 Å²	86	132.2 Å²	132.2	46%	0.46	60%	0.595	S	S	.	*			trans	-34.1	104	150.4	-101.9	11.4	0	0	0	107.7	D518 P524 R527	D518-D522 PolarHBondContact O-N 2.75Å; D522-P524 VanDerWaalsContact O-CD 3.26Å; D522-P524 WeakPolarHBondContact O-CD 3.49Å; D522-P524 VanDerWaalsContact O-N 3.09Å; D522-R527 VanDerWaalsContact OD2-CD 3.23Å; D522-R527 WeakPolarHBondContact OD2-CD 3.21Å; D522-R527 IonicContact OD2-CZ 3.36Å; D522-R527 IonicContact OD2-NE 3.06Å; D522-R527 PolarHBondContact OD2-NE 2.86Å
523	N	63	Low	68.4	Low	91 Å²	91	132.7 Å²	132.7	49%	0.487	60%	0.596	S	S	.	*			trans	-57	121.5	178.8	-103	-49	0	0	0	106.9	R521 S525 E526 R527	R521-N523 PolarHBondContact O-N 2.86Å; N523-S525 PolarHBondContact O-N 3.07Å; N523-S525 VanDerWaalsContact O-N 3.12Å; N523-E526 HydrophobicContact CB-CB 3.53Å; N523-E526 WeakPolarHBondContact O-CA 3.26Å; N523-E526 WeakPolarHBondContact O-CB 3.33Å; N523-E526 PolarHBondContact O-N 2.85Å; N523-R527 PolarHBondContact O-N 3.49Å
524	P	66.8	Low	69.2	Low	102 Å²	102	132.2 Å²	132.2	66%	0.662	59%	0.594	S	S	*	*	H	α-helix	trans	-55.4	-39.4	-178.2	-28.3	36.1	0	0	0	111.3	D522 E526 E528	D522-P524 VanDerWaalsContact O-CD 3.26Å; D522-P524 WeakPolarHBondContact O-CD 3.49Å; D522-P524 VanDerWaalsContact O-N 3.09Å; P524-E526 VanDerWaalsContact C-N 3.31Å; P524-E526 PolarHBondContact O-N 2.9Å; P524-E528 WeakPolarHBondContact O-CB 3.49Å; P524-E528 PolarHBondContact O-N 3.06Å
525	S	67.6	Low	70.1	Confident	73 Å²	73	128.7 Å²	128.7	51%	0.51	58%	0.579	S	S	.	*	H	α-helix	trans	-61.2	-28.3	173.4	-46.3	0	0	0	0	115	N523 R529	N523-S525 PolarHBondContact O-N 3.07Å; N523-S525 VanDerWaalsContact O-N 3.12Å; S525-R529 WeakPolarHBondContact O-CD 3.43Å; S525-R529 WeakPolarHBondContact O-CG 3.41Å; S525-R529 PolarHBondContact O-N 3.24Å; S525-R529 VanDerWaalsContact O-N 3.07Å
526	E	73	Confident	71.1	Confident	107 Å²	107	128.9 Å²	128.9	50%	0.5	58%	0.58	S	S	.	*	H	α-helix	trans	-88.6	-44.5	-176.9	-176.1	163.2	-160.5	0	0	111	N523 P524 E528 R529 I530	N523-E526 HydrophobicContact CB-CB 3.53Å; N523-E526 WeakPolarHBondContact O-CA 3.26Å; N523-E526 WeakPolarHBondContact O-CB 3.33Å; N523-E526 PolarHBondContact O-N 2.85Å; P524-E526 VanDerWaalsContact C-N 3.31Å; P524-E526 PolarHBondContact O-N 2.9Å; E526-E528 PolarHBondContact O-N 2.79Å; E526-R529 WeakPolarHBondContact O-CB 3.47Å; E526-R529 PolarHBondContact O-N 2.87Å; E526-I530 WeakPolarHBondContact O-CG1 3.25Å; E526-I530 PolarHBondContact O-N 2.78Å
527	R	70	Confident	72.3	Confident	173 Å²	173	127.2 Å²	127.2	65%	0.653	57%	0.574	S	S	*	*	H	α-helix	trans	-58	-36.7	168.5	-149.8	174.7	-162.2	-101.7	-1.3	111.4	D522 N523 R531	D522-R527 VanDerWaalsContact OD2-CD 3.23Å; D522-R527 WeakPolarHBondContact OD2-CD 3.21Å; D522-R527 IonicContact OD2-CZ 3.36Å; D522-R527 IonicContact OD2-NE 3.06Å; D522-R527 PolarHBondContact OD2-NE 2.86Å; N523-R527 PolarHBondContact O-N 3.49Å; R527-R531 WeakPolarHBondContact O-CB 3.25Å; R527-R531 PolarHBondContact O-N 3.32Å
528	E	77.5	Confident	73.6	Confident	127 Å²	127	127.1 Å²	127.1	59%	0.593	57%	0.57	S	S	*	*	H	α-helix	trans	-71.6	-37.9	172.7	-170.2	165.6	-119.3	0	0	112.9	P524 E526 R531 M532	P524-E528 WeakPolarHBondContact O-CB 3.49Å; P524-E528 PolarHBondContact O-N 3.06Å; E526-E528 PolarHBondContact O-N 2.79Å; E528-R531 PolarHBondContact O-N 3.47Å; E528-M532 HydrophobicContact CG-CG 4.45Å; E528-M532 WeakPolarHBondContact O-CB 3.27Å; E528-M532 WeakPolarHBondContact O-CG 3.26Å; E528-M532 PolarHBondContact O-N 2.91Å
529	R	80.4	Confident	74.9	Confident	190 Å²	190	129.8 Å²	129.8	72%	0.717	57%	0.573	S	S	*	*	H	α-helix	trans	-60.3	-48.5	171.2	-79.2	164.6	-172	-155.7	2.6	112.1	S525 E526 R531 M532 F533	S525-R529 WeakPolarHBondContact O-CD 3.43Å; S525-R529 WeakPolarHBondContact O-CG 3.41Å; S525-R529 PolarHBondContact O-N 3.24Å; S525-R529 VanDerWaalsContact O-N 3.07Å; E526-R529 WeakPolarHBondContact O-CB 3.47Å; E526-R529 PolarHBondContact O-N 2.87Å; R529-R531 VanDerWaalsContact C-N 3.32Å; R529-R531 PolarHBondContact O-N 2.83Å; R529-M532 PolarHBondContact O-N 3.01Å; R529-F533 WeakPolarHBondContact O-CB 3.33Å; R529-F533 PolarHBondContact O-N 3.39Å
530	I	83.5	Confident	76	Confident	104 Å²	104	126.1 Å²	126.1	53%	0.533	57%	0.567	S	S	.	*	H	α-helix	trans	-61.7	-42.6	178.6	-65.6	166.5	0	0	0	110.2	E526 F533 R534	E526-I530 WeakPolarHBondContact O-CG1 3.25Å; E526-I530 PolarHBondContact O-N 2.78Å; I530-F533 PolarHBondContact O-N 3.44Å; I530-R534 PolarHBondContact O-N 2.82Å
531	R	82.6	Confident	77.6	Confident	189 Å²	189	126 Å²	126	71%	0.713	56%	0.564	S	S	*	*	H	α-helix	trans	-61.5	-45.2	174.6	-171.2	-178	-172.4	-171.8	3.9	112.3	R527 E528 R529 F533 R534 E535	R527-R531 WeakPolarHBondContact O-CB 3.25Å; R527-R531 PolarHBondContact O-N 3.32Å; E528-R531 PolarHBondContact O-N 3.47Å; R529-R531 VanDerWaalsContact C-N 3.32Å; R529-R531 PolarHBondContact O-N 2.83Å; R531-F533 VanDerWaalsContact C-N 3.32Å; R531-F533 PolarHBondContact O-N 3.2Å; R531-R534 PolarHBondContact O-N 3.36Å; R531-E535 WeakPolarHBondContact O-CB 3.44Å; R531-E535 PolarHBondContact O-N 2.91Å
532	M	82.8	Confident	79.1	Confident	108 Å²	108	121.5 Å²	121.5	53%	0.532	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-30.8	177.9	-74.7	-70.4	-66.7	0	0	112.7	E528 R529 R536	E528-M532 HydrophobicContact CG-CG 4.45Å; E528-M532 WeakPolarHBondContact O-CB 3.27Å; E528-M532 WeakPolarHBondContact O-CG 3.26Å; E528-M532 PolarHBondContact O-N 2.91Å; R529-M532 PolarHBondContact O-N 3.01Å; M532-R536 VanDerWaalsContact O-CB 3.26Å; M532-R536 WeakPolarHBondContact O-CB 3.43Å; M532-R536 PolarHBondContact O-N 3.41Å; M532-R536 VanDerWaalsContact O-N 3.07Å
533	F	83.3	Confident	80.7	Confident	132 Å²	132	121.2 Å²	121.2	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-68.4	-53.8	173	-167.1	-91.6	0	0	0	110.5	R529 I530 R531 E535 R536 E537	R529-F533 WeakPolarHBondContact O-CB 3.33Å; R529-F533 PolarHBondContact O-N 3.39Å; I530-F533 PolarHBondContact O-N 3.44Å; R531-F533 VanDerWaalsContact C-N 3.32Å; R531-F533 PolarHBondContact O-N 3.2Å; F533-E535 VanDerWaalsContact C-N 3.35Å; F533-E535 PolarHBondContact O-N 3.4Å; F533-R536 CarbonylContact O-C 3.57Å; F533-R536 WeakPolarHBondContact O-CA 3.37Å; F533-R536 WeakPolarHBondContact O-CB 3.25Å; F533-R536 PolarHBondContact O-N 3.33Å; F533-E537 HydrophobicContact CD1-CG 4.12Å; F533-E537 WeakPolarHBondContact CD1-OE2 3.2Å; F533-E537 HydrophobicContact CE1-CG 3.96Å; F533-E537 WeakPolarHBondContact CE1-OE1 3.33Å; F533-E537 WeakPolarHBondContact CE1-OE2 3.33Å; F533-E537 PolarHBondContact O-N 2.9Å
534	R	85.2	Confident	82.2	Confident	157 Å²	157	125 Å²	125	59%	0.592	56%	0.56	S	S	*	*	H	α-helix	trans	-60.3	-41.4	177.5	-173.4	176.1	-64.4	-176.5	-0.1	112.5	I530 R531 R536 E537 E538	I530-R534 PolarHBondContact O-N 2.82Å; R531-R534 PolarHBondContact O-N 3.36Å; R534-R536 VanDerWaalsContact C-N 3.28Å; R534-R536 PolarHBondContact O-N 3.44Å; R534-E537 PolarHBondContact O-N 3.37Å; R534-E538 HydrophobicContact CG-CG 4.37Å; R534-E538 WeakPolarHBondContact CG-OE1 3.32Å; R534-E538 WeakPolarHBondContact O-CB 3.37Å; R534-E538 WeakPolarHBondContact O-CG 3.31Å; R534-E538 PolarHBondContact O-N 3.21Å
535	E	85	Confident	83.5	Confident	63 Å²	63	127.3 Å²	127.3	29%	0.294	56%	0.555	S	S	.	*	H	α-helix	trans	-66.2	-31.8	176	-161.8	-170	-177	0	0	111.7	R531 F533 R539	R531-E535 WeakPolarHBondContact O-CB 3.44Å; R531-E535 PolarHBondContact O-N 2.91Å; F533-E535 VanDerWaalsContact C-N 3.35Å; F533-E535 PolarHBondContact O-N 3.4Å; E535-R539 WeakPolarHBondContact O-CB 3.34Å; E535-R539 WeakPolarHBondContact O-CD 3.34Å; E535-R539 WeakPolarHBondContact O-CG 3.12Å; E535-R539 PolarHBondContact O-N 3.02Å; E535-R539 IonicContact OE1-CZ 3.46Å; E535-R539 IonicContact OE1-NE 3.87Å; E535-R539 IonicContact OE1-NH2 2.68Å; E535-R539 PolarHBondContact OE1-NH2 2.81Å; E535-R539 IonicContact OE2-CZ 3.2Å; E535-R539 IonicContact OE2-NH2 3.46Å; E535-R539 PolarHBondContact OE2-NH2 2.98Å
536	R	83.8	Confident	84.7	Confident	180 Å²	180	130.9 Å²	130.9	68%	0.679	56%	0.557	S	S	*	*	H	α-helix	trans	-68	-42.5	171.8	-175.4	-179.6	-177.4	-176.6	-1	111.3	M532 F533 R534 R539 M540	M532-R536 VanDerWaalsContact O-CB 3.26Å; M532-R536 WeakPolarHBondContact O-CB 3.43Å; M532-R536 PolarHBondContact O-N 3.41Å; M532-R536 VanDerWaalsContact O-N 3.07Å; F533-R536 CarbonylContact O-C 3.57Å; F533-R536 WeakPolarHBondContact O-CA 3.37Å; F533-R536 WeakPolarHBondContact O-CB 3.25Å; F533-R536 PolarHBondContact O-N 3.33Å; R534-R536 VanDerWaalsContact C-N 3.28Å; R534-R536 PolarHBondContact O-N 3.44Å; R536-R539 PolarHBondContact O-N 3.28Å; R536-M540 VanDerWaalsContact O-CG 3.25Å; R536-M540 WeakPolarHBondContact O-CG 3.43Å; R536-M540 PolarHBondContact O-N 2.93Å
537	E	85.1	Confident	85.8	Confident	98 Å²	98	130.1 Å²	130.1	46%	0.458	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-45.4	175.1	-68.2	180	120	0	0	112.1	F533 R534 R539 M540 M541	F533-E537 HydrophobicContact CD1-CG 4.12Å; F533-E537 WeakPolarHBondContact CD1-OE2 3.2Å; F533-E537 HydrophobicContact CE1-CG 3.96Å; F533-E537 WeakPolarHBondContact CE1-OE1 3.33Å; F533-E537 WeakPolarHBondContact CE1-OE2 3.33Å; F533-E537 PolarHBondContact O-N 2.9Å; R534-E537 PolarHBondContact O-N 3.37Å; E537-R539 VanDerWaalsContact C-N 3.32Å; E537-R539 PolarHBondContact O-N 3.41Å; E537-M540 CarbonylContact O-C 3.59Å; E537-M540 PolarHBondContact O-N 2.9Å; E537-M540 VanDerWaalsContact O-N 3.1Å; E537-M541 WeakPolarHBondContact O-CB 3.44Å; E537-M541 WeakPolarHBondContact O-CG 3.42Å; E537-M541 PolarHBondContact O-N 3.37Å
538	E	85.1	Confident	86.9	Confident	105 Å²	105	126.9 Å²	126.9	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-61.1	-39.3	175.6	-74.8	172.6	-168.4	0	0	111.7	R534 N542	R534-E538 HydrophobicContact CG-CG 4.37Å; R534-E538 WeakPolarHBondContact CG-OE1 3.32Å; R534-E538 WeakPolarHBondContact O-CB 3.37Å; R534-E538 WeakPolarHBondContact O-CG 3.31Å; R534-E538 PolarHBondContact O-N 3.21Å; E538-N542 VanDerWaalsContact O-CB 3.31Å; E538-N542 WeakPolarHBondContact O-CB 3.22Å; E538-N542 VanDerWaalsContact O-CG 3.28Å; E538-N542 PolarHBondContact O-N 2.87Å; E538-N542 PolarHBondContact O-ND2 2.91Å
539	R	89.8	Confident	87.7	Confident	144 Å²	144	125 Å²	125	54%	0.543	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-40.2	171.8	-72.5	167.1	-172.9	178.1	5.7	112.1	E535 R536 E537 N543	E535-R539 WeakPolarHBondContact O-CB 3.34Å; E535-R539 WeakPolarHBondContact O-CD 3.34Å; E535-R539 WeakPolarHBondContact O-CG 3.12Å; E535-R539 PolarHBondContact O-N 3.02Å; E535-R539 IonicContact OE1-CZ 3.46Å; E535-R539 IonicContact OE1-NE 3.87Å; E535-R539 IonicContact OE1-NH2 2.68Å; E535-R539 PolarHBondContact OE1-NH2 2.81Å; E535-R539 IonicContact OE2-CZ 3.2Å; E535-R539 IonicContact OE2-NH2 3.46Å; E535-R539 PolarHBondContact OE2-NH2 2.98Å; R536-R539 PolarHBondContact O-N 3.28Å; E537-R539 VanDerWaalsContact C-N 3.32Å; E537-R539 PolarHBondContact O-N 3.41Å; R539-N543 VanDerWaalsContact O-CB 3.22Å; R539-N543 WeakPolarHBondContact O-CB 3.41Å; R539-N543 PolarHBondContact O-N 2.84Å
540	M	82.3	Confident	88.3	Confident	123 Å²	123	118.5 Å²	118.5	61%	0.606	52%	0.524	S	S	*	.	H	α-helix	trans	-68.7	-41	176.3	-71	-66.6	-69.5	0	0	112.1	R536 E537 N543 R544	R536-M540 VanDerWaalsContact O-CG 3.25Å; R536-M540 WeakPolarHBondContact O-CG 3.43Å; R536-M540 PolarHBondContact O-N 2.93Å; E537-M540 CarbonylContact O-C 3.59Å; E537-M540 PolarHBondContact O-N 2.9Å; E537-M540 VanDerWaalsContact O-N 3.1Å; M540-N543 PolarHBondContact O-N 2.75Å; M540-R544 WeakPolarHBondContact O-CB 3.49Å; M540-R544 PolarHBondContact O-N 3.45Å
541	M	88.4	Confident	88.8	Confident	108 Å²	108	119.4 Å²	119.4	53%	0.532	52%	0.524	S	S	.	.	H	α-helix	trans	-60	-49.1	172.7	-82.8	-77.2	-166.2	0	0	111.5	E537 R544 R545	E537-M541 WeakPolarHBondContact O-CB 3.44Å; E537-M541 WeakPolarHBondContact O-CG 3.42Å; E537-M541 PolarHBondContact O-N 3.37Å; M541-R544 PolarHBondContact O-N 2.91Å; M541-R545 WeakPolarHBondContact O-CB 3.38Å; M541-R545 VanDerWaalsContact O-CG 3.32Å; M541-R545 WeakPolarHBondContact O-CG 3.27Å; M541-R545 PolarHBondContact O-N 2.89Å
542	N	88.4	Confident	89.4	Confident	91 Å²	91	116.4 Å²	116.4	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-69	-33.8	179	-72.1	-20.4	0	0	0	112.1	E538 R545 W546	E538-N542 VanDerWaalsContact O-CB 3.31Å; E538-N542 WeakPolarHBondContact O-CB 3.22Å; E538-N542 VanDerWaalsContact O-CG 3.28Å; E538-N542 PolarHBondContact O-N 2.87Å; E538-N542 PolarHBondContact O-ND2 2.91Å; N542-R545 PolarHBondContact OD1-NH1 3.33Å; N542-W546 WeakPolarHBondContact O-CB 3.37Å; N542-W546 PolarHBondContact O-N 3.26Å
543	N	91.6	Very high	90.1	Very high	80 Å²	80	117.5 Å²	117.5	43%	0.428	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-40.1	171.2	-169.1	49.3	0	0	0	111.7	R539 M540 W546 L547	R539-N543 VanDerWaalsContact O-CB 3.22Å; R539-N543 WeakPolarHBondContact O-CB 3.41Å; R539-N543 PolarHBondContact O-N 2.84Å; M540-N543 PolarHBondContact O-N 2.75Å; N543-W546 PolarHBondContact O-N 2.77Å; N543-L547 WeakPolarHBondContact O-CB 3.43Å; N543-L547 VanDerWaalsContact O-CG 3.27Å; N543-L547 WeakPolarHBondContact O-CG 3.33Å; N543-L547 PolarHBondContact O-N 3.1Å
544	R	93.6	Very high	90.6	Very high	172 Å²	172	116 Å²	116	65%	0.649	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-46.6	175	-167.9	163.4	108.1	-179.2	4.2	111.2	M540 M541 W546 L547 E548	M540-R544 WeakPolarHBondContact O-CB 3.49Å; M540-R544 PolarHBondContact O-N 3.45Å; M541-R544 PolarHBondContact O-N 2.91Å; R544-W546 VanDerWaalsContact C-N 3.33Å; R544-W546 PolarHBondContact O-N 2.79Å; R544-L547 PolarHBondContact O-N 2.93Å; R544-E548 VanDerWaalsContact O-CB 3.25Å; R544-E548 WeakPolarHBondContact O-CB 3.28Å; R544-E548 PolarHBondContact O-N 3.28Å
545	R	93.9	Very high	91.1	Very high	149 Å²	149	112.8 Å²	112.8	56%	0.562	51%	0.505	S	S	*	.	H	α-helix	trans	-57.6	-42.4	173.1	-72.2	167.6	174.8	169.1	-5.2	112.5	M541 N542 E548 V549	M541-R545 WeakPolarHBondContact O-CB 3.38Å; M541-R545 VanDerWaalsContact O-CG 3.32Å; M541-R545 WeakPolarHBondContact O-CG 3.27Å; M541-R545 PolarHBondContact O-N 2.89Å; N542-R545 PolarHBondContact OD1-NH1 3.33Å; R545-E548 PolarHBondContact O-N 3.3Å; R545-V549 WeakPolarHBondContact O-CG2 3.46Å; R545-V549 PolarHBondContact O-N 3.4Å
546	W	93.9	Very high	91.5	Very high	148 Å²	148	112.5 Å²	112.5	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-66.1	-44.7	176.9	-179	76.9	0	0	0	112.1	N542 N543 R544 E548 V549 E550	N542-W546 WeakPolarHBondContact O-CB 3.37Å; N542-W546 PolarHBondContact O-N 3.26Å; N543-W546 PolarHBondContact O-N 2.77Å; R544-W546 VanDerWaalsContact C-N 3.33Å; R544-W546 PolarHBondContact O-N 2.79Å; W546-E548 VanDerWaalsContact C-N 3.27Å; W546-E548 PolarHBondContact O-N 2.91Å; W546-V549 PolarHBondContact O-N 3Å; W546-E550 HydrophobicContact CH2-CG 4.4Å; W546-E550 HydrophobicContact CZ2-CB 4.43Å; W546-E550 HydrophobicContact CZ2-CG 4.38Å; W546-E550 WeakPolarHBondContact O-CB 3.46Å; W546-E550 PolarHBondContact O-N 3.36Å
547	L	95	Very high	92.1	Very high	92 Å²	92	106.7 Å²	106.7	48%	0.482	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-33.6	174.2	-73	167.9	0	0	0	112.4	N543 R544 K551	N543-L547 WeakPolarHBondContact O-CB 3.43Å; N543-L547 VanDerWaalsContact O-CG 3.27Å; N543-L547 WeakPolarHBondContact O-CG 3.33Å; N543-L547 PolarHBondContact O-N 3.1Å; R544-L547 PolarHBondContact O-N 2.93Å; L547-K551 WeakPolarHBondContact O-CB 3.47Å; L547-K551 PolarHBondContact O-N 2.94Å
548	E	93.1	Very high	92.6	Very high	104 Å²	104	109.6 Å²	109.6	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-72.8	-40	179.1	-164.8	143.3	-124.3	0	0	111.8	R544 R545 W546 K551 Q552	R544-E548 VanDerWaalsContact O-CB 3.25Å; R544-E548 WeakPolarHBondContact O-CB 3.28Å; R544-E548 PolarHBondContact O-N 3.28Å; R545-E548 PolarHBondContact O-N 3.3Å; W546-E548 VanDerWaalsContact C-N 3.27Å; W546-E548 PolarHBondContact O-N 2.91Å; E548-K551 PolarHBondContact O-N 3.46Å; E548-Q552 WeakPolarHBondContact O-CG 3.47Å; E548-Q552 PolarHBondContact O-N 2.85Å
549	V	95	Very high	93.1	Very high	89 Å²	89	109.9 Å²	109.9	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-45.3	170.8	171.5	0	0	0	0	111.6	R545 W546 K551 Q552 R553	R545-V549 WeakPolarHBondContact O-CG2 3.46Å; R545-V549 PolarHBondContact O-N 3.4Å; W546-V549 PolarHBondContact O-N 3Å; V549-K551 VanDerWaalsContact C-N 3.31Å; V549-K551 PolarHBondContact O-N 3.4Å; V549-Q552 PolarHBondContact O-N 3.36Å; V549-R553 WeakPolarHBondContact O-CB 3.36Å; V549-R553 PolarHBondContact O-N 3.41Å
550	E	92.8	Very high	93.4	Very high	53 Å²	53	108.5 Å²	108.5	25%	0.248	51%	0.505	C	S	.	.	H	α-helix	trans	-68.4	-31.2	177.6	-169.5	71.7	172.1	0	0	111.3	W546 R553 L554	W546-E550 HydrophobicContact CH2-CG 4.4Å; W546-E550 HydrophobicContact CZ2-CB 4.43Å; W546-E550 HydrophobicContact CZ2-CG 4.38Å; W546-E550 WeakPolarHBondContact O-CB 3.46Å; W546-E550 PolarHBondContact O-N 3.36Å; E550-R553 PolarHBondContact O-N 3.18Å; E550-R553 IonicContact OE1-CZ 3.26Å; E550-R553 IonicContact OE1-NH1 2.63Å; E550-R553 PolarHBondContact OE1-NH1 2.88Å; E550-R553 IonicContact OE2-CZ 2.72Å; E550-R553 IonicContact OE2-NH1 2.75Å; E550-R553 PolarHBondContact OE2-NH1 3.39Å; E550-L554 HydrophobicContact CG-CD1 4.45Å; E550-L554 WeakPolarHBondContact O-CB 3.2Å; E550-L554 VanDerWaalsContact O-CG 3.28Å; E550-L554 WeakPolarHBondContact O-CG 3.28Å; E550-L554 PolarHBondContact O-N 2.82Å
551	K	95.1	Very high	93.8	Very high	123 Å²	123	111.3 Å²	111.3	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-52.6	168.6	-175.1	-153.3	168.1	-153.3	0	110.8	L547 E548 V549 R553 L554 E555	L547-K551 WeakPolarHBondContact O-CB 3.47Å; L547-K551 PolarHBondContact O-N 2.94Å; E548-K551 PolarHBondContact O-N 3.46Å; V549-K551 VanDerWaalsContact C-N 3.31Å; V549-K551 PolarHBondContact O-N 3.4Å; K551-R553 PolarHBondContact O-N 3.32Å; K551-L554 PolarHBondContact O-N 2.94Å; K551-L554 VanDerWaalsContact O-N 3.14Å; K551-E555 VanDerWaalsContact CE-OE2 3.3Å; K551-E555 WeakPolarHBondContact CE-OE2 3.35Å; K551-E555 IonicContact NZ-OE2 3.88Å; K551-E555 PolarHBondContact NZ-OE2 2.84Å; K551-E555 VanDerWaalsContact O-CB 3.28Å; K551-E555 WeakPolarHBondContact O-CB 3.48Å; K551-E555 PolarHBondContact O-N 2.83Å
552	Q	94.5	Very high	94.1	Very high	125 Å²	125	109.4 Å²	109.4	58%	0.584	50%	0.499	S	S	*	.	H	α-helix	trans	-56.7	-39.2	178.3	-76.6	176.3	-2.1	0	0	111.8	E548 V549 E555 A556	E548-Q552 WeakPolarHBondContact O-CG 3.47Å; E548-Q552 PolarHBondContact O-N 2.85Å; V549-Q552 PolarHBondContact O-N 3.36Å; Q552-E555 PolarHBondContact O-N 3.27Å; Q552-A556 WeakPolarHBondContact O-CB 3.47Å; Q552-A556 PolarHBondContact O-N 2.86Å
553	R	97.6	Very high	94.5	Very high	131 Å²	131	111 Å²	111	49%	0.494	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-49.2	173.7	178.7	177.5	162	-127.8	-11.8	112.5	V549 E550 K551 E555 A556 D557	V549-R553 WeakPolarHBondContact O-CB 3.36Å; V549-R553 PolarHBondContact O-N 3.41Å; E550-R553 PolarHBondContact O-N 3.18Å; E550-R553 IonicContact OE1-CZ 3.26Å; E550-R553 IonicContact OE1-NH1 2.63Å; E550-R553 PolarHBondContact OE1-NH1 2.88Å; E550-R553 IonicContact OE2-CZ 2.72Å; E550-R553 IonicContact OE2-NH1 2.75Å; E550-R553 PolarHBondContact OE2-NH1 3.39Å; K551-R553 PolarHBondContact O-N 3.32Å; R553-E555 PolarHBondContact O-N 3.29Å; R553-A556 WeakPolarHBondContact O-CB 3.47Å; R553-A556 PolarHBondContact O-N 3.5Å; R553-D557 PolarHBondContact O-N 3.43Å
554	L	93.9	Very high	94.7	Very high	100 Å²	100	111.9 Å²	111.9	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-29.2	176.3	-71.5	169.2	0	0	0	112.7	E550 K551 R558	E550-L554 HydrophobicContact CG-CD1 4.45Å; E550-L554 WeakPolarHBondContact O-CB 3.2Å; E550-L554 VanDerWaalsContact O-CG 3.28Å; E550-L554 WeakPolarHBondContact O-CG 3.28Å; E550-L554 PolarHBondContact O-N 2.82Å; K551-L554 PolarHBondContact O-N 2.94Å; K551-L554 VanDerWaalsContact O-N 3.14Å; L554-R558 VanDerWaalsContact O-CB 3.26Å; L554-R558 WeakPolarHBondContact O-CB 3.25Å; L554-R558 PolarHBondContact O-N 3.47Å
555	E	95.3	Very high	94.7	Very high	90 Å²	90	109.8 Å²	109.8	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-73.1	-39.1	174.7	-166.1	144.9	-135.1	0	0	111	K551 Q552 R553 R558 M559	K551-E555 VanDerWaalsContact CE-OE2 3.3Å; K551-E555 WeakPolarHBondContact CE-OE2 3.35Å; K551-E555 IonicContact NZ-OE2 3.88Å; K551-E555 PolarHBondContact NZ-OE2 2.84Å; K551-E555 VanDerWaalsContact O-CB 3.28Å; K551-E555 WeakPolarHBondContact O-CB 3.48Å; K551-E555 PolarHBondContact O-N 2.83Å; Q552-E555 PolarHBondContact O-N 3.27Å; R553-E555 PolarHBondContact O-N 3.29Å; E555-R558 WeakPolarHBondContact O-CB 3.26Å; E555-R558 PolarHBondContact O-N 3.03Å; E555-M559 VanDerWaalsContact O-CG 3.3Å; E555-M559 WeakPolarHBondContact O-CG 3.28Å; E555-M559 PolarHBondContact O-N 3.14Å
556	A	94.4	Very high	94.8	Very high	57 Å²	57	110.4 Å²	110.4	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-50.8	169.6	0	0	0	0	0	112.3	Q552 R553 R558 M559 E560	Q552-A556 WeakPolarHBondContact O-CB 3.47Å; Q552-A556 PolarHBondContact O-N 2.86Å; R553-A556 WeakPolarHBondContact O-CB 3.47Å; R553-A556 PolarHBondContact O-N 3.5Å; A556-R558 PolarHBondContact O-N 3.14Å; A556-M559 PolarHBondContact O-N 3.39Å; A556-E560 PolarHBondContact O-N 2.83Å
557	D	94.6	Very high	94.8	Very high	59 Å²	59	106.5 Å²	106.5	32%	0.316	49%	0.494	S	S	.	.	H	α-helix	trans	-54.1	-36.2	174.1	-77.2	25.1	0	0	0	111.5	R553 R561	R553-D557 PolarHBondContact O-N 3.43Å; D557-R561 WeakPolarHBondContact O-CB 3.18Å; D557-R561 VanDerWaalsContact O-CD 3.28Å; D557-R561 WeakPolarHBondContact O-CD 3.5Å; D557-R561 WeakPolarHBondContact O-CG 3.48Å; D557-R561 PolarHBondContact O-N 3.39Å; D557-R561 VanDerWaalsContact O-N 3.13Å
558	R	97.3	Very high	94.7	Very high	158 Å²	158	109.5 Å²	109.5	60%	0.596	50%	0.498	S	S	*	.	H	α-helix	trans	-70.6	-43.6	176.3	-179.1	-176.4	-178	-171.2	1.7	112.1	L554 E555 A556 R561 Q562	L554-R558 VanDerWaalsContact O-CB 3.26Å; L554-R558 WeakPolarHBondContact O-CB 3.25Å; L554-R558 PolarHBondContact O-N 3.47Å; E555-R558 WeakPolarHBondContact O-CB 3.26Å; E555-R558 PolarHBondContact O-N 3.03Å; A556-R558 PolarHBondContact O-N 3.14Å; R558-R561 PolarHBondContact O-N 2.91Å; R558-Q562 WeakPolarHBondContact O-CG 3.3Å; R558-Q562 PolarHBondContact O-N 3.34Å; R558-Q562 VanDerWaalsContact O-N 3.08Å
559	M	95.6	Very high	94.6	Very high	111 Å²	111	110.2 Å²	110.2	55%	0.547	50%	0.503	S	S	.	.	H	α-helix	trans	-67.8	-39.5	177.7	-71.7	-64.3	-70.7	0	0	111.7	E555 A556 Q562 F563	E555-M559 VanDerWaalsContact O-CG 3.3Å; E555-M559 WeakPolarHBondContact O-CG 3.28Å; E555-M559 PolarHBondContact O-N 3.14Å; A556-M559 PolarHBondContact O-N 3.39Å; M559-Q562 PolarHBondContact O-N 3.13Å; M559-F563 PolarHBondContact O-N 2.86Å
560	E	94.9	Very high	94.7	Very high	116 Å²	116	113.9 Å²	113.9	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-45.8	172.9	-172.6	-174	-173.4	0	0	111	A556 Q562 F563 L564	A556-E560 PolarHBondContact O-N 2.83Å; E560-Q562 VanDerWaalsContact C-N 3.34Å; E560-Q562 PolarHBondContact O-N 3.05Å; E560-F563 WeakPolarHBondContact O-CB 3.5Å; E560-F563 PolarHBondContact O-N 3.19Å; E560-F563 VanDerWaalsContact O-N 3.14Å; E560-L564 HydrophobicContact CG-CD1 4Å; E560-L564 HydrophobicContact CG-CG 4.38Å; E560-L564 WeakPolarHBondContact O-CB 3.18Å; E560-L564 WeakPolarHBondContact O-CG 3.3Å; E560-L564 PolarHBondContact O-N 2.97Å
561	R	91.2	Very high	94.7	Very high	182 Å²	182	116.1 Å²	116.1	69%	0.687	52%	0.52	S	S	*	.	H	α-helix	trans	-58.1	-43	174.5	-75.2	164	-178.8	-92.1	-3	112.6	D557 R558 L564 E565	D557-R561 WeakPolarHBondContact O-CB 3.18Å; D557-R561 VanDerWaalsContact O-CD 3.28Å; D557-R561 WeakPolarHBondContact O-CD 3.5Å; D557-R561 WeakPolarHBondContact O-CG 3.48Å; D557-R561 PolarHBondContact O-N 3.39Å; D557-R561 VanDerWaalsContact O-N 3.13Å; R558-R561 PolarHBondContact O-N 2.91Å; R561-L564 PolarHBondContact O-N 3.49Å; R561-E565 VanDerWaalsContact O-CB 3.3Å; R561-E565 WeakPolarHBondContact O-CB 3.3Å; R561-E565 PolarHBondContact O-N 3.08Å
562	Q	95	Very high	94.6	Very high	67 Å²	67	114.2 Å²	114.2	31%	0.313	51%	0.513	S	S	.	.	H	α-helix	trans	-67.5	-34.7	176	-72.9	-173.7	-8.1	0	0	112.7	R558 M559 E560 R566	R558-Q562 WeakPolarHBondContact O-CG 3.3Å; R558-Q562 PolarHBondContact O-N 3.34Å; R558-Q562 VanDerWaalsContact O-N 3.08Å; M559-Q562 PolarHBondContact O-N 3.13Å; E560-Q562 VanDerWaalsContact C-N 3.34Å; E560-Q562 PolarHBondContact O-N 3.05Å; Q562-R566 WeakPolarHBondContact O-CB 3.3Å; Q562-R566 WeakPolarHBondContact O-CD 3.46Å; Q562-R566 WeakPolarHBondContact O-CG 3.34Å; Q562-R566 PolarHBondContact O-N 3.35Å
563	F	96.1	Very high	94.6	Very high	126 Å²	126	115.7 Å²	115.7	55%	0.553	51%	0.514	S	S	*	.	H	α-helix	trans	-65.8	-50.2	173.6	-179	-94.9	0	0	0	111.1	M559 E560 E565 R566 E567	M559-F563 PolarHBondContact O-N 2.86Å; E560-F563 WeakPolarHBondContact O-CB 3.5Å; E560-F563 PolarHBondContact O-N 3.19Å; E560-F563 VanDerWaalsContact O-N 3.14Å; F563-E565 VanDerWaalsContact C-N 3.29Å; F563-E565 PolarHBondContact O-N 3.49Å; F563-R566 PolarHBondContact O-N 2.86Å; F563-E567 WeakPolarHBondContact O-CB 3.21Å; F563-E567 PolarHBondContact O-N 3.26Å
564	L	95.4	Very high	94.5	Very high	98 Å²	98	116 Å²	116	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-34.2	176.9	-68.9	171.5	0	0	0	112.6	E560 R561 R568	E560-L564 HydrophobicContact CG-CD1 4Å; E560-L564 HydrophobicContact CG-CG 4.38Å; E560-L564 WeakPolarHBondContact O-CB 3.18Å; E560-L564 WeakPolarHBondContact O-CG 3.3Å; E560-L564 PolarHBondContact O-N 2.97Å; R561-L564 PolarHBondContact O-N 3.49Å; L564-R568 WeakPolarHBondContact O-CB 3.2Å; L564-R568 PolarHBondContact O-N 2.74Å
565	E	93.5	Very high	94.5	Very high	128 Å²	128	118.3 Å²	118.3	60%	0.598	52%	0.523	S	S	*	.	H	α-helix	trans	-68.7	-43.9	173.7	-176.5	167.7	-131.4	0	0	112.1	R561 F563 R568 M569	R561-E565 VanDerWaalsContact O-CB 3.3Å; R561-E565 WeakPolarHBondContact O-CB 3.3Å; R561-E565 PolarHBondContact O-N 3.08Å; F563-E565 VanDerWaalsContact C-N 3.29Å; F563-E565 PolarHBondContact O-N 3.49Å; E565-R568 PolarHBondContact O-N 2.8Å; E565-M569 WeakPolarHBondContact O-CB 3.48Å; E565-M569 VanDerWaalsContact O-CG 3.3Å; E565-M569 WeakPolarHBondContact O-CG 3.45Å; E565-M569 PolarHBondContact O-N 3.19Å
566	R	96.3	Very high	94.5	Very high	162 Å²	162	122.9 Å²	122.9	61%	0.611	54%	0.537	S	S	*	.	H	α-helix	trans	-62.9	-42.4	174.3	-72.8	167	-178	177.7	2.4	112	Q562 F563 M569 R570	Q562-R566 WeakPolarHBondContact O-CB 3.3Å; Q562-R566 WeakPolarHBondContact O-CD 3.46Å; Q562-R566 WeakPolarHBondContact O-CG 3.34Å; Q562-R566 PolarHBondContact O-N 3.35Å; F563-R566 PolarHBondContact O-N 2.86Å; R566-M569 PolarHBondContact O-N 2.88Å; R566-R570 WeakPolarHBondContact O-CG 3.5Å; R566-R570 PolarHBondContact O-N 3.03Å
567	E	93.3	Very high	94.6	Very high	66 Å²	66	127.8 Å²	127.8	31%	0.308	54%	0.543	S	S	.	.	H	α-helix	trans	-73.4	-37.3	-179.5	-157.2	60	-157.4	0	0	111.4	F563 M569 R570 I571	F563-E567 WeakPolarHBondContact O-CB 3.21Å; F563-E567 PolarHBondContact O-N 3.26Å; E567-M569 VanDerWaalsContact C-N 3.32Å; E567-M569 PolarHBondContact O-N 3.05Å; E567-R570 WeakPolarHBondContact O-CB 3.46Å; E567-R570 PolarHBondContact O-N 3.33Å; E567-R570 WeakPolarHBondContact OE2-CD 3.44Å; E567-R570 IonicContact OE2-NE 3.74Å; E567-R570 IonicContact OE2-NH1 3.7Å; E567-R570 PolarHBondContact OE2-NH1 2.85Å; E567-I571 HydrophobicContact CG-CD1 4.45Å; E567-I571 WeakPolarHBondContact O-CG1 3.23Å; E567-I571 PolarHBondContact O-N 3.22Å
568	R	94	Very high	94.5	Very high	154 Å²	154	130.2 Å²	130.2	58%	0.581	55%	0.553	S	S	*	*	H	α-helix	trans	-56.6	-45.9	166.7	180	-170.5	155.7	-154.7	-11.1	111	L564 E565 R570 I571 E572	L564-R568 WeakPolarHBondContact O-CB 3.2Å; L564-R568 PolarHBondContact O-N 2.74Å; E565-R568 PolarHBondContact O-N 2.8Å; R568-R570 VanDerWaalsContact C-N 3.28Å; R568-R570 PolarHBondContact O-N 2.87Å; R568-I571 PolarHBondContact O-N 3.4Å; R568-E572 IonicContact CZ-OE2 3.35Å; R568-E572 VanDerWaalsContact CZ-OE2 3.3Å; R568-E572 IonicContact NE-OE2 3.7Å; R568-E572 PolarHBondContact NE-OE2 3.01Å; R568-E572 IonicContact NH2-OE1 3.09Å; R568-E572 IonicContact NH2-OE2 3.74Å; R568-E572 PolarHBondContact NH2-OE2 3.39Å; R568-E572 WeakPolarHBondContact O-CB 3.46Å; R568-E572 PolarHBondContact O-N 2.93Å
569	M	91.3	Very high	94.4	Very high	119 Å²	119	127.3 Å²	127.3	59%	0.586	55%	0.545	S	S	*	.	H	α-helix	trans	-63.3	-33	178.6	-75.9	-65.2	-64.7	0	0	112.7	E565 R566 E567 Y573	E565-M569 WeakPolarHBondContact O-CB 3.48Å; E565-M569 VanDerWaalsContact O-CG 3.3Å; E565-M569 WeakPolarHBondContact O-CG 3.45Å; E565-M569 PolarHBondContact O-N 3.19Å; R566-M569 PolarHBondContact O-N 2.88Å; E567-M569 VanDerWaalsContact C-N 3.32Å; E567-M569 PolarHBondContact O-N 3.05Å; M569-Y573 VanDerWaalsContact O-CB 3.27Å; M569-Y573 WeakPolarHBondContact O-CB 3.15Å; M569-Y573 PolarHBondContact O-N 3.42Å
570	R	96.4	Very high	94.3	Very high	167 Å²	167	126.5 Å²	126.5	63%	0.63	54%	0.541	S	S	*	.	H	α-helix	trans	-66.5	-50.6	171.7	-74.8	167.4	161.4	-155.2	-5.5	112	R566 E567 R568 E572 Y573 E574	R566-R570 WeakPolarHBondContact O-CG 3.5Å; R566-R570 PolarHBondContact O-N 3.03Å; E567-R570 WeakPolarHBondContact O-CB 3.46Å; E567-R570 PolarHBondContact O-N 3.33Å; E567-R570 WeakPolarHBondContact OE2-CD 3.44Å; E567-R570 IonicContact OE2-NE 3.74Å; E567-R570 IonicContact OE2-NH1 3.7Å; E567-R570 PolarHBondContact OE2-NH1 2.85Å; R568-R570 VanDerWaalsContact C-N 3.28Å; R568-R570 PolarHBondContact O-N 2.87Å; R570-E572 VanDerWaalsContact C-N 3.3Å; R570-E572 PolarHBondContact O-N 3.46Å; R570-Y573 WeakPolarHBondContact O-CB 3.49Å; R570-Y573 PolarHBondContact O-N 3.3Å; R570-E574 WeakPolarHBondContact O-CB 3.13Å; R570-E574 PolarHBondContact O-N 2.94Å
571	I	93.7	Very high	94.3	Very high	99 Å²	99	128.9 Å²	128.9	51%	0.508	55%	0.545	S	S	.	.	H	α-helix	trans	-61.1	-39.5	177.6	-65.6	163.9	0	0	0	110.9	E567 R568 E574 R575	E567-I571 HydrophobicContact CG-CD1 4.45Å; E567-I571 WeakPolarHBondContact O-CG1 3.23Å; E567-I571 PolarHBondContact O-N 3.22Å; R568-I571 PolarHBondContact O-N 3.4Å; I571-E574 PolarHBondContact O-N 3.18Å; I571-R575 WeakPolarHBondContact O-CB 3.3Å; I571-R575 PolarHBondContact O-N 3.21Å
572	E	93.1	Very high	94.4	Very high	84 Å²	84	124.6 Å²	124.6	39%	0.393	53%	0.534	S	S	.	.	H	α-helix	trans	-71.7	-33.3	178.9	-169.5	144.7	-141	0	0	112	R568 R570 R576	R568-E572 IonicContact CZ-OE2 3.35Å; R568-E572 VanDerWaalsContact CZ-OE2 3.3Å; R568-E572 IonicContact NE-OE2 3.7Å; R568-E572 PolarHBondContact NE-OE2 3.01Å; R568-E572 IonicContact NH2-OE1 3.09Å; R568-E572 IonicContact NH2-OE2 3.74Å; R568-E572 PolarHBondContact NH2-OE2 3.39Å; R568-E572 WeakPolarHBondContact O-CB 3.46Å; R568-E572 PolarHBondContact O-N 2.93Å; R570-E572 VanDerWaalsContact C-N 3.3Å; R570-E572 PolarHBondContact O-N 3.46Å; E572-R576 VanDerWaalsContact O-CB 3.3Å; E572-R576 WeakPolarHBondContact O-CB 3.39Å; E572-R576 PolarHBondContact O-N 2.97Å; E572-R576 VanDerWaalsContact O-N 3.1Å
573	Y	94.6	Very high	94.2	Very high	155 Å²	155	126.9 Å²	126.9	61%	0.608	55%	0.546	S	S	*	.	H	α-helix	trans	-67.7	-46.6	169.2	175	-93.7	0	0	0	112.4	M569 R570 R576 R577	M569-Y573 VanDerWaalsContact O-CB 3.27Å; M569-Y573 WeakPolarHBondContact O-CB 3.15Å; M569-Y573 PolarHBondContact O-N 3.42Å; R570-Y573 WeakPolarHBondContact O-CB 3.49Å; R570-Y573 PolarHBondContact O-N 3.3Å; Y573-R576 WeakPolarHBondContact O-CB 3.27Å; Y573-R576 PolarHBondContact O-N 2.66Å; Y573-R577 PolarHBondContact O-N 3.2Å
574	E	95.1	Very high	94.2	Very high	139 Å²	139	127.4 Å²	127.4	65%	0.65	55%	0.545	S	S	*	.	H	α-helix	trans	-63.4	-47.5	179	-177.6	162.6	-128.4	0	0	111.4	R570 I571 R576 R577 E578	R570-E574 WeakPolarHBondContact O-CB 3.13Å; R570-E574 PolarHBondContact O-N 2.94Å; I571-E574 PolarHBondContact O-N 3.18Å; E574-R576 VanDerWaalsContact C-N 3.26Å; E574-R576 PolarHBondContact O-N 3.27Å; E574-R577 CarbonylContact O-C 3.58Å; E574-R577 WeakPolarHBondContact O-CB 3.36Å; E574-R577 PolarHBondContact O-N 3.1Å; E574-E578 PolarHBondContact O-N 3.46Å
575	R	93.9	Very high	94.1	Very high	148 Å²	148	128.1 Å²	128.1	56%	0.558	55%	0.545	S	S	*	.	H	α-helix	trans	-57	-37.7	172.6	-175.2	-178.4	-176.7	-136.6	2.6	112.4	I571 Q579	I571-R575 WeakPolarHBondContact O-CB 3.3Å; I571-R575 PolarHBondContact O-N 3.21Å; R575-Q579 WeakPolarHBondContact O-CB 3.45Å; R575-Q579 VanDerWaalsContact O-CG 3.23Å; R575-Q579 WeakPolarHBondContact O-CG 3.41Å; R575-Q579 PolarHBondContact O-N 3.3Å
576	R	95.4	Very high	94.1	Very high	186 Å²	186	130.5 Å²	130.5	70%	0.702	55%	0.549	S	S	*	.	H	α-helix	trans	-69	-39.2	175.4	-175.3	176.9	179.3	180	-0.5	111.9	E572 Y573 E574 Q579 E580	E572-R576 VanDerWaalsContact O-CB 3.3Å; E572-R576 WeakPolarHBondContact O-CB 3.39Å; E572-R576 PolarHBondContact O-N 2.97Å; E572-R576 VanDerWaalsContact O-N 3.1Å; Y573-R576 WeakPolarHBondContact O-CB 3.27Å; Y573-R576 PolarHBondContact O-N 2.66Å; E574-R576 VanDerWaalsContact C-N 3.26Å; E574-R576 PolarHBondContact O-N 3.27Å; R576-Q579 PolarHBondContact O-N 3.01Å; R576-E580 PolarHBondContact O-N 3.39Å
577	R	96.8	Very high	94.1	Very high	159 Å²	159	127 Å²	127	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-66.6	-37.5	175.4	-168.1	-178.2	-173.5	-165.5	3.8	111.9	Y573 E574 E580 R581	Y573-R577 PolarHBondContact O-N 3.2Å; E574-R577 CarbonylContact O-C 3.58Å; E574-R577 WeakPolarHBondContact O-CB 3.36Å; E574-R577 PolarHBondContact O-N 3.1Å; R577-E580 PolarHBondContact O-N 2.91Å; R577-R581 PolarHBondContact O-N 2.89Å
578	E	91.8	Very high	94.1	Very high	111 Å²	111	128.9 Å²	128.9	52%	0.519	55%	0.548	S	S	.	.	H	α-helix	trans	-68.9	-44.6	173.4	-175.1	174.1	-119.9	0	0	111.9	E574 E580 R581 I582	E574-E578 PolarHBondContact O-N 3.46Å; E578-E580 PolarHBondContact O-N 2.91Å; E578-R581 WeakPolarHBondContact O-CB 3.12Å; E578-R581 PolarHBondContact O-N 3.11Å; E578-R581 VanDerWaalsContact O-N 3.11Å; E578-I582 HydrophobicContact CG-CD1 3.98Å; E578-I582 WeakPolarHBondContact O-CG1 3.31Å; E578-I582 PolarHBondContact O-N 3.3Å
579	Q	94.4	Very high	94.1	Very high	96 Å²	96	126.1 Å²	126.1	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-56.7	-37.7	170.7	-77.1	172.5	-0.1	0	0	112.2	R575 R576 M583	R575-Q579 WeakPolarHBondContact O-CB 3.45Å; R575-Q579 VanDerWaalsContact O-CG 3.23Å; R575-Q579 WeakPolarHBondContact O-CG 3.41Å; R575-Q579 PolarHBondContact O-N 3.3Å; R576-Q579 PolarHBondContact O-N 3.01Å; Q579-M583 VanDerWaalsContact O-CB 3.31Å; Q579-M583 WeakPolarHBondContact O-CB 3.48Å; Q579-M583 VanDerWaalsContact O-CG 3.25Å; Q579-M583 WeakPolarHBondContact O-CG 3.31Å; Q579-M583 PolarHBondContact O-N 2.94Å
580	E	93.6	Very high	94.3	Very high	95 Å²	95	127.4 Å²	127.4	44%	0.444	54%	0.543	S	S	.	.	H	α-helix	trans	-67.7	-41.8	175.1	-162.6	-174.8	169.2	0	0	112.1	R576 R577 E578 M583 R584	R576-E580 PolarHBondContact O-N 3.39Å; R577-E580 PolarHBondContact O-N 2.91Å; E578-E580 PolarHBondContact O-N 2.91Å; E580-M583 PolarHBondContact O-N 2.92Å; E580-R584 VanDerWaalsContact CD-NH2 3.34Å; E580-R584 WeakPolarHBondContact O-CG 3.41Å; E580-R584 PolarHBondContact O-N 3.37Å; E580-R584 IonicContact OE1-CZ 3.69Å; E580-R584 IonicContact OE1-NE 2.8Å; E580-R584 PolarHBondContact OE1-NE 2.86Å; E580-R584 IonicContact OE1-NH2 3.38Å; E580-R584 PolarHBondContact OE1-NH2 2.84Å; E580-R584 IonicContact OE2-NH2 2.69Å
581	R	95.4	Very high	94.2	Very high	166 Å²	166	125.8 Å²	125.8	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-57.8	-50.8	172	-74	179.9	63.9	-151.1	-4.2	111.5	R577 E578 M583 R584 E585	R577-R581 PolarHBondContact O-N 2.89Å; E578-R581 WeakPolarHBondContact O-CB 3.12Å; E578-R581 PolarHBondContact O-N 3.11Å; E578-R581 VanDerWaalsContact O-N 3.11Å; R581-M583 VanDerWaalsContact C-N 3.28Å; R581-M583 PolarHBondContact O-N 3.06Å; R581-R584 PolarHBondContact O-N 3.29Å; R581-E585 WeakPolarHBondContact O-CB 3.45Å; R581-E585 PolarHBondContact O-N 3.34Å
582	I	92.6	Very high	94.2	Very high	91 Å²	91	125.9 Å²	125.9	47%	0.467	54%	0.535	S	S	.	.	H	α-helix	trans	-60.7	-37.9	178.7	-66.7	166.2	0	0	0	110.9	E578 R586	E578-I582 HydrophobicContact CG-CD1 3.98Å; E578-I582 WeakPolarHBondContact O-CG1 3.31Å; E578-I582 PolarHBondContact O-N 3.3Å; I582-R586 WeakPolarHBondContact O-CB 3.25Å; I582-R586 PolarHBondContact O-N 2.89Å
583	M	92.2	Very high	94.2	Very high	116 Å²	116	128.7 Å²	128.7	57%	0.571	55%	0.548	S	S	*	.	H	α-helix	trans	-68.1	-39.5	176	-80.3	-68.6	-65	0	0	112.9	Q579 E580 R581 E587	Q579-M583 VanDerWaalsContact O-CB 3.31Å; Q579-M583 WeakPolarHBondContact O-CB 3.48Å; Q579-M583 VanDerWaalsContact O-CG 3.25Å; Q579-M583 WeakPolarHBondContact O-CG 3.31Å; Q579-M583 PolarHBondContact O-N 2.94Å; E580-M583 PolarHBondContact O-N 2.92Å; R581-M583 VanDerWaalsContact C-N 3.28Å; R581-M583 PolarHBondContact O-N 3.06Å; M583-E587 WeakPolarHBondContact O-CB 3.4Å; M583-E587 PolarHBondContact O-N 3.18Å
584	R	95.3	Very high	93.9	Very high	137 Å²	137	125.9 Å²	125.9	52%	0.517	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-48.4	174.4	-68.3	177.4	-163.8	178.1	3.2	111.4	E580 R581 R586 E587 E588	E580-R584 VanDerWaalsContact CD-NH2 3.34Å; E580-R584 WeakPolarHBondContact O-CG 3.41Å; E580-R584 PolarHBondContact O-N 3.37Å; E580-R584 IonicContact OE1-CZ 3.69Å; E580-R584 IonicContact OE1-NE 2.8Å; E580-R584 PolarHBondContact OE1-NE 2.86Å; E580-R584 IonicContact OE1-NH2 3.38Å; E580-R584 PolarHBondContact OE1-NH2 2.84Å; E580-R584 IonicContact OE2-NH2 2.69Å; R581-R584 PolarHBondContact O-N 3.29Å; R584-R586 VanDerWaalsContact C-N 3.29Å; R584-R586 PolarHBondContact O-N 2.9Å; R584-E587 CarbonylContact O-C 3.58Å; R584-E587 WeakPolarHBondContact O-CA 3.33Å; R584-E587 PolarHBondContact O-N 3.36Å; R584-E588 WeakPolarHBondContact O-CG 3.45Å; R584-E588 PolarHBondContact O-N 2.93Å
585	E	94.1	Very high	93.7	Very high	112 Å²	112	125 Å²	125	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-57.5	-42.2	175.8	-175.4	-179.9	169.5	0	0	111.4	R581 E588 L589	R581-E585 WeakPolarHBondContact O-CB 3.45Å; R581-E585 PolarHBondContact O-N 3.34Å; E585-E588 PolarHBondContact O-N 3.35Å; E585-L589 HydrophobicContact CG-CD1 4.39Å; E585-L589 WeakPolarHBondContact O-CB 3.34Å; E585-L589 VanDerWaalsContact O-CG 3.31Å; E585-L589 WeakPolarHBondContact O-CG 3.33Å; E585-L589 PolarHBondContact O-N 3.29Å
586	R	93.7	Very high	93.4	Very high	178 Å²	178	122.6 Å²	122.6	67%	0.672	53%	0.534	S	S	*	.	H	α-helix	trans	-67.2	-33.7	174.2	-173.5	179.1	-178.4	-162.2	1.5	113.2	I582 R584 R590	I582-R586 WeakPolarHBondContact O-CB 3.25Å; I582-R586 PolarHBondContact O-N 2.89Å; R584-R586 VanDerWaalsContact C-N 3.29Å; R584-R586 PolarHBondContact O-N 2.9Å; R586-R590 WeakPolarHBondContact O-CB 3.44Å; R586-R590 PolarHBondContact O-N 2.84Å
587	E	94.7	Very high	92.9	Very high	88 Å²	88	121 Å²	121	41%	0.411	53%	0.528	S	S	.	.	H	α-helix	trans	-72.6	-37.8	173.4	-166.4	-177.3	175.7	0	0	111.6	M583 R584 R590 R591	M583-E587 WeakPolarHBondContact O-CB 3.4Å; M583-E587 PolarHBondContact O-N 3.18Å; R584-E587 CarbonylContact O-C 3.58Å; R584-E587 WeakPolarHBondContact O-CA 3.33Å; R584-E587 PolarHBondContact O-N 3.36Å; E587-R590 CarbonylContact O-C 3.54Å; E587-R590 WeakPolarHBondContact O-CB 3.48Å; E587-R590 PolarHBondContact O-N 3.39Å; E587-R591 VanDerWaalsContact CD-NH2 3.29Å; E587-R591 WeakPolarHBondContact O-CG 3.29Å; E587-R591 PolarHBondContact O-N 2.87Å; E587-R591 IonicContact OE1-CZ 2.72Å; E587-R591 IonicContact OE1-NE 3.84Å; E587-R591 PolarHBondContact OE1-NE 2.79Å; E587-R591 IonicContact OE1-NH2 3.94Å; E587-R591 PolarHBondContact OE1-NH2 3.02Å; E587-R591 IonicContact OE2-NH2 3.35Å
588	E	94.8	Very high	92.3	Very high	107 Å²	107	119.2 Å²	119.2	50%	0.5	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-46.3	174.3	-74	169.2	-158.2	0	0	111.2	R584 E585 R590 R591 Q592	R584-E588 WeakPolarHBondContact O-CG 3.45Å; R584-E588 PolarHBondContact O-N 2.93Å; E585-E588 PolarHBondContact O-N 3.35Å; E588-R590 VanDerWaalsContact C-N 3.29Å; E588-R590 PolarHBondContact O-N 3.26Å; E588-R591 CarbonylContact O-C 3.59Å; E588-R591 PolarHBondContact O-N 2.79Å; E588-R591 VanDerWaalsContact O-N 3.12Å; E588-Q592 VanDerWaalsContact O-CG 3.31Å; E588-Q592 WeakPolarHBondContact O-CG 3.37Å; E588-Q592 PolarHBondContact O-N 2.91Å
589	L	93.6	Very high	91.9	Very high	96 Å²	96	119 Å²	119	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-59.2	-39	170.9	-74	168.8	0	0	0	112	E585 Q592 Q593	E585-L589 HydrophobicContact CG-CD1 4.39Å; E585-L589 WeakPolarHBondContact O-CB 3.34Å; E585-L589 VanDerWaalsContact O-CG 3.31Å; E585-L589 WeakPolarHBondContact O-CG 3.33Å; E585-L589 PolarHBondContact O-N 3.29Å; L589-Q592 PolarHBondContact O-N 2.93Å; L589-Q593 WeakPolarHBondContact O-CB 3.3Å; L589-Q593 PolarHBondContact O-N 3.35Å
590	R	95	Very high	91.3	Very high	145 Å²	145	120.1 Å²	120.1	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-43.8	173	-178.8	-175.5	162.7	-138.2	-20.9	111.3	R586 E587 E588 Q593 E594	R586-R590 WeakPolarHBondContact O-CB 3.44Å; R586-R590 PolarHBondContact O-N 2.84Å; E587-R590 CarbonylContact O-C 3.54Å; E587-R590 WeakPolarHBondContact O-CB 3.48Å; E587-R590 PolarHBondContact O-N 3.39Å; E588-R590 VanDerWaalsContact C-N 3.29Å; E588-R590 PolarHBondContact O-N 3.26Å; R590-Q593 PolarHBondContact O-N 3.09Å; R590-E594 IonicContact CZ-OE2 2.85Å; R590-E594 IonicContact NE-OE2 3.76Å; R590-E594 IonicContact NH2-OE1 3.79Å; R590-E594 IonicContact NH2-OE2 3.83Å; R590-E594 PolarHBondContact NH2-OE2 3.48Å; R590-E594 VanDerWaalsContact NH2-OE2 3.09Å; R590-E594 VanDerWaalsContact O-CB 3.29Å; R590-E594 WeakPolarHBondContact O-CB 3.37Å; R590-E594 PolarHBondContact O-N 3.01Å
591	R	95	Very high	90.5	Very high	134 Å²	134	120.5 Å²	120.5	51%	0.506	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-39.3	177.2	-73.2	173.9	-171.9	179.9	4.3	111.6	E587 E588 E594 Q595	E587-R591 VanDerWaalsContact CD-NH2 3.29Å; E587-R591 WeakPolarHBondContact O-CG 3.29Å; E587-R591 PolarHBondContact O-N 2.87Å; E587-R591 IonicContact OE1-CZ 2.72Å; E587-R591 IonicContact OE1-NE 3.84Å; E587-R591 PolarHBondContact OE1-NE 2.79Å; E587-R591 IonicContact OE1-NH2 3.94Å; E587-R591 PolarHBondContact OE1-NH2 3.02Å; E587-R591 IonicContact OE2-NH2 3.35Å; E588-R591 CarbonylContact O-C 3.59Å; E588-R591 PolarHBondContact O-N 2.79Å; E588-R591 VanDerWaalsContact O-N 3.12Å; R591-E594 PolarHBondContact O-N 3.37Å; R591-Q595 WeakPolarHBondContact O-CB 3.31Å; R591-Q595 WeakPolarHBondContact O-CG 3.21Å; R591-Q595 PolarHBondContact O-N 3.48Å
592	Q	94	Very high	89.4	Confident	100 Å²	100	121.6 Å²	121.6	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-44.2	172.4	-70	169.8	23.1	0	0	111.3	E588 L589 E594 Q595 L596	E588-Q592 VanDerWaalsContact O-CG 3.31Å; E588-Q592 WeakPolarHBondContact O-CG 3.37Å; E588-Q592 PolarHBondContact O-N 2.91Å; L589-Q592 PolarHBondContact O-N 2.93Å; Q592-E594 VanDerWaalsContact C-N 3.34Å; Q592-E594 PolarHBondContact O-N 2.94Å; Q592-Q595 PolarHBondContact O-N 3.46Å; Q592-L596 WeakPolarHBondContact O-CB 3.48Å; Q592-L596 VanDerWaalsContact O-CG 3.3Å; Q592-L596 WeakPolarHBondContact O-CG 3.44Å; Q592-L596 PolarHBondContact O-N 2.68Å
593	Q	92.4	Very high	88.2	Confident	143 Å²	143	124.8 Å²	124.8	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-64.9	-37	175.2	-175.5	173.3	73.9	0	0	112.3	L589 R590 R597	L589-Q593 WeakPolarHBondContact O-CB 3.3Å; L589-Q593 PolarHBondContact O-N 3.35Å; R590-Q593 PolarHBondContact O-N 3.09Å; Q593-R597 WeakPolarHBondContact O-CB 3.31Å; Q593-R597 PolarHBondContact O-N 2.83Å
594	E	88.8	Confident	86.4	Confident	96 Å²	96	125.1 Å²	125.1	45%	0.449	56%	0.555	S	S	.	*	H	α-helix	trans	-71.9	-34.5	176.7	-168.3	149.6	-148.2	0	0	111.8	R590 R591 Q592 R597 F598	R590-E594 IonicContact CZ-OE2 2.85Å; R590-E594 IonicContact NE-OE2 3.76Å; R590-E594 IonicContact NH2-OE1 3.79Å; R590-E594 IonicContact NH2-OE2 3.83Å; R590-E594 PolarHBondContact NH2-OE2 3.48Å; R590-E594 VanDerWaalsContact NH2-OE2 3.09Å; R590-E594 VanDerWaalsContact O-CB 3.29Å; R590-E594 WeakPolarHBondContact O-CB 3.37Å; R590-E594 PolarHBondContact O-N 3.01Å; R591-E594 PolarHBondContact O-N 3.37Å; Q592-E594 VanDerWaalsContact C-N 3.34Å; Q592-E594 PolarHBondContact O-N 2.94Å; E594-R597 PolarHBondContact O-N 2.81Å; E594-F598 WeakPolarHBondContact O-CB 3.42Å; E594-F598 PolarHBondContact O-N 3.12Å
595	Q	89.3	Confident	84.7	Confident	122 Å²	122	124.8 Å²	124.8	57%	0.57	57%	0.568	S	S	*	*	H	α-helix	trans	-67.2	-49.4	169.4	-75.3	167.8	-4.1	0	0	111.8	R591 Q592 R597 F598 E599	R591-Q595 WeakPolarHBondContact O-CB 3.31Å; R591-Q595 WeakPolarHBondContact O-CG 3.21Å; R591-Q595 PolarHBondContact O-N 3.48Å; Q592-Q595 PolarHBondContact O-N 3.46Å; Q595-R597 PolarHBondContact O-N 3.08Å; Q595-F598 CarbonylContact O-C 3.58Å; Q595-F598 PolarHBondContact O-N 3.05Å; Q595-E599 PolarHBondContact O-N 3.26Å
596	L	88.8	Confident	82.7	Confident	97 Å²	97	128.9 Å²	128.9	51%	0.508	58%	0.584	S	S	.	*	H	α-helix	trans	-60.1	-31.2	175.2	-74.8	169.8	0	0	0	112	Q592 Q600	Q592-L596 WeakPolarHBondContact O-CB 3.48Å; Q592-L596 VanDerWaalsContact O-CG 3.3Å; Q592-L596 WeakPolarHBondContact O-CG 3.44Å; Q592-L596 PolarHBondContact O-N 2.68Å; L596-Q600 VanDerWaalsContact O-CG 3.31Å; L596-Q600 WeakPolarHBondContact O-CG 3.41Å; L596-Q600 PolarHBondContact O-N 2.88Å; L596-Q600 VanDerWaalsContact O-N 3.12Å; L596-Q600 PolarHBondContact O-NE2 2.8Å
597	R	84.8	Confident	80.8	Confident	153 Å²	153	131 Å²	131	58%	0.577	59%	0.592	S	S	*	*	H	α-helix	trans	-70.7	-48.5	170.2	-177.1	-175	163.5	-152.9	-6.9	111.5	Q593 E594 Q595 E599 Q600 D601	Q593-R597 WeakPolarHBondContact O-CB 3.31Å; Q593-R597 PolarHBondContact O-N 2.83Å; E594-R597 PolarHBondContact O-N 2.81Å; Q595-R597 PolarHBondContact O-N 3.08Å; R597-E599 PolarHBondContact O-N 3.25Å; R597-Q600 CarbonylContact O-C 3.56Å; R597-Q600 WeakPolarHBondContact O-CA 3.35Å; R597-Q600 WeakPolarHBondContact O-CB 3.38Å; R597-Q600 PolarHBondContact O-N 3.31Å; R597-D601 IonicContact CZ-OD2 3.51Å; R597-D601 IonicContact NE-OD2 3.44Å; R597-D601 PolarHBondContact NE-OD2 3.01Å; R597-D601 IonicContact NH2-OD2 2.73Å; R597-D601 PolarHBondContact O-N 2.8Å
598	F	84.2	Confident	78.5	Confident	121 Å²	121	132.2 Å²	132.2	53%	0.531	61%	0.608	S	S	.	*	H	α-helix	trans	-60.5	-33.1	177.5	-176.8	-109.4	0	0	0	112.6	E594 Q595 R602	E594-F598 WeakPolarHBondContact O-CB 3.42Å; E594-F598 PolarHBondContact O-N 3.12Å; Q595-F598 CarbonylContact O-C 3.58Å; Q595-F598 PolarHBondContact O-N 3.05Å; F598-R602 VanDerWaalsContact O-CB 3.29Å; F598-R602 WeakPolarHBondContact O-CB 3.29Å; F598-R602 WeakPolarHBondContact O-CG 3.47Å; F598-R602 PolarHBondContact O-N 3.32Å
599	E	83.9	Confident	76	Confident	105 Å²	105	137 Å²	137	49%	0.491	62%	0.623	S	S	.	*	H	α-helix	trans	-68.5	-40.7	169.7	-75	-169.7	176.3	0	0	112.8	Q595 R597 R602 R603	Q595-E599 PolarHBondContact O-N 3.26Å; R597-E599 PolarHBondContact O-N 3.25Å; E599-R602 CarbonylContact O-C 3.51Å; E599-R602 PolarHBondContact O-N 2.81Å; E599-R603 WeakPolarHBondContact O-CG 3.33Å; E599-R603 PolarHBondContact O-N 3.12Å
600	Q	82.3	Confident	73.8	Confident	121 Å²	121	139.2 Å²	139.2	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-64.1	-44.6	173.7	-78.5	168.3	88.7	0	0	111.6	L596 R597 R602 R603	L596-Q600 VanDerWaalsContact O-CG 3.31Å; L596-Q600 WeakPolarHBondContact O-CG 3.41Å; L596-Q600 PolarHBondContact O-N 2.88Å; L596-Q600 VanDerWaalsContact O-N 3.12Å; L596-Q600 PolarHBondContact O-NE2 2.8Å; R597-Q600 CarbonylContact O-C 3.56Å; R597-Q600 WeakPolarHBondContact O-CA 3.35Å; R597-Q600 WeakPolarHBondContact O-CB 3.38Å; R597-Q600 PolarHBondContact O-N 3.31Å; Q600-R602 PolarHBondContact O-N 3.25Å; Q600-R603 WeakPolarHBondContact O-CB 3.22Å; Q600-R603 PolarHBondContact O-N 3.49Å; Q600-R603 VanDerWaalsContact O-N 3.08Å
601	D	75.2	Confident	71.4	Confident	103 Å²	103	140.8 Å²	140.8	55%	0.551	65%	0.651	S	S	*	*	H	α-helix	trans	-64.9	-20.5	175.1	-67.5	-21.5	0	0	0	111.8	R597	R597-D601 IonicContact CZ-OD2 3.51Å; R597-D601 IonicContact NE-OD2 3.44Å; R597-D601 PolarHBondContact NE-OD2 3.01Å; R597-D601 IonicContact NH2-OD2 2.73Å; R597-D601 PolarHBondContact O-N 2.8Å
602	R	72.3	Confident	69.4	Low	188 Å²	188	142.1 Å²	142.1	71%	0.709	67%	0.668	S	S	*	*	H	α-helix	trans	-91.9	-13.7	172	-83.5	-178.3	143.2	-165.4	-6.2	115.2	F598 E599 Q600	F598-R602 VanDerWaalsContact O-CB 3.29Å; F598-R602 WeakPolarHBondContact O-CB 3.29Å; F598-R602 WeakPolarHBondContact O-CG 3.47Å; F598-R602 PolarHBondContact O-N 3.32Å; E599-R602 CarbonylContact O-C 3.51Å; E599-R602 PolarHBondContact O-N 2.81Å; Q600-R602 PolarHBondContact O-N 3.25Å
603	R	67.6	Low	66.8	Low	159 Å²	159	149.2 Å²	149.2	60%	0.6	69%	0.691	S	S	*	*	S	Bend	trans	-66.4	132.3	171.6	-73.8	167.2	-165.3	-155.1	0	107.4	E599 Q600 V605	E599-R603 WeakPolarHBondContact O-CG 3.33Å; E599-R603 PolarHBondContact O-N 3.12Å; Q600-R603 WeakPolarHBondContact O-CB 3.22Å; Q600-R603 PolarHBondContact O-N 3.49Å; Q600-R603 VanDerWaalsContact O-N 3.08Å; R603-V605 PolarHBondContact O-N 2.91Å
604	P	55.7	Low	64.3	Low	122 Å²	122	150.4 Å²	150.4	79%	0.792	69%	0.694	S	S	*	*			trans	-62.8	111.5	-173.6	24.4	-33.6	0	0	0	109.8	K606	P604-K606 PolarHBondContact O-N 3.03Å
605	V	59.5	Low	62	Low	131 Å²	131	151 Å²	151	79%	0.794	70%	0.7	S	S	*	*			trans	-57	105.6	172.7	178	0	0	0	0	107.3	R603 R607	R603-V605 PolarHBondContact O-N 2.91Å; V605-R607 PolarHBondContact O-N 3.4Å; V605-R607 VanDerWaalsContact O-N 3.08Å
606	K	51.8	Low	59.7	Low	198 Å²	198	151.3 Å²	151.3	86%	0.861	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-57.4	118.9	172	-85.7	178.2	172.5	174.3	0	106.9	P604	P604-K606 PolarHBondContact O-N 3.03Å
607	R	53.1	Low	57.4	Low	222 Å²	222	157.5 Å²	157.5	84%	0.838	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-46.6	138.6	173.5	-95.7	-177.8	161	84.3	-2.7	109	V605 Y609	V605-R607 PolarHBondContact O-N 3.4Å; V605-R607 VanDerWaalsContact O-N 3.08Å; R607-Y609 PolarHBondContact O-N 2.69Å
608	P	46.7	Very low	55.7	Low	114 Å²	114	155.1 Å²	155.1	74%	0.74	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-49.4	130.7	160	-22.3	33.5	0	0	0	108.2	D610	P608-D610 PolarHBondContact O-N 3.35Å
609	Y	41.9	Very low	53.8	Low	206 Å²	206	155.7 Å²	155.7	81%	0.808	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-74.8	121.1	178.9	-150.6	-92.6	0	0	0	107.5	R607 M611	R607-Y609 PolarHBondContact O-N 2.69Å; Y609-M611 PolarHBondContact O-N 3.08Å
610	D	46.8	Very low	51.6	Low	143 Å²	143	160.4 Å²	160.4	77%	0.765	75%	0.754	S	S	*	*			trans	-61.6	110.4	177	-72.7	-56.6	0	0	0	109.1	P608 D612	P608-D610 PolarHBondContact O-N 3.35Å; D610-D612 PolarHBondContact O-N 2.9Å
611	M	46.2	Very low	49.6	Very low	179 Å²	179	164.9 Å²	164.9	88%	0.882	77%	0.766	S	S	*	*			trans	-80.1	48.2	-176.7	-82.1	-71.1	-171.8	0	0	112.1	Y609	Y609-M611 PolarHBondContact O-N 3.08Å
612	D	52.3	Low	48	Very low	162 Å²	162	168.8 Å²	168.8	87%	0.866	78%	0.783	S	S	*	*			trans	-137.3	51.4	-179.1	-109.6	-42.3	0	0	0	111.9	D610	D610-D612 PolarHBondContact O-N 2.9Å
613	R	38.6	Very low	46.9	Very low	248 Å²	248	163.9 Å²	163.9	94%	0.936	78%	0.782	S	S	*	*			trans	-139.1	125.4	152.8	-152	167.9	-172.3	172.1	2.6	113.2
614	K	41.4	Very low	45.7	Very low	169 Å²	169	164 Å²	164	74%	0.735	79%	0.792	S	S	*	*			trans	-85	168.7	-169.3	-165.7	176.7	155.3	-79.9	0	112.5
615	D	39.9	Very low	44.8	Very low	109 Å²	109	162.9 Å²	162.9	58%	0.583	78%	0.779	S	S	*	*			trans	95.5	102.7	159.8	-54.5	-55.1	0	0	0	119.3
616	D	41.5	Very low	44.2	Very low	128 Å²	128	164.5 Å²	164.5	68%	0.684	78%	0.783	S	S	*	*				85.6	97.7	122.5	-76.4	-3.7	0	0	0	125.5
617	W	40.4	Very low	43.5	Very low	226 Å²	226	164 Å²	164	86%	0.856	78%	0.776	S	S	*	*			trans	65.8	162.5	143	-57	90.4	0	0	0	120.8
618	P	48.8	Very low	42.7	Very low	104 Å²	104	163.5 Å²	163.5	68%	0.675	78%	0.78	S	S	*	*				-139.3	176	-56.2	41.3	-25.9	0	0	0	116.4
619	D	43.8	Very low	42.1	Very low	132 Å²	132	161.5 Å²	161.5	71%	0.706	78%	0.78	S	S	*	*			trans	-10.1	125.4	166.2	179.1	24.9	0	0	0	118.5	R621	D619-R621 PolarHBondContact OD1-N 2.94Å
620	K	38.7	Very low	41.7	Very low	204 Å²	204	162 Å²	162	89%	0.887	78%	0.781	S	S	*	*			trans	-143.2	109.9	152.3	-118.6	171.8	-172.5	171.3	0	112.6
621	R	40.4	Very low	41.2	Very low	216 Å²	216	160.2 Å²	160.2	82%	0.815	78%	0.779	S	S	*	*			trans	-44.1	142.3	165.2	-52.4	169	-174.3	-137.8	-3.7	113	D619	D619-R621 PolarHBondContact OD1-N 2.94Å
622	M	40.9	Very low	40.8	Very low	185 Å²	185	156.7 Å²	156.7	91%	0.911	76%	0.764	S	S	*	*			trans	-148.7	131.2	136.2	-98.2	-79.2	163.3	0	0	108
623	A	48.6	Very low	39.8	Very low	84 Å²	84	158.6 Å²	158.6	69%	0.694	77%	0.765	S	S	*	*			trans	-127.6	127.6	168.5	0	0	0	0	0	107.4
624	M	42.8	Very low	39.4	Very low	161 Å²	161	150 Å²	150	79%	0.793	75%	0.754	S	S	*	*			trans	-148.4	108.3	166.3	-82.1	-71.3	139.5	0	0	104.7
625	D	36.5	Very low	38.9	Very low	99 Å²	99	152.8 Å²	152.8	53%	0.529	76%	0.76	S	S	.	*				102.4	103.2	63.5	-116.4	40.3	0	0	0	109.4	R627	D625-R627 IonicContact OD2-CZ 2.7Å; D625-R627 IonicContact OD2-NE 3.53Å; D625-R627 PolarHBondContact OD2-NE 2.96Å; D625-R627 IonicContact OD2-NH2 3.6Å; D625-R627 PolarHBondContact OD2-NH2 3.23Å
626	D	46.6	Very low	38.5	Very low	166 Å²	166	154 Å²	154	89%	0.888	76%	0.761	S	S	*	*			trans	-62.7	131.6	165.7	-57.5	-94.6	0	0	0	110.4
627	R	37.1	Very low	38.1	Very low	188 Å²	188	153.4 Å²	153.4	71%	0.709	76%	0.758	S	S	*	*			trans	-154.2	86.4	176.3	-118.9	173.6	-114	-116.3	1.7	114.5	D625	D625-R627 IonicContact OD2-CZ 2.7Å; D625-R627 IonicContact OD2-NE 3.53Å; D625-R627 PolarHBondContact OD2-NE 2.96Å; D625-R627 IonicContact OD2-NH2 3.6Å; D625-R627 PolarHBondContact OD2-NH2 3.23Å
628	F	36.6	Very low	37.7	Very low	211 Å²	211	152.9 Å²	152.9	93%	0.925	76%	0.756	S	S	*	*			trans	64.2	159.4	165	-58.1	-81.6	0	0	0	116.6
629	G	34.3	Very low	36.9	Very low	71 Å²	71	157.3 Å²	157.3	73%	0.732	76%	0.761	S	S	*	*			cis	172	145.5	-7	0	0	0	0	0	111.5
630	R	33.6	Very low	36.4	Very low	217 Å²	217	159.9 Å²	159.9	82%	0.819	77%	0.769	S	S	*	*			trans	-64.2	143.9	-176.4	-70.1	165.8	150.4	-93.5	2.8	114.6	D632	R630-D632 IonicContact NH1-OD2 3.91Å
631	S	36	Very low	36.2	Very low	105 Å²	105	156.7 Å²	156.7	73%	0.734	76%	0.761	S	S	*	*				-177.1	113.8	119.6	53.2	0	0	0	0	108.7
632	D	37.1	Very low	35.7	Very low	106 Å²	106	154.4 Å²	154.4	57%	0.567	76%	0.758	S	S	*	*				71.3	142.8	83.6	-68.1	-58.4	0	0	0	112.5	R630	R630-D632 IonicContact NH1-OD2 3.91Å
633	F	31.5	Very low	35.4	Very low	202 Å²	202	152.8 Å²	152.8	89%	0.886	75%	0.753	S	S	*	*			cis	-145.2	161.3	20.3	-103	-69.1	0	0	0	113
634	G	29.9	Very low	35	Very low	68 Å²	68	156.8 Å²	156.8	70%	0.701	76%	0.757	S	S	*	*			trans	173.7	80.1	162.9	0	0	0	0	0	118.7
635	R	31.1	Very low	34.9	Very low	227 Å²	227	159.7 Å²	159.7	86%	0.857	76%	0.759	S	S	*	*			trans	65.6	153.1	171.2	-59.6	-178.6	179	-110.5	7.7	116.3
636	Q	33.1	Very low	34.8	Very low	133 Å²	133	162.6 Å²	162.6	62%	0.621	78%	0.775	S	S	*	*			cis	-155	166	-21.1	-115.3	178.3	-86.8	0	0	110.5
637	D	32.5	Very low	34.3	Very low	116 Å²	116	167 Å²	167	62%	0.62	78%	0.778	S	S	*	*			trans	25.9	106.7	162.7	-61.4	-71.9	0	0	0	119.6
638	R	32.2	Very low	33.9	Very low	216 Å²	216	161.6 Å²	161.6	82%	0.815	78%	0.781	S	S	*	*				82.6	81.2	69	-172.3	178.9	-75.6	-177.5	-1.6	114.5
639	Y	30.6	Very low	33.7	Very low	197 Å²	197	161 Å²	161	77%	0.773	77%	0.773	S	S	*	*			trans	44.4	118.1	143.7	-71.7	-75.4	0	0	0	121.3
640	Q	34.5	Very low	33.3	Very low	185 Å²	185	165 Å²	165	86%	0.864	77%	0.771	S	S	*	*				-153.1	83	117.6	-127.8	166.9	102.8	0	0	112
641	D	34.9	Very low	33.3	Very low	137 Å²	137	162.8 Å²	162.8	73%	0.733	77%	0.769	S	S	*	*			trans	-78.3	122.4	166.1	-61.4	-65.6	0	0	0	109.3
642	F	29.4	Very low	32.8	Very low	168 Å²	168	164.5 Å²	164.5	74%	0.737	77%	0.77	S	S	*	*			trans	-137.8	103	171	-131.1	-74.5	0	0	0	109.8	H644	F642-H644 AromaticContact CD1-CE1 3.65Å; F642-H644 PolarHBondContact O-N 3.01Å
643	D	35.2	Very low	32.4	Very low	151 Å²	151	166.8 Å²	166.8	81%	0.807	78%	0.783	S	S	*	*			trans	-65.1	124.6	-179.7	-102.9	-54.1	0	0	0	111.3
644	H	39.3	Very low	32.3	Very low	169 Å²	169	160.5 Å²	160.5	78%	0.782	78%	0.775	S	S	*	*			trans	-122.7	53.2	174.1	-76.2	2.3	0	0	0	110.1	F642	F642-H644 AromaticContact CD1-CE1 3.65Å; F642-H644 PolarHBondContact O-N 3.01Å
645	R	41.7	Very low	32.4	Very low	222 Å²	222	165.1 Å²	165.1	84%	0.838	78%	0.778	S	S	*	*			trans	-130.6	33.3	-176.5	-146.5	178	-169.8	156.1	4.8	115.8
646	D	32.7	Very low	32.3	Very low	160 Å²	160	162.1 Å²	162.1	86%	0.856	77%	0.774	S	S	*	*			trans	-162.8	111.7	142.8	-113	-28.9	0	0	0	113.3
647	R	36.9	Very low	31.9	Very low	257 Å²	257	166.3 Å²	166.3	97%	0.97	79%	0.79	S	S	*	*			trans	-160.1	67.8	163.4	-152.7	179.3	-158.7	-176.6	7.5	112.9
648	G	29.3	Very low	31.8	Very low	75 Å²	75	165 Å²	165	77%	0.773	79%	0.79	S	S	*	*			trans	172.6	76.8	172.6	0	0	0	0	0	116.6
649	R	31.9	Very low	31.9	Very low	200 Å²	200	161.2 Å²	161.2	76%	0.755	79%	0.786	S	S	*	*			trans	-150	137.6	163.6	-138.2	-177.5	-156.6	-77	0.1	111
650	F	26	Very low	31.8	Very low	154 Å²	154	162.1 Å²	162.1	68%	0.675	79%	0.788	S	S	*	*			trans	66.9	144.5	-177.6	-49.8	-77.2	0	0	0	115.4
651	Q	32.8	Very low	31.8	Very low	170 Å²	170	160.9 Å²	160.9	79%	0.794	78%	0.782	S	S	*	*			cis	-104.8	153	-22	-75.7	97.6	1.1	0	0	108.5
652	D	27	Very low	31.4	Very low	141 Å²	141	157.6 Å²	157.6	75%	0.754	78%	0.781	S	S	*	*			cis	69.1	87	45	-138.4	-11.8	0	0	0	113.9
653	D	28.2	Very low	31.5	Very low	155 Å²	155	160 Å²	160	83%	0.829	78%	0.784	S	S	*	*			trans	-170.1	136.7	133.2	-117.1	-38.9	0	0	0	110.9
654	G	29.5	Very low	31.5	Very low	70 Å²	70	158.8 Å²	158.8	72%	0.722	78%	0.778	S	S	*	*			trans	-170	99.5	-178.4	0	0	0	0	0	113.8
655	Q	32	Very low	30.9	Very low	164 Å²	164	156.1 Å²	156.1	77%	0.766	78%	0.778	S	S	*	*			trans	-138.4	113.8	174.8	-62	-171.8	27	0	0	111.9
656	H	28.3	Very low	30.4	Very low	165 Å²	165	157.7 Å²	157.7	76%	0.764	79%	0.785	S	S	*	*			trans	148.2	96.9	132.4	-91.4	-80.7	0	0	0	113.5
657	F	24.3	Very low	30.2	Very low	221 Å²	221	153.8 Å²	153.8	97%	0.969	78%	0.782	S	S	*	*			trans	-144.1	134.4	141.3	-119.6	-86.3	0	0	0	107.3
658	S	31.3	Very low	29.9	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	78%	0.779	S	S	*	*			trans	-108.3	129.2	-164.6	54.1	0	0	0	0	113.4
659	D	34.1	Very low	29.8	Very low	138 Å²	138	144.9 Å²	144.9	74%	0.738	77%	0.77	S	S	*	*			trans	47.5	133.6	143.9	-53.3	-66.8	0	0	0	119.5
660	R	28.3	Very low	29.7	Very low	215 Å²	215	146 Å²	146	81%	0.811	78%	0.776	S	S	*	*			cis	-157.4	157.2	48.3	-81.4	-174.4	170.9	-172	-4.2	114.5
661	H	35.6	Very low	30.2	Very low	160 Å²	160	144.5 Å²	144.5	74%	0.741	78%	0.775	S	S	*	*			trans	-8.7	151.3	159.6	-28.3	-64.9	0	0	0	120.1
662	G	26.5	Very low	30.4	Very low	68 Å²	68	142.2 Å²	142.2	70%	0.701	76%	0.763	S	S	*	*			cis	146.5	169.7	-1.9	0	0	0	0	0	113.2
663	R	31.5	Very low	30.7	Very low	217 Å²	217	145.2 Å²	145.2	82%	0.819	76%	0.763	S	S	*	*			trans	55.2	138.6	164.8	-68.1	-166.5	170.5	-79.8	-1.5	120
664	D	33.8	Very low	30.9	Very low	127 Å²	127	146 Å²	146	68%	0.679	76%	0.764	S	S	*	*			cis	-133.1	-125.8	-16.9	-82.4	-47.9	0	0	0	107.5
665	S	27.3	Very low	31.1	Very low	112 Å²	112	149.4 Å²	149.4	78%	0.783	77%	0.766	S	S	*	*			cis	-158.9	-166.1	-3.1	-166.4	0	0	0	0	109.5
666	W	31.8	Very low	32.2	Very low	256 Å²	256	146.2 Å²	146.2	97%	0.97	76%	0.759	S	S	*	*			trans	-122.7	157	-165.8	-79.7	47.4	0	0	0	116.6
667	G	28.1	Very low	32.2	Very low	78 Å²	78	148.7 Å²	148.7	80%	0.804	76%	0.762	S	S	*	*			trans	125.9	128.4	167.4	0	0	0	0	0	113.2
668	G	30	Very low	32.6	Very low	88 Å²	88	144.2 Å²	144.2	91%	0.907	75%	0.748	S	S	*	*			cis	96.6	114.4	4.3	0	0	0	0	0	112.6
669	G	27.8	Very low	32.6	Very low	57 Å²	57	143.8 Å²	143.8	59%	0.588	76%	0.757	S	S	*	*			cis	176.7	-176.8	-5	0	0	0	0	0	110.4
670	Y	30.6	Very low	32.4	Very low	223 Å²	223	141 Å²	141	88%	0.875	76%	0.761	S	S	*	*			trans	48.6	144.2	158	79.2	-105.3	0	0	0	119.6
671	D	35.9	Very low	33.1	Very low	122 Å²	122	142 Å²	142	65%	0.652	77%	0.765	S	S	*	*			cis	-170.3	-179.6	15	-162.8	-1.3	0	0	0	110.6
672	K	37.1	Very low	32.8	Very low	123 Å²	123	141.7 Å²	141.7	54%	0.535	77%	0.769	S	S	.	*			trans	92.3	104.2	147.4	-73.3	156	-175.5	85.6	0	122
673	R	32.6	Very low	33.2	Very low	203 Å²	203	150.7 Å²	150.7	77%	0.766	78%	0.781	S	S	*	*			trans	74.9	121.9	134.6	-52.2	175.1	-152.1	-66.6	6	116.9
674	M	31.8	Very low	33	Very low	173 Å²	173	147.2 Å²	147.2	85%	0.852	78%	0.779	S	S	*	*			cis	70	130.5	47.3	-59.3	-75.4	-173.4	0	0	113.7
675	N	35.2	Very low	32.9	Very low	140 Å²	140	146.2 Å²	146.2	75%	0.749	78%	0.782	S	S	*	*			cis	-153.6	-130.5	-11.1	-171.4	23.2	0	0	0	111.9
676	P	53.6	Low	33	Very low	97 Å²	97	144.6 Å²	144.6	63%	0.63	78%	0.783	S	S	*	*				-112.8	163.6	-127.7	39.7	-25.9	0	0	0	117.3
677	R	29.3	Very low	33.1	Very low	218 Å²	218	144.5 Å²	144.5	82%	0.823	78%	0.783	S	S	*	*			trans	-173.7	156.2	138.3	-116.1	176.3	175.1	-93	4.8	115.8
678	D	32.9	Very low	33.4	Very low	127 Å²	127	149.7 Å²	149.7	68%	0.679	78%	0.783	S	S	*	*			trans	56.7	154.4	151	-66.5	-59	0	0	0	123.1
679	G	30.4	Very low	33.7	Very low	77 Å²	77	154.5 Å²	154.5	79%	0.794	78%	0.784	S	S	*	*			trans	83.9	126.7	168.5	0	0	0	0	0	114.2
680	G	29.8	Very low	34	Very low	80 Å²	80	158.9 Å²	158.9	83%	0.825	79%	0.794	S	S	*	*			cis	100.5	120.1	17.8	0	0	0	0	0	109.6
681	R	42.9	Very low	34	Very low	237 Å²	237	152 Å²	152	89%	0.894	79%	0.791	S	S	*	*			trans	-76.7	153.8	170.7	-56.8	173.2	-165.5	-125.7	-2.4	108
682	D	30.1	Very low	33.8	Very low	153 Å²	153	153 Å²	153	82%	0.818	80%	0.796	S	S	*	*				-174.4	151.4	118	-83.9	-24	0	0	0	109.7
683	W	34.2	Very low	33.8	Very low	256 Å²	256	157.9 Å²	157.9	97%	0.97	81%	0.811	S	S	*	*			trans	-150.9	106.1	174.5	-95.1	90.2	0	0	0	109.2
684	D	29	Very low	34.6	Very low	145 Å²	145	152.4 Å²	152.4	78%	0.775	80%	0.802	S	S	*	*			trans	-151.6	168	161.7	-157.1	-80.9	0	0	0	110.1
685	S	30.2	Very low	34.6	Very low	105 Å²	105	156.4 Å²	156.4	73%	0.734	81%	0.808	S	S	*	*			trans	61.3	79.2	161.6	-70.5	0	0	0	0	117.1
686	G	30.7	Very low	34.6	Very low	78 Å²	78	158.7 Å²	158.7	80%	0.804	81%	0.814	S	S	*	*			trans	-74	-167.3	170.8	0	0	0	0	0	114.9
687	R	34.1	Very low	33.4	Very low	255 Å²	255	157.7 Å²	157.7	96%	0.962	82%	0.821	S	S	*	*			trans	-130.4	144.6	173.9	-71.5	-173.9	-179.9	-106.8	-3.5	111.9
688	K	33.9	Very low	33.4	Very low	186 Å²	186	158.1 Å²	158.1	81%	0.809	82%	0.823	S	S	*	*			trans	-77.7	150.5	167.4	-56.4	173.9	-177.8	177.6	0	109.9
689	M	35.6	Very low	33.4	Very low	190 Å²	190	159.5 Å²	159.5	94%	0.936	83%	0.83	S	S	*	*			trans	-147.2	116.9	148.4	-89.6	-57	-151.5	0	0	107.9
690	D	33.5	Very low	33.4	Very low	149 Å²	149	159.6 Å²	159.6	80%	0.797	83%	0.831	S	S	*	*			trans	-83	146.8	167.8	-66.8	-80.3	0	0	0	109.5
691	G	30.7	Very low	33.4	Very low	78 Å²	78	159.7 Å²	159.7	80%	0.804	83%	0.832	S	S	*	*			trans	-150.2	114.4	-177.5	0	0	0	0	0	110.7
692	D	31.3	Very low	33.2	Very low	144 Å²	144	156 Å²	156	77%	0.77	83%	0.828	S	S	*	*			trans	-79.9	156.4	-161.7	-94.5	-74.4	0	0	0	116.8
693	R	37.7	Very low	33.9	Very low	224 Å²	224	154.3 Å²	154.3	85%	0.845	83%	0.826	S	S	*	*			trans	85.1	154.4	138.5	-87.3	174.5	-178.7	-121	-5.3	120.2
694	P	49.2	Very low	33.8	Very low	88 Å²	88	145.6 Å²	145.6	57%	0.571	82%	0.816	S	S	*	*				-139	-176.8	-109.9	44.1	-26.9	0	0	0	114.9
695	W	32.1	Very low	34	Very low	258 Å²	258	147.7 Å²	147.7	98%	0.977	82%	0.821	S	S	*	*			trans	-128.4	138	146.8	-86.5	79.4	0	0	0	110.3
696	Q	36.2	Very low	34.2	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	82%	0.819	S	S	*	*			trans	-89.1	142	178.4	-68.9	173.4	-24.8	0	0	110.2
697	G	28.8	Very low	34.4	Very low	75 Å²	75	153.1 Å²	153.1	77%	0.773	82%	0.824	S	S	*	*			trans	-162.2	29.1	-165.4	0	0	0	0	0	117.3
698	R	29.2	Very low	34.8	Very low	228 Å²	228	149.4 Å²	149.4	86%	0.86	82%	0.82	S	S	*	*			trans	73.7	88.5	167.5	-151.9	174.8	-157	-100.6	2.3	117.3
699	D	31.5	Very low	35.4	Very low	155 Å²	155	146.2 Å²	146.2	83%	0.829	82%	0.818	S	S	*	*				31.6	130.6	126.1	-31.2	-51.6	0	0	0	119.3
700	G	30.2	Very low	35.5	Very low	79 Å²	79	148.6 Å²	148.6	81%	0.814	82%	0.817	S	S	*	*			cis	150.6	93.1	0.7	0	0	0	0	0	112.4
701	G	31.5	Very low	35.5	Very low	82 Å²	82	145.5 Å²	145.5	85%	0.845	82%	0.82	S	S	*	*			trans	-134	119	171.8	0	0	0	0	0	109.4
702	I	37.8	Very low	35.5	Very low	160 Å²	160	145.3 Å²	145.3	82%	0.821	82%	0.818	S	S	*	*			trans	-114.5	176.9	-161.6	-15.3	179.6	0	0	0	110.9
703	P	44.3	Very low	35.9	Very low	117 Å²	117	147.8 Å²	147.8	76%	0.76	83%	0.827	S	S	*	*				-114.4	178.6	-105	40.8	-27.2	0	0	0	113.8
704	G	32.8	Very low	35.9	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	83%	0.828	S	S	*	*			trans	-86.2	156.1	167.9	0	0	0	0	0	113.5
705	Q	33.6	Very low	35.2	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	84%	0.835	S	S	*	*			trans	-147.1	163.5	160.5	-141.8	-166.7	54.6	0	0	111.5
706	S	33.2	Very low	35.4	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	83%	0.833	S	S	*	*			trans	50.3	107	164.1	50.1	0	0	0	0	119.1
707	H	34.9	Very low	35.3	Very low	197 Å²	197	135.7 Å²	135.7	91%	0.912	83%	0.832	S	S	*	*			trans	-77.4	124.1	164.9	-59.7	-62.6	0	0	0	111.7
708	M	43	Very low	35.8	Very low	176 Å²	176	135.8 Å²	135.8	87%	0.867	83%	0.833	S	S	*	*			trans	-132.3	133.3	153.4	-75.6	-163.7	179.5	0	0	109.8
709	P	46.7	Very low	36	Very low	119 Å²	119	135.2 Å²	135.2	77%	0.773	83%	0.832	S	S	*	*				-133.5	116.6	126	32.7	-20.6	0	0	0	108.7
710	R	36.5	Very low	36.1	Very low	241 Å²	241	136.5 Å²	136.5	91%	0.909	84%	0.836	S	S	*	*				39.9	111.2	65.3	-151.8	176.1	-165.9	-164.8	4	112.2
711	G	34	Very low	36.1	Very low	83 Å²	83	140 Å²	140	86%	0.856	84%	0.835	S	S	*	*			trans	-71	157.7	-167.1	0	0	0	0	0	115.7
712	G	32	Very low	36.4	Very low	74 Å²	74	142.4 Å²	142.4	76%	0.763	83%	0.834	S	S	*	*			trans	-143	148.8	170.5	0	0	0	0	0	110.3
713	M	38.1	Very low	36.3	Very low	196 Å²	196	138.2 Å²	138.2	97%	0.966	83%	0.83	S	S	*	*			trans	-84.1	139.7	-163.2	-55.2	103.1	78.4	0	0	115.3
714	A	37.7	Very low	35.9	Very low	105 Å²	105	139.5 Å²	139.5	87%	0.868	84%	0.836	S	S	*	*			trans	-143.8	145.7	145.3	0	0	0	0	0	108.8
715	G	34.9	Very low	36.3	Very low	69 Å²	69	141.4 Å²	141.4	71%	0.711	84%	0.838	S	S	*	*			cis	144.9	79.6	1.4	0	0	0	0	0	111.2
716	R	37	Very low	36.5	Very low	247 Å²	247	142 Å²	142	93%	0.932	84%	0.841	S	S	*	*			trans	60.3	96.4	178.8	-59	-177.2	179.4	-82.9	-0.1	116.4
717	G	34.1	Very low	36.7	Very low	83 Å²	83	142.1 Å²	142.1	86%	0.856	84%	0.841	S	S	*	*			trans	-74.7	161.1	139.7	0	0	0	0	0	110.3
718	G	37.9	Very low	36.8	Very low	78 Å²	78	141.6 Å²	141.6	80%	0.804	84%	0.844	S	S	*	*			trans	170.8	88.3	175.8	0	0	0	0	0	117
719	Y	34.9	Very low	36.4	Very low	215 Å²	215	138.6 Å²	138.6	84%	0.843	84%	0.841	S	S	*	*			trans	-152.4	117	132.5	60.6	-88.7	0	0	0	107.5
720	M	33.1	Very low	35.9	Very low	183 Å²	183	136.7 Å²	136.7	90%	0.901	84%	0.843	S	S	*	*				64.8	102.7	100.8	-63.6	175.5	179.6	0	0	113.6
721	N	30.2	Very low	35.8	Very low	151 Å²	151	130 Å²	130	81%	0.807	84%	0.839	S	S	*	*			trans	-120.4	116.3	160.5	-168.7	19.4	0	0	0	107.8
722	T	38	Very low	36	Very low	133 Å²	133	134 Å²	134	82%	0.816	84%	0.84	S	S	*	*			trans	-101.2	91.9	-177.7	49.1	0	0	0	0	110.3
723	G	36.3	Very low	36.2	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	84%	0.841	S	S	*	*			trans	-78.6	129.7	173.9	0	0	0	0	0	112.5
724	T	35.8	Very low	36	Very low	144 Å²	144	138.6 Å²	138.6	88%	0.883	84%	0.835	S	S	*	*			trans	-99.2	98.9	162.4	48.1	0	0	0	0	109.2
725	S	40.3	Very low	36	Very low	114 Å²	114	140.5 Å²	140.5	80%	0.797	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.9	123.3	174.8	52.7	0	0	0	0	111
726	Q	38.4	Very low	35.9	Very low	202 Å²	202	145 Å²	145	94%	0.944	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-94.7	129.4	155.8	-76.2	-171	-18.5	0	0	108.9
727	S	37.6	Very low	36.3	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-100.1	127.9	-175	51.2	0	0	0	0	111.3
728	L	35.3	Very low	36.4	Very low	185 Å²	185	146 Å²	146	97%	0.969	83%	0.828	S	S	*	*			trans	-122.7	94.4	162.1	-73	176.7	0	0	0	109
729	S	36.5	Very low	36.3	Very low	113 Å²	113	151.4 Å²	151.4	79%	0.79	84%	0.835	S	S	*	*			trans	-92.3	121.6	168.1	51.4	0	0	0	0	109.2
730	G	34.8	Very low	36.4	Very low	80 Å²	80	150.2 Å²	150.2	83%	0.825	84%	0.837	S	S	*	*			trans	-72	162.6	170.9	0	0	0	0	0	112.5
731	A	35.3	Very low	36.5	Very low	101 Å²	101	145.5 Å²	145.5	84%	0.835	84%	0.836	S	S	*	*			trans	-140.9	139	168	0	0	0	0	0	109.3
732	L	38.3	Very low	36.5	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	84%	0.837	S	S	*	*			trans	-84.6	143.2	-173.2	-95.3	71.9	0	0	0	113.1
733	N	36.7	Very low	36.4	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	83%	0.834	S	S	*	*			trans	25.8	120.4	131.3	-173.4	15.3	0	0	0	118
734	R	34	Very low	36.5	Very low	219 Å²	219	143.3 Å²	143.3	83%	0.826	84%	0.837	S	S	*	*			trans	-148.6	115.3	153.2	-155.8	171.3	-67.3	-113.6	2.3	113
735	Q	36.4	Very low	36.6	Very low	146 Å²	146	145.7 Å²	145.7	68%	0.682	84%	0.838	S	S	*	*			trans	64.1	97.9	139.5	-163.4	164.8	0.7	0	0	118.4
736	N	33.3	Very low	36.3	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	84%	0.842	S	S	*	*			trans	-71.7	136.8	164.8	-172.3	10.6	0	0	0	110.8
737	Q	44.8	Very low	36.2	Very low	168 Å²	168	138.3 Å²	138.3	79%	0.785	83%	0.834	S	S	*	*			trans	-145.9	143.5	169.6	-168.1	164.6	86.1	0	0	110.3
738	M	36.7	Very low	36.3	Very low	183 Å²	183	137.5 Å²	137.5	90%	0.901	83%	0.834	S	S	*	*			trans	-84.2	142.8	-161.5	-53.6	165.5	-175.5	0	0	113.5
739	M	36	Very low	36.3	Very low	192 Å²	192	137.2 Å²	137.2	95%	0.946	83%	0.825	S	S	*	*			trans	-156.9	171.5	140.4	-121.2	177.2	173	0	0	112.6
740	Q	37.5	Very low	36.5	Very low	190 Å²	190	134.9 Å²	134.9	89%	0.888	82%	0.818	S	S	*	*			trans	-106.6	158.9	-157	-62.1	168.8	-26.4	0	0	114.4
741	G	33.9	Very low	36.9	Very low	85 Å²	85	140.8 Å²	140.8	88%	0.876	82%	0.816	S	S	*	*			trans	81.8	155.9	163.9	0	0	0	0	0	114.8
742	G	31.5	Very low	37.4	Very low	80 Å²	80	146.7 Å²	146.7	83%	0.825	82%	0.816	S	S	*	*			cis	-172.6	147.4	-5.3	0	0	0	0	0	108.4
743	G	34.8	Very low	37.9	Very low	74 Å²	74	153.1 Å²	153.1	76%	0.763	83%	0.831	S	S	*	*			trans	-88.6	-165.5	-172.7	0	0	0	0	0	115.2
744	I	37.8	Very low	38	Very low	155 Å²	155	153.4 Å²	153.4	80%	0.795	83%	0.833	S	S	*	*			trans	99.8	124.8	158.9	-53.1	174.2	0	0	0	117.5
745	Q	39.2	Very low	38.2	Very low	195 Å²	195	149.9 Å²	149.9	91%	0.911	83%	0.834	S	S	*	*			trans	67.7	136.9	156.8	-78.9	170	-54.9	0	0	123.3
746	G	34.3	Very low	38.3	Very low	85 Å²	85	150.2 Å²	150.2	88%	0.876	84%	0.842	S	S	*	*			trans	121.2	127.7	147	0	0	0	0	0	116.1
747	G	35.6	Very low	38.6	Very low	75 Å²	75	149.5 Å²	149.5	77%	0.773	84%	0.841	S	S	*	*			cis	161.1	50.1	-3.6	0	0	0	0	0	118.7
748	A	39.3	Very low	38.2	Very low	87 Å²	87	148.3 Å²	148.3	72%	0.719	84%	0.844	S	S	*	*			trans	70.3	163.5	162	0	0	0	0	0	120.9
749	F	35.3	Very low	38.3	Very low	179 Å²	179	146 Å²	146	79%	0.785	84%	0.84	S	S	*	*			trans	61.8	132.6	173.7	-56.1	-75.2	0	0	0	118.3
750	G	41.2	Very low	38.5	Very low	63 Å²	63	142.7 Å²	142.7	65%	0.649	83%	0.833	S	S	*	*			cis	101.4	91.3	-7.2	0	0	0	0	0	115.7
751	R	43.4	Very low	38.5	Very low	205 Å²	205	139.1 Å²	139.1	77%	0.774	83%	0.829	S	S	*	*			trans	174.3	129.4	145.2	-107.3	169.7	-75	-131.5	0.8	113.7
752	R	45.8	Very low	38.9	Very low	224 Å²	224	143.6 Å²	143.6	85%	0.845	83%	0.825	S	S	*	*				-169.1	124.4	106.4	-110.4	176.6	-77.1	-140.4	-1.3	111.3
753	Y	48.8	Very low	39.6	Very low	301 Å²	301	149.4 Å²	149.4	100%	1.18	83%	0.825	S	S	*	*			trans	37	0	166.7	-63.9	-76.1	0	0	0	117

Retrieved 753 of 753 residues in 790.9 ms (Link to these results)

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