A0A087XKP4_POEFO Loading...

Sperm autoantigenic protein 17

AlphaFold DB , UniProt , Accession A0A087XKP4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 687 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	37.3	Very low	54.4	Low	238 Å²	238	145.5 Å²	145.5	100%	1.172	77%	0.768	S	S	*	*				0	118.3	0	-76.1	-177	176.6	0	0	106.1	V3	M1-V3 PolarHBondContact O-N 3.17Å
2	S	46	Very low	56.6	Low	124 Å²	124	141.8 Å²	141.8	87%	0.867	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-63.8	130.5	178.3	34.1	0	0	0	0	110.6
3	V	43.4	Very low	58.8	Low	122 Å²	122	137.8 Å²	137.8	74%	0.739	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-80.3	134	173.6	-175.3	0	0	0	0	107.1	M1 F5	M1-V3 PolarHBondContact O-N 3.17Å; V3-F5 PolarHBondContact O-N 2.94Å
4	P	54.7	Low	60.4	Low	108 Å²	108	135.7 Å²	135.7	70%	0.701	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-66.3	121	178.8	26.5	-33.6	0	0	0	110.1	S6	P4-S6 PolarHBondContact O-N 2.88Å
5	F	50.4	Low	62	Low	191 Å²	191	126.8 Å²	126.8	84%	0.838	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-49.9	134.7	176.3	-78.5	-96.4	0	0	0	112.1	V3	V3-F5 PolarHBondContact O-N 2.94Å
6	S	51.7	Low	63.6	Low	80 Å²	80	123.9 Å²	123.9	56%	0.559	65%	0.651	S	S	*	*			trans	45.8	142.4	163.9	67.4	0	0	0	0	119.7	P4 T8	P4-S6 PolarHBondContact O-N 2.88Å; S6-T8 PolarHBondContact O-N 2.91Å; S6-T8 PolarHBondContact O-OG1 2.88Å; S6-T8 VanDerWaalsContact OG-CG2 3.3Å; S6-T8 WeakPolarHBondContact OG-CG2 2.87Å; S6-T8 PolarHBondContact OG-OG1 3.41Å
7	N	50.3	Low	65	Low	148 Å²	148	119 Å²	119	79%	0.791	64%	0.638	S	S	*	*			trans	-80.2	46.6	172.6	-169	15.1	0	0	0	111.8	H9	N7-H9 PolarHBondContact O-N 3.31Å
8	T	58.1	Low	66.3	Low	72 Å²	72	114.7 Å²	114.7	44%	0.442	62%	0.621	S	S	.	*			trans	-65.5	113	177.9	36.8	0	0	0	0	110.1	S6 L10	S6-T8 PolarHBondContact O-N 2.91Å; S6-T8 PolarHBondContact O-OG1 2.88Å; S6-T8 VanDerWaalsContact OG-CG2 3.3Å; S6-T8 WeakPolarHBondContact OG-CG2 2.87Å; S6-T8 PolarHBondContact OG-OG1 3.41Å; T8-L10 PolarHBondContact O-N 2.97Å
9	H	57.9	Low	67.6	Low	174 Å²	174	110 Å²	110	81%	0.806	60%	0.596	S	S	*	*	S	Bend	trans	-72.3	-12.6	177.8	-104.1	59.2	0	0	0	113.5	N7	N7-H9 PolarHBondContact O-N 3.31Å
10	L	74.8	Confident	68.8	Low	160 Å²	160	108.3 Å²	108.3	84%	0.838	59%	0.586	S	S	*	*			trans	-105.6	123.9	172.5	-58.4	178.5	0	0	0	108	T8	T8-L10 PolarHBondContact O-N 2.97Å
11	R	74.1	Confident	69.8	Low	184 Å²	184	107.5 Å²	107.5	69%	0.694	58%	0.579	S	S	*	*			trans	-127.9	140.6	170.9	-71	-172.7	173.1	-148.2	-8	108.7
12	V	80.5	Confident	72.5	Confident	101 Å²	101	96.9 Å²	96.9	61%	0.612	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-54.9	133.7	174.1	179.9	0	0	0	0	109.3	R14 F16	V12-R14 PolarHBondContact O-N 3.4Å; V12-F16 HydrophobicContact CG1-CB 4.01Å; V12-F16 HydrophobicContact CG1-CD1 3.85Å; V12-F16 HydrophobicContact CG1-CG 4.41Å
13	P	85	Confident	74.8	Confident	90 Å²	90	91.9 Å²	91.9	58%	0.584	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-59.9	134.6	175.7	-24.2	34.6	0	0	0	111.4	G15 F16	P13-G15 PolarHBondContact O-N 3.35Å; P13-F16 HydrophobicContact CB-CB 4.26Å; P13-F16 WeakPolarHBondContact O-CB 3.49Å; P13-F16 PolarHBondContact O-N 3.34Å
14	R	81.4	Confident	77.3	Confident	108 Å²	108	89.6 Å²	89.6	41%	0.408	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	136.8	178.7	-71.7	175.3	159.3	-162.2	-15.7	111.6	V12 F16 A62 E65 D66	V12-R14 PolarHBondContact O-N 3.4Å; R14-F16 PolarHBondContact O-N 2.87Å; R14-A62 HydrophobicContact CB-CB 3.81Å; R14-E65 VanDerWaalsContact CA-OE2 3.23Å; R14-E65 WeakPolarHBondContact CA-OE2 3.48Å; R14-E65 WeakPolarHBondContact CB-OE2 3.5Å; R14-D66 IonicContact CZ-OD1 2.66Å; R14-D66 IonicContact NH1-OD1 3.33Å; R14-D66 PolarHBondContact NH1-OD1 2.89Å; R14-D66 IonicContact NH1-OD2 2.85Å; R14-D66 IonicContact NH2-OD1 3.16Å; R14-D66 PolarHBondContact NH2-OD1 3.47Å
15	G	84.2	Confident	79.2	Confident	2 Å²	2	91.7 Å²	91.7	2%	0.021	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	1.5	-174.6	0	0	0	0	0	115.5	P13 S58 E65	P13-G15 PolarHBondContact O-N 3.35Å; G15-S58 PolarHBondContact O-OG 3.45Å; G15-E65 PolarHBondContact N-OE2 2.91Å
16	F	87.6	Confident	81.3	Confident	80 Å²	80	84.7 Å²	84.7	35%	0.351	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-36.3	171.8	-172	-108.2	0	0	0	111.9	V12 P13 R14 A18 L19 L20	V12-F16 HydrophobicContact CG1-CB 4.01Å; V12-F16 HydrophobicContact CG1-CD1 3.85Å; V12-F16 HydrophobicContact CG1-CG 4.41Å; P13-F16 HydrophobicContact CB-CB 4.26Å; P13-F16 WeakPolarHBondContact O-CB 3.49Å; P13-F16 PolarHBondContact O-N 3.34Å; R14-F16 PolarHBondContact O-N 2.87Å; F16-A18 VanDerWaalsContact C-N 3.25Å; F16-A18 PolarHBondContact O-N 2.65Å; F16-L19 HydrophobicContact CD2-CD1 4.23Å; F16-L19 WeakPolarHBondContact O-CA 3.29Å; F16-L19 WeakPolarHBondContact O-CB 3.34Å; F16-L19 PolarHBondContact O-N 3.1Å; F16-L20 HydrophobicContact CD1-CD1 3.97Å; F16-L20 HydrophobicContact CD1-CG 4.12Å; F16-L20 HydrophobicContact CE1-CD1 3.73Å; F16-L20 HydrophobicContact CE1-CD2 3.9Å; F16-L20 HydrophobicContact CE1-CG 3.86Å; F16-L20 HydrophobicContact CZ-CD2 3.99Å; F16-L20 HydrophobicContact CZ-CG 4.36Å; F16-L20 PolarHBondContact O-N 2.86Å; F16-L20 VanDerWaalsContact O-N 3.1Å
17	G	87.8	Confident	83.5	Confident	41 Å²	41	82 Å²	82	42%	0.423	42%	0.423	S	S	.	.	H	α-helix	trans	-54.9	-40.8	174.4	0	0	0	0	0	112.7	L19 L20 E21	G17-L19 VanDerWaalsContact C-N 3.27Å; G17-L19 PolarHBondContact O-N 2.72Å; G17-L20 PolarHBondContact O-N 3Å; G17-L20 VanDerWaalsContact O-N 3.14Å; G17-E21 WeakPolarHBondContact O-CB 3.38Å; G17-E21 PolarHBondContact O-N 2.97Å
18	A	88	Confident	85.6	Confident	41 Å²	41	81.4 Å²	81.4	34%	0.339	42%	0.42	S	S	.	.	H	α-helix	trans	-69.6	-17.8	175.2	0	0	0	0	0	114.4	F16 G22 A61	F16-A18 VanDerWaalsContact C-N 3.25Å; F16-A18 PolarHBondContact O-N 2.65Å; A18-G22 PolarHBondContact O-N 3.47Å; A18-G22 VanDerWaalsContact O-N 3.16Å; A18-A61 HydrophobicContact CB-CB 3.48Å; A18-A61 VanDerWaalsContact CB-CB 3.48Å
19	L	90.8	Very high	87.4	Confident	26 Å²	26	85.2 Å²	85.2	14%	0.136	43%	0.426	C	S	.	.	H	α-helix	trans	-78.4	-39.6	167.6	-66.3	-167.3	0	0	0	111.7	F16 G17 G22 L23 F43 L46 P57 S58	F16-L19 HydrophobicContact CD2-CD1 4.23Å; F16-L19 WeakPolarHBondContact O-CA 3.29Å; F16-L19 WeakPolarHBondContact O-CB 3.34Å; F16-L19 PolarHBondContact O-N 3.1Å; G17-L19 VanDerWaalsContact C-N 3.27Å; G17-L19 PolarHBondContact O-N 2.72Å; L19-G22 CarbonylContact O-C 3.59Å; L19-G22 PolarHBondContact O-N 2.75Å; L19-L23 PolarHBondContact O-N 3.3Å; L19-F43 HydrophobicContact CB-CE1 4.18Å; L19-F43 HydrophobicContact CD1-CE1 4.4Å; L19-L46 HydrophobicContact CD2-CD1 4.03Å; L19-P57 HydrophobicContact CD2-CB 4.2Å; L19-S58 WeakPolarHBondContact CD1-OG 3.28Å; L19-S58 WeakPolarHBondContact CD2-OG 3.4Å; L19-S58 WeakPolarHBondContact CG-OG 3.43Å
20	L	92	Very high	89.2	Confident	75 Å²	75	81.3 Å²	81.3	39%	0.393	41%	0.411	S	S	.	.	H	α-helix	trans	-66.4	-45	176.5	-62.7	-179.9	0	0	0	110.7	F16 G17 G22 L23 T24 F43	F16-L20 HydrophobicContact CD1-CD1 3.97Å; F16-L20 HydrophobicContact CD1-CG 4.12Å; F16-L20 HydrophobicContact CE1-CD1 3.73Å; F16-L20 HydrophobicContact CE1-CD2 3.9Å; F16-L20 HydrophobicContact CE1-CG 3.86Å; F16-L20 HydrophobicContact CZ-CD2 3.99Å; F16-L20 HydrophobicContact CZ-CG 4.36Å; F16-L20 PolarHBondContact O-N 2.86Å; F16-L20 VanDerWaalsContact O-N 3.1Å; G17-L20 PolarHBondContact O-N 3Å; G17-L20 VanDerWaalsContact O-N 3.14Å; L20-G22 VanDerWaalsContact C-N 3.26Å; L20-G22 PolarHBondContact O-N 2.91Å; L20-L23 WeakPolarHBondContact O-CA 3.17Å; L20-L23 WeakPolarHBondContact O-CB 3.44Å; L20-L23 PolarHBondContact O-N 3.35Å; L20-T24 PolarHBondContact O-N 2.83Å; L20-T24 PolarHBondContact O-OG1 3.24Å; L20-F43 HydrophobicContact CD2-CZ 4.5Å
21	E	90.6	Very high	90.1	Very high	93 Å²	93	81.4 Å²	81.4	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-58.2	-39.9	171	-165.5	-156.7	155.4	0	0	111.3	G17 L23 T24 R25	G17-E21 WeakPolarHBondContact O-CB 3.38Å; G17-E21 PolarHBondContact O-N 2.97Å; E21-L23 VanDerWaalsContact C-N 3.32Å; E21-L23 PolarHBondContact O-N 3.43Å; E21-T24 PolarHBondContact O-OG1 3.46Å; E21-R25 VanDerWaalsContact O-CB 3.28Å; E21-R25 WeakPolarHBondContact O-CB 3.31Å; E21-R25 VanDerWaalsContact O-CD 3.25Å; E21-R25 WeakPolarHBondContact O-CD 3.48Å; E21-R25 WeakPolarHBondContact O-CG 3.38Å; E21-R25 PolarHBondContact O-N 3.38Å; E21-R25 VanDerWaalsContact O-N 3.11Å; E21-R25 IonicContact OE1-CZ 2.86Å; E21-R25 IonicContact OE1-NE 3.88Å; E21-R25 PolarHBondContact OE1-NE 3.39Å; E21-R25 IonicContact OE1-NH2 2.95Å; E21-R25 PolarHBondContact OE1-NH2 2.85Å
22	G	93.1	Very high	91.2	Very high	14 Å²	14	74.1 Å²	74.1	14%	0.144	38%	0.383	C	S	.	.	H	α-helix	trans	-65.3	-32.7	173.6	0	0	0	0	0	113.7	A18 L19 L20 E26 Y42	A18-G22 PolarHBondContact O-N 3.47Å; A18-G22 VanDerWaalsContact O-N 3.16Å; L19-G22 CarbonylContact O-C 3.59Å; L19-G22 PolarHBondContact O-N 2.75Å; L20-G22 VanDerWaalsContact C-N 3.26Å; L20-G22 PolarHBondContact O-N 2.91Å; G22-E26 WeakPolarHBondContact O-CG 3.48Å; G22-Y42 WeakPolarHBondContact CA-OH 3.38Å; G22-Y42 PolarHBondContact O-OH 2.76Å
23	L	94.6	Very high	91.7	Very high	19 Å²	19	77.8 Å²	77.8	10%	0.099	40%	0.4	C	S	.	.	H	α-helix	trans	-74.3	-51.6	176.1	171.9	63	0	0	0	110.9	L19 L20 E21 R25 E26 V27 Y38 A39 Y42 F43	L19-L23 PolarHBondContact O-N 3.3Å; L20-L23 WeakPolarHBondContact O-CA 3.17Å; L20-L23 WeakPolarHBondContact O-CB 3.44Å; L20-L23 PolarHBondContact O-N 3.35Å; E21-L23 VanDerWaalsContact C-N 3.32Å; E21-L23 PolarHBondContact O-N 3.43Å; L23-R25 VanDerWaalsContact C-N 3.31Å; L23-R25 PolarHBondContact O-N 2.98Å; L23-E26 PolarHBondContact O-N 3.18Å; L23-V27 HydrophobicContact CD1-CG2 3.84Å; L23-V27 HydrophobicContact CG-CG2 4.19Å; L23-V27 WeakPolarHBondContact O-CG2 3.45Å; L23-V27 PolarHBondContact O-N 3.49Å; L23-Y38 HydrophobicContact CD1-CD1 4.15Å; L23-Y38 HydrophobicContact CD1-CE1 4.36Å; L23-A39 HydrophobicContact CD1-CB 3.99Å; L23-A39 HydrophobicContact CD2-CB 3.68Å; L23-A39 HydrophobicContact CG-CB 4.49Å; L23-Y42 HydrophobicContact CB-CD1 3.99Å; L23-Y42 HydrophobicContact CB-CE1 3.84Å; L23-Y42 HydrophobicContact CD1-CD1 3.81Å; L23-Y42 HydrophobicContact CD1-CE1 4.46Å; L23-Y42 HydrophobicContact CD1-CG 3.85Å; L23-Y42 HydrophobicContact CG-CD1 4.44Å; L23-F43 HydrophobicContact CB-CZ 4.43Å; L23-F43 HydrophobicContact CD2-CE2 3.94Å; L23-F43 HydrophobicContact CD2-CZ 3.83Å
24	T	95.4	Very high	92.2	Very high	75 Å²	75	77.8 Å²	77.8	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-39.5	-179.1	52.9	0	0	0	0	111.6	L20 E21 E26 V27 L28	L20-T24 PolarHBondContact O-N 2.83Å; L20-T24 PolarHBondContact O-OG1 3.24Å; E21-T24 PolarHBondContact O-OG1 3.46Å; T24-E26 PolarHBondContact O-N 3.21Å; T24-V27 PolarHBondContact O-N 2.84Å; T24-L28 WeakPolarHBondContact O-CB 3.48Å; T24-L28 VanDerWaalsContact O-CG 3.28Å; T24-L28 WeakPolarHBondContact O-CG 3.06Å; T24-L28 PolarHBondContact O-N 2.91Å
25	R	94.9	Very high	92.8	Very high	151 Å²	151	77.1 Å²	77.1	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-60.6	-22.1	173.1	-74.8	168.6	176.6	-90.1	4.4	115.3	E21 L23 R29	E21-R25 VanDerWaalsContact O-CB 3.28Å; E21-R25 WeakPolarHBondContact O-CB 3.31Å; E21-R25 VanDerWaalsContact O-CD 3.25Å; E21-R25 WeakPolarHBondContact O-CD 3.48Å; E21-R25 WeakPolarHBondContact O-CG 3.38Å; E21-R25 PolarHBondContact O-N 3.38Å; E21-R25 VanDerWaalsContact O-N 3.11Å; E21-R25 IonicContact OE1-CZ 2.86Å; E21-R25 IonicContact OE1-NE 3.88Å; E21-R25 PolarHBondContact OE1-NE 3.39Å; E21-R25 IonicContact OE1-NH2 2.95Å; E21-R25 PolarHBondContact OE1-NH2 2.85Å; L23-R25 VanDerWaalsContact C-N 3.31Å; L23-R25 PolarHBondContact O-N 2.98Å; R25-R29 PolarHBondContact O-NH2 2.9Å
26	E	95.3	Very high	93.3	Very high	45 Å²	45	81.8 Å²	81.8	21%	0.21	43%	0.428	C	S	.	.	H	α-helix	trans	-98.2	-34.5	175.5	-57	-73.2	127.7	0	0	111.3	G22 L23 T24 R29 D30 Y38 Y42	G22-E26 WeakPolarHBondContact O-CG 3.48Å; L23-E26 PolarHBondContact O-N 3.18Å; T24-E26 PolarHBondContact O-N 3.21Å; E26-R29 WeakPolarHBondContact O-CB 3.38Å; E26-R29 PolarHBondContact O-N 3.34Å; E26-R29 VanDerWaalsContact O-N 3.09Å; E26-R29 IonicContact OE1-CZ 3.69Å; E26-R29 IonicContact OE1-NH1 2.69Å; E26-R29 PolarHBondContact OE1-NH1 3.3Å; E26-R29 IonicContact OE1-NH2 3.71Å; E26-R29 PolarHBondContact OE1-NH2 3.12Å; E26-R29 IonicContact OE2-CZ 3.21Å; E26-R29 IonicContact OE2-NH1 2.82Å; E26-R29 PolarHBondContact OE2-NH1 2.73Å; E26-R29 IonicContact OE2-NH2 2.72Å; E26-D30 PolarHBondContact O-N 3.32Å; E26-Y38 HydrophobicContact CB-CE1 4.27Å; E26-Y42 HydrophobicContact CB-CE2 4.43Å; E26-Y42 HydrophobicContact CG-CD2 4.46Å; E26-Y42 HydrophobicContact CG-CE2 3.87Å
27	V	96.4	Very high	93.7	Very high	22 Å²	22	80.1 Å²	80.1	13%	0.133	43%	0.429	C	S	.	.	H	α-helix	trans	-58.9	-47.9	169.9	171.2	0	0	0	0	110.9	L23 T24 R29 D30 Q31 P32 I35 Y38	L23-V27 HydrophobicContact CD1-CG2 3.84Å; L23-V27 HydrophobicContact CG-CG2 4.19Å; L23-V27 WeakPolarHBondContact O-CG2 3.45Å; L23-V27 PolarHBondContact O-N 3.49Å; T24-V27 PolarHBondContact O-N 2.84Å; V27-R29 PolarHBondContact O-N 3.35Å; V27-D30 PolarHBondContact O-N 3.13Å; V27-Q31 WeakPolarHBondContact O-CA 3.42Å; V27-Q31 PolarHBondContact O-N 3.46Å; V27-P32 HydrophobicContact CG1-CG 4.39Å; V27-P32 WeakPolarHBondContact O-CD 3.19Å; V27-I35 HydrophobicContact CG1-CD1 4.19Å; V27-I35 HydrophobicContact CG1-CG1 4.16Å; V27-I35 HydrophobicContact CG1-CG2 4.45Å; V27-I35 HydrophobicContact CG2-CG2 4.27Å; V27-Y38 HydrophobicContact CG2-CD1 3.77Å; V27-Y38 HydrophobicContact CG2-CE1 3.97Å
28	L	95.6	Very high	94.1	Very high	137 Å²	137	80.3 Å²	80.3	72%	0.717	42%	0.418	S	S	*	.	H	α-helix	trans	-64.6	-17	175.4	-69.9	170.2	0	0	0	113.6	T24	T24-L28 WeakPolarHBondContact O-CB 3.48Å; T24-L28 VanDerWaalsContact O-CG 3.28Å; T24-L28 WeakPolarHBondContact O-CG 3.06Å; T24-L28 PolarHBondContact O-N 2.91Å
29	R	96.3	Very high	94.5	Very high	152 Å²	152	79.1 Å²	79.1	57%	0.574	41%	0.408	S	S	*	.	H	α-helix	trans	-91.1	-47.2	176.5	-175	-173	-54.9	136.4	21.7	112.5	R25 E26 V27	R25-R29 PolarHBondContact O-NH2 2.9Å; E26-R29 WeakPolarHBondContact O-CB 3.38Å; E26-R29 PolarHBondContact O-N 3.34Å; E26-R29 VanDerWaalsContact O-N 3.09Å; E26-R29 IonicContact OE1-CZ 3.69Å; E26-R29 IonicContact OE1-NH1 2.69Å; E26-R29 PolarHBondContact OE1-NH1 3.3Å; E26-R29 IonicContact OE1-NH2 3.71Å; E26-R29 PolarHBondContact OE1-NH2 3.12Å; E26-R29 IonicContact OE2-CZ 3.21Å; E26-R29 IonicContact OE2-NH1 2.82Å; E26-R29 PolarHBondContact OE2-NH1 2.73Å; E26-R29 IonicContact OE2-NH2 2.72Å; V27-R29 PolarHBondContact O-N 3.35Å
30	D	94.6	Very high	94.7	Very high	92 Å²	92	80.5 Å²	80.5	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-92.5	-13.9	-170.8	-71.5	-3.7	0	0	0	112.5	E26 V27 Y38	E26-D30 PolarHBondContact O-N 3.32Å; V27-D30 PolarHBondContact O-N 3.13Å; D30-Y38 HydrophobicContact CB-CE2 4.07Å; D30-Y38 PolarHBondContact OD2-OH 3.32Å
31	Q	95	Very high	94.9	Very high	162 Å²	162	83.1 Å²	83.1	76%	0.757	43%	0.433	S	S	*	.			trans	41	62.1	-178.9	-67.9	-174.9	-23.5	0	0	113.7	V27	V27-Q31 WeakPolarHBondContact O-CA 3.42Å; V27-Q31 PolarHBondContact O-N 3.46Å
32	P	95.4	Very high	95.1	Very high	30 Å²	30	80.1 Å²	80.1	20%	0.195	42%	0.418	C	S	.	.			trans	-77	133.3	-174.4	31.7	-35.4	0	0	0	113	V27 N34 Y38	V27-P32 HydrophobicContact CG1-CG 4.39Å; V27-P32 WeakPolarHBondContact O-CD 3.19Å; P32-N34 PolarHBondContact O-N 3.16Å; P32-Y38 HydrophobicContact CB-CD2 3.69Å; P32-Y38 HydrophobicContact CB-CE2 4.41Å; P32-Y38 HydrophobicContact CB-CG 3.91Å; P32-Y38 HydrophobicContact CG-CD1 4.08Å; P32-Y38 HydrophobicContact CG-CD2 3.8Å; P32-Y38 HydrophobicContact CG-CE2 4.38Å; P32-Y38 HydrophobicContact CG-CG 3.63Å
33	D	92.2	Very high	95.2	Very high	179 Å²	179	82.2 Å²	82.2	96%	0.957	42%	0.423	S	S	*	.	S	Bend	trans	-58.3	-11	177.4	-48.8	-68.2	0	0	0	115
34	N	95.3	Very high	95.2	Very high	90 Å²	90	86.6 Å²	86.6	48%	0.481	45%	0.447	S	S	.	.			trans	-145.2	95.2	177.5	-168.4	-83.3	0	0	0	110.6	P32 A37 Y38	P32-N34 PolarHBondContact O-N 3.16Å; N34-A37 HydrophobicContact CB-CB 4.36Å; N34-A37 PolarHBondContact O-N 3.11Å; N34-A37 WeakPolarHBondContact OD1-CB 3.21Å; N34-A37 PolarHBondContact OD1-N 2.95Å; N34-Y38 WeakPolarHBondContact O-CB 3.48Å; N34-Y38 PolarHBondContact O-N 2.96Å
35	I	93.7	Very high	95.1	Very high	94 Å²	94	88.1 Å²	88.1	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-60.4	-43.5	-177.3	-57.7	173.9	0	0	0	112.1	V27 A37 Y38 A39	V27-I35 HydrophobicContact CG1-CD1 4.19Å; V27-I35 HydrophobicContact CG1-CG1 4.16Å; V27-I35 HydrophobicContact CG1-CG2 4.45Å; V27-I35 HydrophobicContact CG2-CG2 4.27Å; I35-A37 PolarHBondContact O-N 3.28Å; I35-Y38 PolarHBondContact O-N 3.15Å; I35-A39 WeakPolarHBondContact O-CB 3.27Å; I35-A39 PolarHBondContact O-N 3.48Å
36	P	95.6	Very high	94.9	Very high	100 Å²	100	82.1 Å²	82.1	65%	0.649	43%	0.426	S	S	*	.	H	α-helix	trans	-61	-43.6	178.8	-26.1	36.2	0	0	0	114	A39 A40	P36-A39 PolarHBondContact O-N 2.83Å; P36-A40 PolarHBondContact O-N 3.41Å
37	A	95.4	Very high	94.7	Very high	45 Å²	45	84.5 Å²	84.5	37%	0.372	44%	0.44	S	S	.	.	H	α-helix	trans	-71.8	-29.7	177.7	0	0	0	0	0	112.8	N34 I35 Q41	N34-A37 HydrophobicContact CB-CB 4.36Å; N34-A37 PolarHBondContact O-N 3.11Å; N34-A37 WeakPolarHBondContact OD1-CB 3.21Å; N34-A37 PolarHBondContact OD1-N 2.95Å; I35-A37 PolarHBondContact O-N 3.28Å; A37-Q41 WeakPolarHBondContact O-CG 3.42Å; A37-Q41 PolarHBondContact O-N 3.33Å; A37-Q41 PolarHBondContact O-NE2 3.35Å
38	Y	96.4	Very high	94.6	Very high	45 Å²	45	89.1 Å²	89.1	18%	0.176	46%	0.458	C	S	.	.	H	α-helix	trans	-69.5	-45.5	171.3	-174.4	-89.7	0	0	0	111.2	L23 E26 V27 D30 P32 N34 I35 A40 Q41 Y42	L23-Y38 HydrophobicContact CD1-CD1 4.15Å; L23-Y38 HydrophobicContact CD1-CE1 4.36Å; E26-Y38 HydrophobicContact CB-CE1 4.27Å; V27-Y38 HydrophobicContact CG2-CD1 3.77Å; V27-Y38 HydrophobicContact CG2-CE1 3.97Å; D30-Y38 HydrophobicContact CB-CE2 4.07Å; D30-Y38 PolarHBondContact OD2-OH 3.32Å; P32-Y38 HydrophobicContact CB-CD2 3.69Å; P32-Y38 HydrophobicContact CB-CE2 4.41Å; P32-Y38 HydrophobicContact CB-CG 3.91Å; P32-Y38 HydrophobicContact CG-CD1 4.08Å; P32-Y38 HydrophobicContact CG-CD2 3.8Å; P32-Y38 HydrophobicContact CG-CE2 4.38Å; P32-Y38 HydrophobicContact CG-CG 3.63Å; N34-Y38 WeakPolarHBondContact O-CB 3.48Å; N34-Y38 PolarHBondContact O-N 2.96Å; I35-Y38 PolarHBondContact O-N 3.15Å; Y38-A40 VanDerWaalsContact C-N 3.35Å; Y38-A40 PolarHBondContact O-N 3.03Å; Y38-Q41 PolarHBondContact O-N 2.89Å; Y38-Q41 VanDerWaalsContact O-N 3.15Å; Y38-Y42 WeakPolarHBondContact O-CB 3.47Å; Y38-Y42 PolarHBondContact O-N 2.96Å
39	A	95.6	Very high	94.3	Very high	15 Å²	15	87.2 Å²	87.2	12%	0.124	45%	0.446	C	S	.	.	H	α-helix	trans	-59.1	-42.9	177	0	0	0	0	0	112.2	L23 I35 P36 Q41 Y42 F43	L23-A39 HydrophobicContact CD1-CB 3.99Å; L23-A39 HydrophobicContact CD2-CB 3.68Å; L23-A39 HydrophobicContact CG-CB 4.49Å; I35-A39 WeakPolarHBondContact O-CB 3.27Å; I35-A39 PolarHBondContact O-N 3.48Å; P36-A39 PolarHBondContact O-N 2.83Å; A39-Q41 PolarHBondContact O-N 3.16Å; A39-Y42 WeakPolarHBondContact O-CB 3.49Å; A39-Y42 PolarHBondContact O-N 3.43Å; A39-F43 HydrophobicContact CB-CE2 4.31Å; A39-F43 WeakPolarHBondContact O-CD2 3.46Å; A39-F43 PolarHBondContact O-N 3.13Å
40	A	96.2	Very high	94	Very high	55 Å²	55	84.8 Å²	84.8	46%	0.455	44%	0.436	S	S	.	.	H	α-helix	trans	-57.8	-47.9	173.4	0	0	0	0	0	112	P36 Y38 Y42 F43 D44	P36-A40 PolarHBondContact O-N 3.41Å; Y38-A40 VanDerWaalsContact C-N 3.35Å; Y38-A40 PolarHBondContact O-N 3.03Å; A40-Y42 VanDerWaalsContact C-N 3.35Å; A40-Y42 PolarHBondContact O-N 2.94Å; A40-F43 PolarHBondContact O-N 3.01Å; A40-D44 WeakPolarHBondContact O-CB 3.16Å; A40-D44 PolarHBondContact O-N 2.97Å
41	Q	96.1	Very high	93.9	Very high	130 Å²	130	88.6 Å²	88.6	61%	0.607	45%	0.451	S	S	*	.	H	α-helix	trans	-65.8	-35.2	177.5	-72.6	172.5	79.8	0	0	112.9	A37 Y38 A39 K45	A37-Q41 WeakPolarHBondContact O-CG 3.42Å; A37-Q41 PolarHBondContact O-N 3.33Å; A37-Q41 PolarHBondContact O-NE2 3.35Å; Y38-Q41 PolarHBondContact O-N 2.89Å; Y38-Q41 VanDerWaalsContact O-N 3.15Å; A39-Q41 PolarHBondContact O-N 3.16Å; Q41-K45 VanDerWaalsContact O-CB 3.31Å; Q41-K45 WeakPolarHBondContact O-CB 3.39Å; Q41-K45 PolarHBondContact O-N 3.27Å
42	Y	94.8	Very high	93.7	Very high	31 Å²	31	87.9 Å²	87.9	12%	0.122	45%	0.448	C	S	.	.	H	α-helix	trans	-64	-47.4	174.8	177.5	-96.8	0	0	0	111.4	G22 L23 E26 Y38 A39 A40 K45 L46	G22-Y42 WeakPolarHBondContact CA-OH 3.38Å; G22-Y42 PolarHBondContact O-OH 2.76Å; L23-Y42 HydrophobicContact CB-CD1 3.99Å; L23-Y42 HydrophobicContact CB-CE1 3.84Å; L23-Y42 HydrophobicContact CD1-CD1 3.81Å; L23-Y42 HydrophobicContact CD1-CE1 4.46Å; L23-Y42 HydrophobicContact CD1-CG 3.85Å; L23-Y42 HydrophobicContact CG-CD1 4.44Å; E26-Y42 HydrophobicContact CB-CE2 4.43Å; E26-Y42 HydrophobicContact CG-CD2 4.46Å; E26-Y42 HydrophobicContact CG-CE2 3.87Å; Y38-Y42 WeakPolarHBondContact O-CB 3.47Å; Y38-Y42 PolarHBondContact O-N 2.96Å; A39-Y42 WeakPolarHBondContact O-CB 3.49Å; A39-Y42 PolarHBondContact O-N 3.43Å; A40-Y42 VanDerWaalsContact C-N 3.35Å; A40-Y42 PolarHBondContact O-N 2.94Å; Y42-K45 WeakPolarHBondContact O-CB 3.15Å; Y42-K45 PolarHBondContact O-N 3.14Å; Y42-L46 HydrophobicContact CD1-CD1 4Å; Y42-L46 HydrophobicContact CE1-CD1 3.37Å; Y42-L46 HydrophobicContact CE1-CG 4.22Å; Y42-L46 WeakPolarHBondContact O-CG 3.07Å; Y42-L46 PolarHBondContact O-N 3.43Å
43	F	94	Very high	93.4	Very high	58 Å²	58	90.2 Å²	90.2	25%	0.254	47%	0.465	S	S	.	.	H	α-helix	trans	-70.1	-37.3	177.1	-64.9	-52.1	0	0	0	112.8	L19 L20 L23 A39 A40 K45 L46 L47	L19-F43 HydrophobicContact CB-CE1 4.18Å; L19-F43 HydrophobicContact CD1-CE1 4.4Å; L20-F43 HydrophobicContact CD2-CZ 4.5Å; L23-F43 HydrophobicContact CB-CZ 4.43Å; L23-F43 HydrophobicContact CD2-CE2 3.94Å; L23-F43 HydrophobicContact CD2-CZ 3.83Å; A39-F43 HydrophobicContact CB-CE2 4.31Å; A39-F43 WeakPolarHBondContact O-CD2 3.46Å; A39-F43 PolarHBondContact O-N 3.13Å; A40-F43 PolarHBondContact O-N 3.01Å; F43-K45 VanDerWaalsContact C-N 3.31Å; F43-K45 PolarHBondContact O-N 2.9Å; F43-L46 HydrophobicContact CD1-CD1 4.29Å; F43-L46 PolarHBondContact O-N 2.75Å; F43-L47 WeakPolarHBondContact O-CB 3.44Å; F43-L47 VanDerWaalsContact O-CG 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.07Å; F43-L47 PolarHBondContact O-N 2.87Å
44	D	94.8	Very high	93	Very high	111 Å²	111	85.1 Å²	85.1	59%	0.594	46%	0.455	S	S	*	.	H	α-helix	trans	-59.3	-41.6	171.3	-88	-13.5	0	0	0	111.9	A40 K48	A40-D44 WeakPolarHBondContact O-CB 3.16Å; A40-D44 PolarHBondContact O-N 2.97Å; D44-K48 WeakPolarHBondContact O-CB 3.36Å; D44-K48 PolarHBondContact O-N 3.28Å
45	K	93.4	Very high	92.3	Very high	106 Å²	106	83.8 Å²	83.8	46%	0.461	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-47.9	173.7	174.7	-170.1	167.5	-163.4	0	111.3	Q41 Y42 F43 K48 E49	Q41-K45 VanDerWaalsContact O-CB 3.31Å; Q41-K45 WeakPolarHBondContact O-CB 3.39Å; Q41-K45 PolarHBondContact O-N 3.27Å; Y42-K45 WeakPolarHBondContact O-CB 3.15Å; Y42-K45 PolarHBondContact O-N 3.14Å; F43-K45 VanDerWaalsContact C-N 3.31Å; F43-K45 PolarHBondContact O-N 2.9Å; K45-K48 PolarHBondContact O-N 2.77Å; K45-E49 WeakPolarHBondContact CE-OE1 3.47Å; K45-E49 WeakPolarHBondContact CG-OE1 3.33Å; K45-E49 WeakPolarHBondContact O-CG 3.5Å; K45-E49 PolarHBondContact O-N 2.71Å
46	L	90.9	Very high	91.8	Very high	26 Å²	26	80.5 Å²	80.5	14%	0.136	44%	0.439	C	S	.	.	H	α-helix	trans	-64.7	-39.5	178.1	-72	-178.7	0	0	0	112.9	L19 Y42 F43 K48 E49 R50	L19-L46 HydrophobicContact CD2-CD1 4.03Å; Y42-L46 HydrophobicContact CD1-CD1 4Å; Y42-L46 HydrophobicContact CE1-CD1 3.37Å; Y42-L46 HydrophobicContact CE1-CG 4.22Å; Y42-L46 WeakPolarHBondContact O-CG 3.07Å; Y42-L46 PolarHBondContact O-N 3.43Å; F43-L46 HydrophobicContact CD1-CD1 4.29Å; F43-L46 PolarHBondContact O-N 2.75Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-E49 PolarHBondContact O-N 2.74Å; L46-R50 WeakPolarHBondContact O-CB 3.33Å; L46-R50 PolarHBondContact O-N 3.06Å
47	L	91.8	Very high	91	Very high	95 Å²	95	78.6 Å²	78.6	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-42.6	174.3	-74.4	171	0	0	0	111.1	F43 R50 E51	F43-L47 WeakPolarHBondContact O-CB 3.44Å; F43-L47 VanDerWaalsContact O-CG 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.07Å; F43-L47 PolarHBondContact O-N 2.87Å; L47-R50 WeakPolarHBondContact O-CB 3.39Å; L47-R50 PolarHBondContact O-N 3.37Å; L47-E51 WeakPolarHBondContact O-CG 3.47Å; L47-E51 PolarHBondContact O-N 3.29Å
48	K	93.2	Very high	90.4	Very high	119 Å²	119	77.4 Å²	77.4	52%	0.517	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-43.2	174.5	-177.5	-177.4	169.9	-170.6	0	112.5	D44 K45 L46 R50 E51 E52	D44-K48 WeakPolarHBondContact O-CB 3.36Å; D44-K48 PolarHBondContact O-N 3.28Å; K45-K48 PolarHBondContact O-N 2.77Å; L46-K48 VanDerWaalsContact C-N 3.34Å; K48-R50 VanDerWaalsContact C-N 3.26Å; K48-R50 PolarHBondContact O-N 2.99Å; K48-E51 PolarHBondContact O-N 2.92Å; K48-E52 WeakPolarHBondContact CE-OE1 3.38Å; K48-E52 HydrophobicContact CG-CG 4.45Å; K48-E52 IonicContact NZ-OE1 3.77Å; K48-E52 WeakPolarHBondContact O-CB 3.43Å; K48-E52 WeakPolarHBondContact O-CG 3.46Å; K48-E52 PolarHBondContact O-N 3.05Å
49	E	89.7	Confident	89.7	Confident	97 Å²	97	80.1 Å²	80.1	45%	0.453	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-34.3	175.5	-75	178.9	-160.8	0	0	111.5	K45 L46 S53	K45-E49 WeakPolarHBondContact CE-OE1 3.47Å; K45-E49 WeakPolarHBondContact CG-OE1 3.33Å; K45-E49 WeakPolarHBondContact O-CG 3.5Å; K45-E49 PolarHBondContact O-N 2.71Å; L46-E49 PolarHBondContact O-N 2.74Å; E49-S53 WeakPolarHBondContact O-CB 3.23Å; E49-S53 PolarHBondContact O-N 3.45Å; E49-S53 PolarHBondContact O-OG 3.44Å
50	R	89.8	Confident	89	Confident	101 Å²	101	87.9 Å²	87.9	38%	0.381	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-45.4	169.7	-180	-165.7	-171.9	126.1	20.6	112.3	L46 L47 K48 G54 A55 D56 E59	L46-R50 WeakPolarHBondContact O-CB 3.33Å; L46-R50 PolarHBondContact O-N 3.06Å; L47-R50 WeakPolarHBondContact O-CB 3.39Å; L47-R50 PolarHBondContact O-N 3.37Å; K48-R50 VanDerWaalsContact C-N 3.26Å; K48-R50 PolarHBondContact O-N 2.99Å; R50-G54 VanDerWaalsContact O-CA 3.29Å; R50-G54 WeakPolarHBondContact O-CA 3.46Å; R50-G54 PolarHBondContact O-N 3.26Å; R50-A55 WeakPolarHBondContact CA-O 3.47Å; R50-D56 HydrophobicContact CG-CB 4.22Å; R50-D56 IonicContact CZ-OD2 3Å; R50-D56 IonicContact NH1-OD1 3.68Å; R50-D56 IonicContact NH1-OD2 2.72Å; R50-D56 PolarHBondContact NH1-OD2 3.05Å; R50-D56 IonicContact NH2-OD2 2.68Å; R50-D56 PolarHBondContact NH2-OD2 2.77Å; R50-E59 IonicContact NH2-OE1 2.75Å
51	E	91.9	Very high	88.2	Confident	171 Å²	171	85.9 Å²	85.9	80%	0.799	44%	0.44	S	S	*	.	H	α-helix	trans	-64.7	-39.2	177.1	-74.4	-170.5	169	0	0	112.7	L47 K48	L47-E51 WeakPolarHBondContact O-CG 3.47Å; L47-E51 PolarHBondContact O-N 3.29Å; K48-E51 PolarHBondContact O-N 2.92Å
52	E	92.3	Very high	87.6	Confident	148 Å²	148	80.7 Å²	80.7	69%	0.692	42%	0.419	S	S	*	.	H	α-helix	trans	-79.5	-35.1	-178.7	-70.6	-174.2	-176.3	0	0	113.3	K48	K48-E52 WeakPolarHBondContact CE-OE1 3.38Å; K48-E52 HydrophobicContact CG-CG 4.45Å; K48-E52 IonicContact NZ-OE1 3.77Å; K48-E52 WeakPolarHBondContact O-CB 3.43Å; K48-E52 WeakPolarHBondContact O-CG 3.46Å; K48-E52 PolarHBondContact O-N 3.05Å
53	S	87.8	Confident	86.9	Confident	79 Å²	79	85.1 Å²	85.1	55%	0.552	44%	0.439	S	S	*	.	H	α-helix	trans	-96.1	-25.3	-177.4	72.5	0	0	0	0	114.8	E49 A55	E49-S53 WeakPolarHBondContact O-CB 3.23Å; E49-S53 PolarHBondContact O-N 3.45Å; E49-S53 PolarHBondContact O-OG 3.44Å; S53-A55 PolarHBondContact O-N 2.66Å; S53-A55 PolarHBondContact OG-N 3.44Å; S53-A55 VanDerWaalsContact OG-N 3.1Å; S53-A55 PolarHBondContact OG-O 2.82Å
54	G	84.6	Confident	85.9	Confident	72 Å²	72	85.1 Å²	85.1	74%	0.742	44%	0.442	S	S	*	.	S	Bend	trans	71.4	8	-169.4	0	0	0	0	0	114.7	R50	R50-G54 VanDerWaalsContact O-CA 3.29Å; R50-G54 WeakPolarHBondContact O-CA 3.46Å; R50-G54 PolarHBondContact O-N 3.26Å
55	A	79.9	Confident	84.7	Confident	61 Å²	61	82.7 Å²	82.7	50%	0.504	43%	0.426	S	S	.	.			trans	-107.9	134.3	175.5	0	0	0	0	0	110.5	R50 S53	R50-A55 WeakPolarHBondContact CA-O 3.47Å; S53-A55 PolarHBondContact O-N 2.66Å; S53-A55 PolarHBondContact OG-N 3.44Å; S53-A55 VanDerWaalsContact OG-N 3.1Å; S53-A55 PolarHBondContact OG-O 2.82Å
56	D	82.7	Confident	83.3	Confident	25 Å²	25	79.9 Å²	79.9	13%	0.134	42%	0.416	C	S	.	.			trans	-108.5	118.9	176.3	170.7	10.2	0	0	0	109.6	R50 S58 E59 W60	R50-D56 HydrophobicContact CG-CB 4.22Å; R50-D56 IonicContact CZ-OD2 3Å; R50-D56 IonicContact NH1-OD1 3.68Å; R50-D56 IonicContact NH1-OD2 2.72Å; R50-D56 PolarHBondContact NH1-OD2 3.05Å; R50-D56 IonicContact NH2-OD2 2.68Å; R50-D56 PolarHBondContact NH2-OD2 2.77Å; D56-S58 VanDerWaalsContact C-N 3.3Å; D56-S58 PolarHBondContact O-N 2.78Å; D56-S58 WeakPolarHBondContact OD1-CB 3.47Å; D56-S58 PolarHBondContact OD1-N 3.09Å; D56-E59 HydrophobicContact CB-CB 3.86Å; D56-E59 HydrophobicContact CB-CG 4.2Å; D56-E59 WeakPolarHBondContact O-CB 3.09Å; D56-E59 PolarHBondContact O-N 2.88Å; D56-W60 PolarHBondContact O-N 3.3Å
57	P	78.9	Confident	81.8	Confident	61 Å²	61	86.5 Å²	86.5	40%	0.396	44%	0.44	S	S	.	.	H	α-helix	trans	-56.4	-38.7	175.8	-26.2	35.6	0	0	0	113.7	L19 E59 W60 A61	L19-P57 HydrophobicContact CD2-CB 4.2Å; P57-E59 VanDerWaalsContact C-N 3.35Å; P57-E59 PolarHBondContact O-N 2.87Å; P57-W60 PolarHBondContact O-N 2.88Å; P57-W60 VanDerWaalsContact O-N 3.12Å; P57-A61 PolarHBondContact O-N 2.68Å
58	S	83.2	Confident	80	Confident	20 Å²	20	90.1 Å²	90.1	14%	0.14	45%	0.452	C	S	.	.	H	α-helix	trans	-63.9	-42	176.8	-63	0	0	0	0	111.6	G15 L19 D56 W60 A61 A62	G15-S58 PolarHBondContact O-OG 3.45Å; L19-S58 WeakPolarHBondContact CD1-OG 3.28Å; L19-S58 WeakPolarHBondContact CD2-OG 3.4Å; L19-S58 WeakPolarHBondContact CG-OG 3.43Å; D56-S58 VanDerWaalsContact C-N 3.3Å; D56-S58 PolarHBondContact O-N 2.78Å; D56-S58 WeakPolarHBondContact OD1-CB 3.47Å; D56-S58 PolarHBondContact OD1-N 3.09Å; S58-W60 PolarHBondContact O-N 3.5Å; S58-A61 PolarHBondContact O-N 3.2Å; S58-A62 WeakPolarHBondContact O-CB 3.32Å; S58-A62 PolarHBondContact O-N 3Å
59	E	82.2	Confident	78.3	Confident	101 Å²	101	92.3 Å²	92.3	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-63.2	-27.6	175.1	-97.4	-156.8	-123.1	0	0	113	R50 D56 P57 K63	R50-E59 IonicContact NH2-OE1 2.75Å; D56-E59 HydrophobicContact CB-CB 3.86Å; D56-E59 HydrophobicContact CB-CG 4.2Å; D56-E59 WeakPolarHBondContact O-CB 3.09Å; D56-E59 PolarHBondContact O-N 2.88Å; P57-E59 VanDerWaalsContact C-N 3.35Å; P57-E59 PolarHBondContact O-N 2.87Å; E59-K63 VanDerWaalsContact O-CD 3.27Å; E59-K63 WeakPolarHBondContact O-CD 3.33Å; E59-K63 WeakPolarHBondContact O-CE 3.41Å; E59-K63 WeakPolarHBondContact O-CG 3.43Å; E59-K63 PolarHBondContact O-NZ 3.35Å; E59-K63 IonicContact OE2-NZ 2.78Å; E59-K63 PolarHBondContact OE2-NZ 3.04Å
60	W	80.3	Confident	76.6	Confident	179 Å²	179	90.5 Å²	90.5	68%	0.678	45%	0.451	S	S	*	.	H	α-helix	trans	-79.1	-47.5	174.3	-178.9	80.8	0	0	0	111.1	D56 P57 S58 A62 K63 L64	D56-W60 PolarHBondContact O-N 3.3Å; P57-W60 PolarHBondContact O-N 2.88Å; P57-W60 VanDerWaalsContact O-N 3.12Å; S58-W60 PolarHBondContact O-N 3.5Å; W60-A62 PolarHBondContact O-N 3.11Å; W60-K63 WeakPolarHBondContact O-CB 3.49Å; W60-K63 PolarHBondContact O-N 3.26Å; W60-K63 VanDerWaalsContact O-N 3.13Å; W60-L64 HydrophobicContact CD2-CD1 4.21Å; W60-L64 HydrophobicContact CE3-CD1 3.96Å; W60-L64 HydrophobicContact CH2-CD1 3.61Å; W60-L64 HydrophobicContact CZ2-CD1 3.86Å; W60-L64 HydrophobicContact CZ3-CD1 3.66Å; W60-L64 PolarHBondContact O-N 2.85Å
61	A	81.1	Confident	74.7	Confident	13 Å²	13	91 Å²	91	11%	0.107	46%	0.461	C	S	.	.	H	α-helix	trans	-58.1	-46.6	176.3	0	0	0	0	0	112.4	A18 P57 S58 K63 L64 E65	A18-A61 HydrophobicContact CB-CB 3.48Å; A18-A61 VanDerWaalsContact CB-CB 3.48Å; P57-A61 PolarHBondContact O-N 2.68Å; S58-A61 PolarHBondContact O-N 3.2Å; A61-K63 PolarHBondContact O-N 3.38Å; A61-K63 VanDerWaalsContact O-N 3.16Å; A61-L64 WeakPolarHBondContact O-CA 3.1Å; A61-L64 WeakPolarHBondContact O-CB 3.25Å; A61-L64 PolarHBondContact O-N 3.1Å; A61-E65 WeakPolarHBondContact O-CB 3.37Å; A61-E65 PolarHBondContact O-N 2.66Å
62	A	83.4	Confident	72.6	Confident	21 Å²	21	88.1 Å²	88.1	17%	0.174	45%	0.448	C	S	.	.	H	α-helix	trans	-57.8	-30.7	176.9	0	0	0	0	0	113.3	R14 S58 W60 D66	R14-A62 HydrophobicContact CB-CB 3.81Å; S58-A62 WeakPolarHBondContact O-CB 3.32Å; S58-A62 PolarHBondContact O-N 3Å; W60-A62 PolarHBondContact O-N 3.11Å; A62-D66 WeakPolarHBondContact O-CB 3.28Å; A62-D66 PolarHBondContact O-N 2.85Å; A62-D66 VanDerWaalsContact O-N 3.13Å
63	K	79.9	Confident	70.4	Confident	124 Å²	124	84.4 Å²	84.4	54%	0.539	44%	0.443	S	S	.	.	H	α-helix	trans	-77.2	-21	175.8	-68.6	171.6	-172.6	90.4	0	112.7	E59 W60 A61	E59-K63 VanDerWaalsContact O-CD 3.27Å; E59-K63 WeakPolarHBondContact O-CD 3.33Å; E59-K63 WeakPolarHBondContact O-CE 3.41Å; E59-K63 WeakPolarHBondContact O-CG 3.43Å; E59-K63 PolarHBondContact O-NZ 3.35Å; E59-K63 IonicContact OE2-NZ 2.78Å; E59-K63 PolarHBondContact OE2-NZ 3.04Å; W60-K63 WeakPolarHBondContact O-CB 3.49Å; W60-K63 PolarHBondContact O-N 3.26Å; W60-K63 VanDerWaalsContact O-N 3.13Å; A61-K63 PolarHBondContact O-N 3.38Å; A61-K63 VanDerWaalsContact O-N 3.16Å
64	L	71.3	Confident	68.5	Low	58 Å²	58	89.2 Å²	89.2	30%	0.304	45%	0.454	S	S	.	.	H	α-helix	trans	-81.9	-43.7	171.5	-60.8	176.9	0	0	0	111.2	W60 A61 R67	W60-L64 HydrophobicContact CD2-CD1 4.21Å; W60-L64 HydrophobicContact CE3-CD1 3.96Å; W60-L64 HydrophobicContact CH2-CD1 3.61Å; W60-L64 HydrophobicContact CZ2-CD1 3.86Å; W60-L64 HydrophobicContact CZ3-CD1 3.66Å; W60-L64 PolarHBondContact O-N 2.85Å; A61-L64 WeakPolarHBondContact O-CA 3.1Å; A61-L64 WeakPolarHBondContact O-CB 3.25Å; A61-L64 PolarHBondContact O-N 3.1Å; L64-R67 WeakPolarHBondContact O-CB 3.41Å; L64-R67 WeakPolarHBondContact O-CG 3.48Å; L64-R67 PolarHBondContact O-N 3.14Å; L64-R67 PolarHBondContact O-NE 3.29Å; L64-R67 VanDerWaalsContact O-NE 3.14Å
65	E	71.4	Confident	66.6	Low	59 Å²	59	92.4 Å²	92.4	28%	0.276	45%	0.447	S	S	.	.	H	α-helix	trans	-61.5	-41.2	179.5	-171.6	-169.5	163	0	0	112.5	R14 G15 A61 R67 F68 Y69	R14-E65 VanDerWaalsContact CA-OE2 3.23Å; R14-E65 WeakPolarHBondContact CA-OE2 3.48Å; R14-E65 WeakPolarHBondContact CB-OE2 3.5Å; G15-E65 PolarHBondContact N-OE2 2.91Å; A61-E65 WeakPolarHBondContact O-CB 3.37Å; A61-E65 PolarHBondContact O-N 2.66Å; E65-R67 PolarHBondContact O-N 3.19Å; E65-F68 PolarHBondContact O-N 3.35Å; E65-Y69 HydrophobicContact CG-CD2 3.97Å; E65-Y69 HydrophobicContact CG-CE2 3.9Å; E65-Y69 PolarHBondContact O-N 3.22Å
66	D	62.8	Low	65.1	Low	47 Å²	47	93.9 Å²	93.9	25%	0.251	45%	0.454	S	S	.	.	H	α-helix	trans	-62.6	-17.6	178.9	-159.7	28.8	0	0	0	113.5	R14 A62 F68 N70	R14-D66 IonicContact CZ-OD1 2.66Å; R14-D66 IonicContact NH1-OD1 3.33Å; R14-D66 PolarHBondContact NH1-OD1 2.89Å; R14-D66 IonicContact NH1-OD2 2.85Å; R14-D66 IonicContact NH2-OD1 3.16Å; R14-D66 PolarHBondContact NH2-OD1 3.47Å; A62-D66 WeakPolarHBondContact O-CB 3.28Å; A62-D66 PolarHBondContact O-N 2.85Å; A62-D66 VanDerWaalsContact O-N 3.13Å; D66-F68 VanDerWaalsContact C-N 3.32Å; D66-N70 WeakPolarHBondContact O-CA 3.5Å; D66-N70 WeakPolarHBondContact O-CB 3.28Å; D66-N70 PolarHBondContact O-N 2.89Å; D66-N70 WeakPolarHBondContact OD1-CB 3.32Å; D66-N70 PolarHBondContact OD1-ND2 2.86Å
67	R	59.3	Low	63.2	Low	166 Å²	166	98.9 Å²	98.9	63%	0.626	49%	0.485	S	S	*	.	H	α-helix	trans	-72	-25.4	174.3	-55.5	-179.3	-60.6	163.8	3.9	113.1	L64 E65	L64-R67 WeakPolarHBondContact O-CB 3.41Å; L64-R67 WeakPolarHBondContact O-CG 3.48Å; L64-R67 PolarHBondContact O-N 3.14Å; L64-R67 PolarHBondContact O-NE 3.29Å; L64-R67 VanDerWaalsContact O-NE 3.14Å; E65-R67 PolarHBondContact O-N 3.19Å
68	F	54.7	Low	61.2	Low	171 Å²	171	105.5 Å²	105.5	75%	0.75	51%	0.511	S	S	*	.	H	α-helix	trans	-86.1	-41.2	176.1	-76.9	-93.1	0	0	0	111.2	E65 D66	E65-F68 PolarHBondContact O-N 3.35Å; D66-F68 VanDerWaalsContact C-N 3.32Å
69	Y	57	Low	58.8	Low	165 Å²	165	112.6 Å²	112.6	65%	0.647	54%	0.542	S	S	*	.	H	α-helix	trans	-85	-32.1	-178.6	-69.4	-70.9	0	0	0	115.2	E65	E65-Y69 HydrophobicContact CG-CD2 3.97Å; E65-Y69 HydrophobicContact CG-CE2 3.9Å; E65-Y69 PolarHBondContact O-N 3.22Å
70	N	54.8	Low	56.4	Low	59 Å²	59	113.6 Å²	113.6	32%	0.316	56%	0.555	S	S	.	*	S	Bend	trans	-109.4	100	173.5	-88	-69.1	0	0	0	110.2	D66 H72	D66-N70 WeakPolarHBondContact O-CA 3.5Å; D66-N70 WeakPolarHBondContact O-CB 3.28Å; D66-N70 PolarHBondContact O-N 2.89Å; D66-N70 WeakPolarHBondContact OD1-CB 3.32Å; D66-N70 PolarHBondContact OD1-ND2 2.86Å; N70-H72 PolarHBondContact O-N 3.27Å
71	N	48.6	Very low	53.8	Low	110 Å²	110	115 Å²	115	59%	0.588	57%	0.567	S	S	*	*			trans	-70.6	76.2	-179.6	-150.1	-29.4	0	0	0	111.7	A73 F74	N71-A73 PolarHBondContact O-N 2.91Å; N71-A73 WeakPolarHBondContact OD1-CB 3.3Å; N71-F74 PolarHBondContact O-N 3.46Å
72	H	49.2	Very low	51.2	Low	112 Å²	112	119.7 Å²	119.7	52%	0.519	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-64.9	-8.1	-176.4	-99.4	-91.5	0	0	0	113.8	N70 F74 K75	N70-H72 PolarHBondContact O-N 3.27Å; H72-F74 PolarHBondContact O-N 3.39Å; H72-F74 VanDerWaalsContact O-N 3.11Å; H72-K75 PolarHBondContact O-N 3.45Å
73	A	46.1	Very low	48.7	Very low	70 Å²	70	124.5 Å²	124.5	58%	0.579	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-50.6	-28.9	168	0	0	0	0	0	113.3	N71	N71-A73 PolarHBondContact O-N 2.91Å; N71-A73 WeakPolarHBondContact OD1-CB 3.3Å
74	F	46.4	Very low	46.2	Very low	179 Å²	179	128.3 Å²	128.3	79%	0.785	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-97.7	1.7	177.9	-67.4	-75.9	0	0	0	115	N71 H72	N71-F74 PolarHBondContact O-N 3.46Å; H72-F74 PolarHBondContact O-N 3.39Å; H72-F74 VanDerWaalsContact O-N 3.11Å
75	K	45.9	Very low	44.3	Very low	140 Å²	140	135.3 Å²	135.3	61%	0.609	68%	0.675	S	S	*	*	S	Bend	trans	-99.9	23.7	177.3	-75	176.6	-179.9	165.4	0	113.4	H72	H72-K75 PolarHBondContact O-N 3.45Å
76	S	48.2	Very low	42.3	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	70%	0.7	S	S	*	*	S	Bend	trans	-136	39.8	177.7	64.3	0	0	0	0	115.1
77	T	43.4	Very low	40.4	Very low	131 Å²	131	144.9 Å²	144.9	80%	0.804	73%	0.728	S	S	*	*			trans	-158.9	77.9	148	-62.8	0	0	0	0	110.9
78	E	35.3	Very low	39	Very low	199 Å²	199	141.4 Å²	141.4	93%	0.93	74%	0.735	S	S	*	*			trans	-135.4	63.1	151.4	-82.3	-140.7	141.6	0	0	109.7	T80	E78-T80 VanDerWaalsContact C-N 3.28Å; E78-T80 PolarHBondContact O-N 3.2Å
79	Q	32.6	Very low	37.7	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.794	73%	0.734	S	S	*	*			trans	-77.7	81.8	169.7	-169.4	173	19.5	0	0	110.1
80	T	32.8	Very low	36.4	Very low	121 Å²	121	138.4 Å²	138.4	74%	0.742	74%	0.744	S	S	*	*			trans	44.6	88	154.1	58	0	0	0	0	117.3	E78	E78-T80 VanDerWaalsContact C-N 3.28Å; E78-T80 PolarHBondContact O-N 3.2Å
81	F	24.7	Very low	35.2	Very low	210 Å²	210	143.9 Å²	143.9	92%	0.921	77%	0.768	S	S	*	*			trans	-127.4	79.9	155.9	-91.4	-82.6	0	0	0	111.2
82	S	27	Very low	34.3	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.4	145.5	155.6	-77.4	0	0	0	0	109.6
83	P	31	Very low	33.3	Very low	121 Å²	121	144 Å²	144	79%	0.786	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.7	136.9	-170.1	28.2	-35.6	0	0	0	112.5	K85	P83-K85 PolarHBondContact O-N 3.47Å
84	E	27.9	Very low	32.6	Very low	204 Å²	204	146.3 Å²	146.3	95%	0.953	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.4	121.3	165	-67.5	-168.2	147.1	0	0	109.9
85	K	31.4	Very low	32	Very low	205 Å²	205	141.8 Å²	141.8	89%	0.891	78%	0.782	S	S	*	*			trans	-131.1	135.4	160.4	-166.1	170.7	-175.6	175.3	0	109.4	P83	P83-K85 PolarHBondContact O-N 3.47Å
86	E	28.3	Very low	31.4	Very low	171 Å²	171	141.5 Å²	141.5	80%	0.799	79%	0.787	S	S	*	*			trans	-81.2	154.5	-159.5	-48.9	175.1	104.4	0	0	115.2
87	T	24.9	Very low	30.7	Very low	136 Å²	136	143.3 Å²	143.3	83%	0.834	79%	0.79	S	S	*	*			trans	81.4	155.8	151.9	72.6	0	0	0	0	121.9
88	A	28.7	Very low	30.3	Very low	93 Å²	93	144 Å²	144	77%	0.769	79%	0.787	S	S	*	*			trans	89.6	82.4	157.5	0	0	0	0	0	121
89	A	28.4	Very low	30.1	Very low	90 Å²	90	139.6 Å²	139.6	74%	0.744	78%	0.779	S	S	*	*				29.4	149.2	124.3	0	0	0	0	0	124.6
90	E	29.5	Very low	30.1	Very low	184 Å²	184	136 Å²	136	86%	0.86	77%	0.768	S	S	*	*			trans	67.1	145.2	161.2	-70.5	178.4	113.4	0	0	118.7
91	E	28.7	Very low	30.2	Very low	174 Å²	174	138.9 Å²	138.9	81%	0.813	77%	0.774	S	S	*	*			cis	-164.1	163.6	-32.8	-140.4	-168	-128	0	0	110.3
92	A	30.8	Very low	30.8	Very low	87 Å²	87	136 Å²	136	72%	0.719	77%	0.767	S	S	*	*			trans	63.2	162.5	173.6	0	0	0	0	0	117.2
93	D	26.9	Very low	31.1	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	76%	0.764	S	S	*	*			cis	-147.4	121.2	3.7	-149.4	30.8	0	0	0	107.5
94	V	32.2	Very low	31.4	Very low	120 Å²	120	137.5 Å²	137.5	73%	0.727	76%	0.763	S	S	*	*				63.7	126.8	101.3	172	0	0	0	0	114.3
95	S	34.1	Very low	31.6	Very low	84 Å²	84	134.1 Å²	134.1	59%	0.587	75%	0.75	S	S	*	*			cis	-164.4	153.2	10.8	-126.3	0	0	0	0	114.5
96	N	33.7	Very low	31.8	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	74%	0.74	S	S	*	*			trans	61.4	156.1	139.9	-66	18.6	0	0	0	121.7
97	D	33.6	Very low	32.1	Very low	130 Å²	130	129.6 Å²	129.6	70%	0.695	74%	0.74	S	S	*	*			cis	-146.5	176.7	11.4	-137.6	-41	0	0	0	115
98	L	34.9	Very low	32.3	Very low	144 Å²	144	126.4 Å²	126.4	75%	0.754	73%	0.734	S	S	*	*			trans	-65.1	152.1	-171.1	-88.6	62.5	0	0	0	118
99	S	30.3	Very low	32.5	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	73%	0.73	S	S	*	*				162.8	108.2	96.1	-165.7	0	0	0	0	113
100	T	32.9	Very low	32.4	Very low	93 Å²	93	132.7 Å²	132.7	57%	0.571	73%	0.73	S	S	*	*				85.1	100.7	76.2	-50.5	0	0	0	0	117.8
101	Q	33.9	Very low	32.3	Very low	182 Å²	182	129.3 Å²	129.3	85%	0.85	72%	0.721	S	S	*	*			trans	172.7	123.9	136.7	-97.3	152.9	90	0	0	108
102	L	36.8	Very low	32.2	Very low	151 Å²	151	127.9 Å²	127.9	79%	0.791	73%	0.725	S	S	*	*			cis	63.8	126.6	42.1	-67.8	175.3	0	0	0	113.1
103	S	34.7	Very low	32.1	Very low	101 Å²	101	130 Å²	130	71%	0.706	73%	0.729	S	S	*	*			cis	-137.3	-161.5	14	-62.3	0	0	0	0	110.6
104	E	36.2	Very low	32.1	Very low	162 Å²	162	130.2 Å²	130.2	76%	0.757	74%	0.735	S	S	*	*			cis	-170.2	148	22.6	-155.4	163.4	175.8	0	0	114.9
105	L	33.6	Very low	31.9	Very low	133 Å²	133	131.7 Å²	131.7	70%	0.696	74%	0.738	S	S	*	*			trans	57.8	131.5	155	-90.3	33.7	0	0	0	121.1
106	V	35.2	Very low	31.5	Very low	111 Å²	111	132.4 Å²	132.4	67%	0.673	74%	0.743	S	S	*	*				93.4	139	50.1	149.3	0	0	0	0	112.1
107	E	34	Very low	31.3	Very low	169 Å²	169	137.2 Å²	137.2	79%	0.79	75%	0.751	S	S	*	*			cis	-159.6	154.8	5.3	-129.1	166.2	-148.5	0	0	113.7
108	G	29.5	Very low	31.1	Very low	69 Å²	69	137.7 Å²	137.7	71%	0.711	75%	0.754	S	S	*	*			trans	76.9	170.4	137.8	0	0	0	0	0	121.5
109	Q	33.6	Very low	30.7	Very low	150 Å²	150	137.2 Å²	137.2	70%	0.701	76%	0.757	S	S	*	*			cis	-172.4	166.2	-25.6	-130.2	177.7	21.2	0	0	112
110	F	26.1	Very low	30.7	Very low	166 Å²	166	136.2 Å²	136.2	73%	0.728	76%	0.756	S	S	*	*			trans	66.4	124.6	173.7	-52.3	-72.8	0	0	0	116.7
111	T	26.3	Very low	31.5	Very low	112 Å²	112	137.1 Å²	137.1	69%	0.687	76%	0.763	S	S	*	*			cis	79.7	125.4	36	74.4	0	0	0	0	117.1
112	T	27.4	Very low	31.3	Very low	144 Å²	144	134.9 Å²	134.9	88%	0.883	76%	0.757	S	S	*	*				-173.3	170.6	122.7	19.1	0	0	0	0	112.9
113	T	27.4	Very low	31	Very low	132 Å²	132	134.3 Å²	134.3	81%	0.81	75%	0.753	S	S	*	*			trans	-142.5	136.8	-165.4	-51.9	0	0	0	0	112.3
114	V	27.5	Very low	30.8	Very low	141 Å²	141	134.8 Å²	134.8	86%	0.855	75%	0.752	S	S	*	*			trans	-154.3	101.3	162.4	-113.6	0	0	0	0	116.6
115	L	27.9	Very low	30.5	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	75%	0.749	S	S	*	*			trans	34.8	103.5	131.3	-68.8	160.7	0	0	0	123.2
116	S	26.8	Very low	30.3	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	75%	0.75	S	S	*	*				36.9	139.1	115.6	-44.6	0	0	0	0	123.4
117	R	29.2	Very low	30.1	Very low	233 Å²	233	131.1 Å²	131.1	88%	0.879	76%	0.756	S	S	*	*				-175.2	131.3	113	-100.8	163.6	-168.3	-173.3	5.5	116.2
118	N	28.2	Very low	30	Very low	140 Å²	140	128 Å²	128	75%	0.749	76%	0.759	S	S	*	*			trans	31.6	136.7	141.3	-45.4	8.4	0	0	0	119.5
119	T	28.3	Very low	29.9	Very low	135 Å²	135	128.3 Å²	128.3	83%	0.828	76%	0.762	S	S	*	*				-171.4	134.1	60	-58.1	0	0	0	0	112
120	A	29.6	Very low	30.7	Very low	87 Å²	87	126.5 Å²	126.5	72%	0.719	76%	0.763	S	S	*	*			trans	-106.7	166.6	157.5	0	0	0	0	0	109
121	P	49.5	Very low	31.1	Very low	112 Å²	112	127.2 Å²	127.2	73%	0.727	77%	0.769	S	S	*	*				-153.5	-167.2	85.7	44.6	-24.2	0	0	0	113.1
122	N	29.1	Very low	31.3	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	77%	0.772	S	S	*	*			cis	-169.3	157.9	15.5	-139.6	5.3	0	0	0	111.7
123	I	31.6	Very low	31.6	Very low	139 Å²	139	125.7 Å²	125.7	71%	0.713	76%	0.763	S	S	*	*			trans	65.8	139.8	141.4	-69.7	-76.6	0	0	0	117.2
124	T	31	Very low	31.8	Very low	111 Å²	111	128 Å²	128	68%	0.681	76%	0.764	S	S	*	*			cis	-162.2	145	6.5	110.9	0	0	0	0	106.3
125	D	28.5	Very low	32	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	76%	0.759	S	S	*	*			cis	-158.6	-89.3	-6.5	-151	-71.3	0	0	0	113.2
126	S	30.4	Very low	32.1	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	76%	0.758	S	S	*	*			trans	-167	174.7	-154.4	-63	0	0	0	0	114.7
127	A	31	Very low	32.4	Very low	97 Å²	97	129.6 Å²	129.6	80%	0.802	76%	0.76	S	S	*	*			trans	85.8	141.5	150.3	0	0	0	0	0	119.6
128	A	30.5	Very low	32.4	Very low	105 Å²	105	127.4 Å²	127.4	87%	0.868	76%	0.759	S	S	*	*			cis	-171.2	167.8	-14.3	0	0	0	0	0	111.4
129	G	27.8	Very low	32.5	Very low	74 Å²	74	129.7 Å²	129.7	76%	0.763	77%	0.765	S	S	*	*			trans	122.7	97.2	149	0	0	0	0	0	117.4
130	P	51.6	Low	32.5	Very low	113 Å²	113	127.3 Å²	127.3	73%	0.734	76%	0.759	S	S	*	*			trans	-101.7	165	171.6	39.3	-33.5	0	0	0	113.4
131	Q	33.2	Very low	32.6	Very low	181 Å²	181	131 Å²	131	85%	0.846	76%	0.761	S	S	*	*			trans	178.5	159	154	-102.1	154.2	30.2	0	0	109.1
132	D	32	Very low	31.6	Very low	140 Å²	140	132.8 Å²	132.8	75%	0.749	76%	0.76	S	S	*	*			cis	-179.9	151.9	-41.2	-100.1	-38.6	0	0	0	107.3
133	A	33.3	Very low	31.9	Very low	83 Å²	83	132.8 Å²	132.8	69%	0.686	77%	0.766	S	S	*	*			trans	63.8	115	161.3	0	0	0	0	0	121.8
134	E	30.8	Very low	31.9	Very low	180 Å²	180	131.8 Å²	131.8	84%	0.841	77%	0.771	S	S	*	*				41.7	138.6	119.7	-56.1	173.6	136.4	0	0	119.8
135	T	31.9	Very low	32.3	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	78%	0.781	S	S	*	*				-171.6	150.3	61.2	-38.4	0	0	0	0	113.1
136	E	29.9	Very low	32.8	Very low	163 Å²	163	134.1 Å²	134.1	76%	0.762	79%	0.787	S	S	*	*			trans	17.1	129.9	158.9	-68.4	-173.8	112.9	0	0	125.5
137	L	32.9	Very low	33.1	Very low	139 Å²	139	135.1 Å²	135.1	73%	0.728	78%	0.784	S	S	*	*				60.1	118	129.4	-58	171	0	0	0	122.1
138	Q	30.3	Very low	33.3	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	79%	0.788	S	S	*	*				-176.5	179.6	103.4	-97.8	174.2	41.8	0	0	113.2
139	H	28.8	Very low	33.8	Very low	188 Å²	188	141.6 Å²	141.6	87%	0.87	78%	0.78	S	S	*	*			trans	-86.5	162	-165.9	-63.7	-99.3	0	0	0	115.9
140	A	29.5	Very low	34.2	Very low	86 Å²	86	144 Å²	144	71%	0.711	79%	0.785	S	S	*	*			trans	112.5	127.5	131.9	0	0	0	0	0	119.7
141	E	31.5	Very low	33.4	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.762	79%	0.786	S	S	*	*			trans	71.2	144.1	140.5	-76.9	-169	85	0	0	124
142	Q	29.2	Very low	33.5	Very low	151 Å²	151	141 Å²	141	71%	0.706	78%	0.784	S	S	*	*			trans	71.2	101.8	148.7	-70.4	169.2	34.6	0	0	121.1
143	T	34.7	Very low	33.8	Very low	135 Å²	135	139.8 Å²	139.8	83%	0.828	78%	0.778	S	S	*	*				8.3	127.2	125.5	53.6	0	0	0	0	119.9
144	S	31.3	Very low	34	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	78%	0.779	S	S	*	*			trans	-164.3	147.3	146.3	60.8	0	0	0	0	111.8
145	E	40.3	Very low	34.5	Very low	191 Å²	191	141.9 Å²	141.9	89%	0.893	78%	0.775	S	S	*	*			trans	-79.9	158	176.2	-52	130.1	111.3	0	0	113.6
146	A	37.5	Very low	34.9	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	77%	0.774	S	S	*	*			trans	174.9	147.4	162.2	0	0	0	0	0	108.6
147	D	37.6	Very low	35.1	Very low	121 Å²	121	142.6 Å²	142.6	65%	0.647	77%	0.77	S	S	*	*			cis	-172.7	171	-12.3	-166.8	-8.5	0	0	0	106.7	Q149	D147-Q149 PolarHBondContact OD1-NE2 2.77Å; D147-Q149 PolarHBondContact OD2-NE2 2.75Å
148	E	35.8	Very low	35.6	Very low	189 Å²	189	142.7 Å²	142.7	88%	0.883	77%	0.77	S	S	*	*			trans	169.2	148.5	134.2	-94.2	-170.1	-169	0	0	112.8
149	Q	40.8	Very low	35.8	Very low	149 Å²	149	138.9 Å²	138.9	70%	0.696	76%	0.76	S	S	*	*			trans	-130.8	159.3	-159.7	-43.6	96.2	-0.1	0	0	117.1	D147	D147-Q149 PolarHBondContact OD1-NE2 2.77Å; D147-Q149 PolarHBondContact OD2-NE2 2.75Å
150	S	36	Very low	36.3	Very low	125 Å²	125	138.9 Å²	138.9	87%	0.874	76%	0.76	S	S	*	*			trans	-162.1	165.9	147.1	62.2	0	0	0	0	109.2
151	G	34.8	Very low	36.4	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	77%	0.766	S	S	*	*			cis	147.2	136.9	-5	0	0	0	0	0	111
152	I	34.8	Very low	37.1	Very low	158 Å²	158	138.9 Å²	138.9	81%	0.81	76%	0.763	S	S	*	*			cis	-164.2	177.7	-5.2	-141.9	167.3	0	0	0	110.2
153	D	38.7	Very low	38.2	Very low	114 Å²	114	137.2 Å²	137.2	61%	0.61	77%	0.765	S	S	*	*			trans	-10.2	147.4	169.2	-57.5	5.3	0	0	0	120.3
154	K	37.8	Very low	38.1	Very low	163 Å²	163	134.7 Å²	134.7	71%	0.709	75%	0.753	S	S	*	*				-175.5	164.9	54.1	-142.3	157.7	-147.2	81.2	0	115.5
155	D	40.9	Very low	38.4	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	75%	0.753	S	S	*	*			trans	-55.8	157.4	178.2	33.4	-73	0	0	0	117.8
156	H	40.1	Very low	38	Very low	157 Å²	157	134 Å²	134	73%	0.727	75%	0.745	S	S	*	*			cis	-161.9	-161.8	-9.6	-165	-145.9	0	0	0	107.3
157	E	34.9	Very low	37.7	Very low	145 Å²	145	136.8 Å²	136.8	68%	0.678	74%	0.744	S	S	*	*			cis	-168.9	127.9	16.9	-178.6	155.6	109.2	0	0	113.7
158	L	42.3	Very low	37.3	Very low	140 Å²	140	134 Å²	134	73%	0.733	75%	0.745	S	S	*	*			trans	60	151.1	163.8	-60.5	170.8	0	0	0	119.5
159	T	34.7	Very low	37.5	Very low	108 Å²	108	133.1 Å²	133.1	66%	0.663	75%	0.745	S	S	*	*			cis	-162.4	152.3	26.9	-25.7	0	0	0	0	112
160	E	38.8	Very low	37.1	Very low	187 Å²	187	134.7 Å²	134.7	87%	0.874	75%	0.752	S	S	*	*			trans	41.5	135.8	155.8	-75	166.2	-140.7	0	0	121
161	A	31.5	Very low	37.1	Very low	99 Å²	99	134 Å²	134	82%	0.818	75%	0.748	S	S	*	*			cis	-161.4	173.2	33.8	0	0	0	0	0	115.8
162	E	45.7	Very low	37.5	Very low	150 Å²	150	138.8 Å²	138.8	70%	0.701	75%	0.75	S	S	*	*			trans	-65	169.8	176.7	-79.1	-89.3	160.8	0	0	115.8	S164	E162-S164 WeakPolarHBondContact OE2-CB 3.44Å; E162-S164 PolarHBondContact OE2-N 2.73Å; E162-S164 PolarHBondContact OE2-OG 3Å
163	P	53.1	Low	37.5	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	75%	0.749	S	S	*	*			cis	-142.6	148.8	27.4	39.9	-19	0	0	0	122.4
164	S	32.7	Very low	37.3	Very low	81 Å²	81	139 Å²	139	57%	0.566	76%	0.758	S	S	*	*				11	155.6	124.5	-65.7	0	0	0	0	122.8	E162	E162-S164 WeakPolarHBondContact OE2-CB 3.44Å; E162-S164 PolarHBondContact OE2-N 2.73Å; E162-S164 PolarHBondContact OE2-OG 3Å
165	Q	36.7	Very low	37.3	Very low	176 Å²	176	138.9 Å²	138.9	82%	0.822	76%	0.764	S	S	*	*			cis	-173.4	179.8	-27.1	-131.3	178.3	39.6	0	0	111.9
166	T	32.4	Very low	37	Very low	117 Å²	117	139.2 Å²	139.2	72%	0.718	77%	0.766	S	S	*	*			trans	-65.1	-178.6	179.9	44.6	0	0	0	0	115.3
167	I	31.8	Very low	36.6	Very low	159 Å²	159	138.7 Å²	138.7	82%	0.815	77%	0.768	S	S	*	*			cis	-161.8	150.6	46	-64	168.9	0	0	0	110.8
168	G	29	Very low	36.6	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	77%	0.769	S	S	*	*			trans	-103.7	-149.6	-179.2	0	0	0	0	0	119.9
169	L	39.8	Very low	36.2	Very low	170 Å²	170	139.1 Å²	139.1	89%	0.89	77%	0.77	S	S	*	*			trans	76.6	124.1	170.2	-50.5	179.8	0	0	0	119.9
170	E	33.4	Very low	36.2	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	78%	0.778	S	S	*	*				164.8	145.3	105.9	-87.7	-170.3	168.7	0	0	114.6
171	S	35.8	Very low	35.9	Very low	111 Å²	111	137 Å²	137	78%	0.776	77%	0.767	S	S	*	*			trans	73	147.8	156.2	64	0	0	0	0	123.1
172	E	42.2	Very low	36	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.813	76%	0.764	S	S	*	*			trans	-82.2	171.3	175.3	-41.2	93.6	113.9	0	0	113.7
173	V	35.7	Very low	35.3	Very low	129 Å²	129	138 Å²	138	78%	0.782	77%	0.767	S	S	*	*			trans	179.4	133.1	136.3	141.6	0	0	0	0	113.7
174	D	33.3	Very low	34.4	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	77%	0.771	S	S	*	*			trans	27.3	116.1	156.8	-53.2	-28.9	0	0	0	122.3
175	D	38.6	Very low	34.4	Very low	159 Å²	159	144 Å²	144	85%	0.85	79%	0.785	S	S	*	*			trans	-75.1	120.5	152.6	-92.4	-57	0	0	0	111.9
176	N	34.4	Very low	34.3	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	78%	0.783	S	S	*	*			trans	-170	148.4	146.3	-119.7	-85.9	0	0	0	115.6
177	L	31.7	Very low	34.6	Very low	145 Å²	145	142.1 Å²	142.1	76%	0.759	78%	0.784	S	S	*	*			trans	83.3	122	140.5	-165.8	60.3	0	0	0	121.2
178	L	35.4	Very low	34.7	Very low	135 Å²	135	142.4 Å²	142.4	71%	0.707	79%	0.788	S	S	*	*			trans	84.6	91.6	159.3	-71.9	163.5	0	0	0	121.5
179	H	34	Very low	35.1	Very low	159 Å²	159	147.1 Å²	147.1	74%	0.736	80%	0.797	S	S	*	*				34.5	106.7	102.6	-174.8	-64.9	0	0	0	117.4
180	L	33.5	Very low	35.9	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	79%	0.788	S	S	*	*			trans	-126.6	120.2	177.4	-158.4	73.8	0	0	0	114	L182	L180-L182 HydrophobicContact CD1-CD1 4.03Å; L180-L182 HydrophobicContact CG-CD1 4.26Å
181	S	33.4	Very low	36	Very low	93 Å²	93	139.9 Å²	139.9	65%	0.65	78%	0.783	S	S	*	*			trans	-128.1	101.5	177.8	59.9	0	0	0	0	111.4
182	L	32.8	Very low	35.8	Very low	144 Å²	144	141.4 Å²	141.4	75%	0.754	78%	0.783	S	S	*	*			trans	-152.5	147.3	179.6	-91.6	104.4	0	0	0	109	L180	L180-L182 HydrophobicContact CD1-CD1 4.03Å; L180-L182 HydrophobicContact CG-CD1 4.26Å
183	V	32.3	Very low	35.5	Very low	126 Å²	126	140.7 Å²	140.7	76%	0.764	78%	0.779	S	S	*	*			cis	-154.3	167.7	-6.8	97.6	0	0	0	0	110.4
184	Q	32.7	Very low	35.6	Very low	181 Å²	181	139.4 Å²	139.4	85%	0.846	77%	0.772	S	S	*	*			trans	-82.7	165.3	-177.8	-59.2	163.1	-85.8	0	0	114
185	V	33.4	Very low	35.6	Very low	143 Å²	143	137.5 Å²	137.5	87%	0.867	77%	0.77	S	S	*	*			trans	-133.1	139	160.2	179.8	0	0	0	0	109.1
186	D	34.9	Very low	35.3	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	77%	0.767	S	S	*	*			trans	-75.2	151.1	-169.4	-47.8	-98.3	0	0	0	115.2
187	S	37.7	Very low	35.2	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	76%	0.759	S	S	*	*				172.4	144.7	105.7	-71.2	0	0	0	0	115.2
188	D	35.5	Very low	35.5	Very low	165 Å²	165	131.8 Å²	131.8	88%	0.882	75%	0.751	S	S	*	*			trans	71.9	151.6	155.6	-66.6	-28.7	0	0	0	122.8
189	L	37.6	Very low	35.5	Very low	163 Å²	163	132.5 Å²	132.5	85%	0.853	75%	0.751	S	S	*	*			trans	-135.7	-178.5	-164.3	-90.7	170.7	0	0	0	108.8
190	P	54.9	Low	35.6	Very low	109 Å²	109	133 Å²	133	71%	0.708	75%	0.753	S	S	*	*			cis	-133.8	178.4	-11.6	32.1	-11.7	0	0	0	115.6
191	A	35.5	Very low	35.6	Very low	90 Å²	90	132.2 Å²	132.2	74%	0.744	75%	0.745	S	S	*	*			trans	71.6	157.1	152.2	0	0	0	0	0	117.8
192	D	32.2	Very low	35.5	Very low	143 Å²	143	134.7 Å²	134.7	77%	0.765	75%	0.747	S	S	*	*			cis	-150.4	163.9	11.1	-144.5	-6.6	0	0	0	111.9
193	E	35.7	Very low	35.3	Very low	159 Å²	159	132.4 Å²	132.4	74%	0.743	74%	0.743	S	S	*	*			trans	41.5	139.9	158.9	-59.1	-130.6	118.7	0	0	120.7
194	T	37.2	Very low	35.2	Very low	102 Å²	102	132.1 Å²	132.1	63%	0.626	75%	0.746	S	S	*	*			cis	-171.2	151.8	8.1	15.7	0	0	0	0	110.6
195	S	34.4	Very low	35.2	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	74%	0.741	S	S	*	*			trans	44.6	152.4	143.1	67.7	0	0	0	0	123.2
196	D	31.1	Very low	35	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	74%	0.738	S	S	*	*			cis	178.7	167.7	-20.2	-164.6	0.5	0	0	0	106.5
197	V	33.9	Very low	34.7	Very low	108 Å²	108	131.6 Å²	131.6	66%	0.655	74%	0.74	S	S	*	*			trans	64.5	111.8	169.7	-173.1	0	0	0	0	115.5
198	S	36.5	Very low	34.4	Very low	84 Å²	84	133.4 Å²	133.4	59%	0.587	75%	0.747	S	S	*	*			cis	89.5	157.3	35.5	84.8	0	0	0	0	115.9
199	E	36.6	Very low	34.3	Very low	149 Å²	149	131.8 Å²	131.8	70%	0.696	74%	0.738	S	S	*	*			trans	70.6	119.5	-179.5	-74.6	123.3	-97.4	0	0	116.2
200	E	35.3	Very low	33.8	Very low	169 Å²	169	131.8 Å²	131.8	79%	0.79	73%	0.734	S	S	*	*				75.7	137.4	67.1	-70.5	-179	179.7	0	0	112.2
201	E	33.8	Very low	32.7	Very low	144 Å²	144	132.2 Å²	132.2	67%	0.673	73%	0.726	S	S	*	*			cis	-158.4	168.7	-7	-129.2	-160.6	147.7	0	0	111.2
202	Q	30.9	Very low	32.6	Very low	144 Å²	144	138.1 Å²	138.1	67%	0.673	73%	0.731	S	S	*	*			trans	46.9	113.1	149.5	-68.4	-176.4	33.7	0	0	122.3
203	S	29.6	Very low	32.6	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	73%	0.726	S	S	*	*				75.6	119	115.7	-53.2	0	0	0	0	122.6
204	S	30.4	Very low	32.3	Very low	119 Å²	119	138.3 Å²	138.3	83%	0.832	73%	0.73	S	S	*	*			trans	70.5	117.4	130.4	-54.2	0	0	0	0	121.4
205	A	32.5	Very low	31.9	Very low	90 Å²	90	137.3 Å²	137.3	74%	0.744	74%	0.74	S	S	*	*				141	138.5	108.1	0	0	0	0	0	116.2
206	L	28	Very low	31.7	Very low	153 Å²	153	137 Å²	137	80%	0.801	74%	0.743	S	S	*	*			trans	57.9	108.2	154.9	-88	74.6	0	0	0	122
207	W	29.3	Very low	31.5	Very low	217 Å²	217	138.6 Å²	138.6	82%	0.822	74%	0.744	S	S	*	*				38.2	118	115.6	-72.3	84.4	0	0	0	120.7
208	T	31.1	Very low	31.6	Very low	143 Å²	143	140.6 Å²	140.6	88%	0.877	75%	0.746	S	S	*	*			trans	-156.1	131.8	134.1	48.9	0	0	0	0	111.2
209	D	33.3	Very low	31.5	Very low	131 Å²	131	144.4 Å²	144.4	70%	0.701	76%	0.755	S	S	*	*			trans	-70.7	158.5	163.7	-55.1	-85.2	0	0	0	113
210	Q	27.7	Very low	31.2	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	76%	0.755	S	S	*	*				-170.8	148.3	121.3	-158.9	71.8	60.9	0	0	111.2
211	E	31.7	Very low	31.1	Very low	118 Å²	118	144.1 Å²	144.1	55%	0.551	75%	0.753	S	S	*	*			trans	-61.4	156.7	177.4	-48.5	144.4	90.5	0	0	115.6
212	Y	33.1	Very low	30.9	Very low	213 Å²	213	143.2 Å²	143.2	84%	0.835	76%	0.758	S	S	*	*				176.7	102.3	121.5	-107.2	-76.7	0	0	0	109
213	K	31.7	Very low	30.9	Very low	153 Å²	153	143.3 Å²	143.3	67%	0.665	77%	0.768	S	S	*	*				72.2	133.7	74.3	-97.5	177.7	-179.3	153.6	0	118
214	D	30.1	Very low	30.8	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	78%	0.775	S	S	*	*			trans	71.4	123.5	161.4	-51.2	-19.7	0	0	0	119.6
215	G	29.2	Very low	30.8	Very low	81 Å²	81	140.6 Å²	140.6	84%	0.835	76%	0.762	S	S	*	*			trans	-176.8	-14.3	178.8	0	0	0	0	0	121.3
216	A	30.9	Very low	31	Very low	101 Å²	101	143.4 Å²	143.4	84%	0.835	76%	0.759	S	S	*	*			trans	28.3	122.8	166.2	0	0	0	0	0	122.3
217	F	25.9	Very low	31.4	Very low	180 Å²	180	144.2 Å²	144.2	79%	0.789	76%	0.759	S	S	*	*				-153.2	162.8	127.4	-151	-102.4	0	0	0	112.3
218	E	35.7	Very low	31.7	Very low	150 Å²	150	138.5 Å²	138.5	70%	0.701	75%	0.752	S	S	*	*			trans	-76	169.4	-178.6	-67.8	150.5	128.2	0	0	111.6
219	E	34.6	Very low	31.9	Very low	163 Å²	163	139.2 Å²	139.2	76%	0.762	75%	0.745	S	S	*	*			cis	-147.3	137.5	37.1	-65.1	169.1	156.3	0	0	114.7
220	Q	31.1	Very low	32.2	Very low	151 Å²	151	140 Å²	140	71%	0.706	75%	0.745	S	S	*	*			trans	44.5	113.1	135.3	-60.5	-172.1	-93.2	0	0	121.1
221	E	32.3	Very low	32.5	Very low	161 Å²	161	138.5 Å²	138.5	75%	0.752	74%	0.742	S	S	*	*				89.9	143.8	94.6	-78.4	-179.5	136.2	0	0	114
222	T	30.4	Very low	32.4	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	75%	0.754	S	S	*	*			cis	-127.9	160.5	7.7	48.4	0	0	0	0	112.8
223	V	30.1	Very low	32.3	Very low	146 Å²	146	136 Å²	136	89%	0.885	75%	0.749	S	S	*	*			trans	-127	157.3	171.7	176	0	0	0	0	108.7
224	G	27.2	Very low	32.1	Very low	79 Å²	79	136 Å²	136	81%	0.814	76%	0.756	S	S	*	*			trans	177.2	86.3	173.4	0	0	0	0	0	114.2
225	S	30.7	Very low	32	Very low	80 Å²	80	135.5 Å²	135.5	56%	0.559	75%	0.752	S	S	*	*			trans	-132.2	179.3	165.5	49.9	0	0	0	0	109
226	E	36.4	Very low	32	Very low	149 Å²	149	139.4 Å²	139.4	70%	0.696	75%	0.748	S	S	*	*			trans	73.1	122.6	168.2	-73.7	112.8	-106.5	0	0	120.9
227	E	36.7	Very low	31.8	Very low	169 Å²	169	140 Å²	140	79%	0.79	74%	0.737	S	S	*	*				86.6	107.6	124.9	-68.1	174.2	173.4	0	0	123.2
228	S	34.7	Very low	31.8	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	73%	0.729	S	S	*	*				62.8	118.8	107.3	-47.6	0	0	0	0	122.7
229	E	36.7	Very low	31.4	Very low	157 Å²	157	135.7 Å²	135.7	73%	0.734	73%	0.73	S	S	*	*				95	147.4	122.3	-94.1	-173.8	-110.1	0	0	125.6
230	Q	38.3	Very low	31.2	Very low	147 Å²	147	137 Å²	137	69%	0.687	74%	0.736	S	S	*	*			trans	70.2	105.3	152.8	-70.6	-174.3	33.8	0	0	123.6
231	L	33.9	Very low	31	Very low	134 Å²	134	134.9 Å²	134.9	70%	0.702	73%	0.733	S	S	*	*				95.8	141.2	116.3	-74.4	176.4	0	0	0	124
232	Q	31.7	Very low	30.7	Very low	175 Å²	175	134.1 Å²	134.1	82%	0.818	73%	0.734	S	S	*	*			trans	88.3	130.8	143.6	-82.1	174.1	36.9	0	0	124
233	S	30.1	Very low	30.7	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	74%	0.739	S	S	*	*			trans	91.2	81	135.1	-170.1	0	0	0	0	122.2
234	L	27.8	Very low	30.7	Very low	154 Å²	154	133 Å²	133	81%	0.806	74%	0.738	S	S	*	*				61.2	109.6	107.9	-165.9	67.1	0	0	0	121.2
235	L	28.3	Very low	30.8	Very low	141 Å²	141	134 Å²	134	74%	0.738	74%	0.739	S	S	*	*			trans	65.6	108.2	136.6	-166.3	82.1	0	0	0	122.5
236	H	29.3	Very low	30.8	Very low	164 Å²	164	138 Å²	138	76%	0.759	75%	0.753	S	S	*	*				-169.6	97.6	129.7	-154.8	-84.7	0	0	0	111.8
237	L	25.9	Very low	31	Very low	113 Å²	113	138.6 Å²	138.6	59%	0.592	76%	0.756	S	S	*	*				76.4	102.7	78.4	-165.3	77.9	0	0	0	116.7
238	T	26.4	Very low	31.3	Very low	103 Å²	103	136.2 Å²	136.2	63%	0.632	76%	0.755	S	S	*	*			trans	81.1	133	143.7	58.6	0	0	0	0	126.4
239	L	27.1	Very low	30.9	Very low	137 Å²	137	134.4 Å²	134.4	72%	0.717	75%	0.752	S	S	*	*			trans	63.9	114.5	130.6	-68	167	0	0	0	123.1	V241	L239-V241 HydrophobicContact CD2-CG2 4.15Å
240	Q	29.5	Very low	30.7	Very low	189 Å²	189	135.4 Å²	135.4	88%	0.883	76%	0.757	S	S	*	*				-177.9	112.9	114.2	-95.6	156.8	30.3	0	0	108.7
241	V	28.3	Very low	30.4	Very low	107 Å²	107	133.9 Å²	133.9	65%	0.648	76%	0.758	S	S	*	*				74.3	105.7	65.1	178.8	0	0	0	0	113.7	L239	L239-V241 HydrophobicContact CD2-CG2 4.15Å
242	D	25.5	Very low	30.2	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	77%	0.765	S	S	*	*			trans	44.5	126.3	156.6	-64.2	-38.5	0	0	0	122.5
243	S	31.4	Very low	30.1	Very low	125 Å²	125	132.4 Å²	132.4	87%	0.874	76%	0.758	S	S	*	*				-165.1	127.7	115.8	-82.8	0	0	0	0	114.5
244	S	29.2	Very low	30.1	Very low	122 Å²	122	134.3 Å²	134.3	85%	0.853	77%	0.766	S	S	*	*			trans	-47.2	155.5	179.2	-33.9	0	0	0	0	118.9
245	A	29.7	Very low	30.3	Very low	102 Å²	102	133.8 Å²	133.8	84%	0.843	76%	0.763	S	S	*	*				178.7	151.8	114	0	0	0	0	0	115.3
246	L	30.4	Very low	30.6	Very low	162 Å²	162	135.4 Å²	135.4	85%	0.848	76%	0.764	S	S	*	*			trans	-64.2	150.4	-179.4	-88.1	54.1	0	0	0	116.6
247	E	39.6	Very low	30.7	Very low	162 Å²	162	133 Å²	133	76%	0.757	76%	0.756	S	S	*	*				12.3	151.4	118.2	-71.1	-64.2	124.9	0	0	119.2
248	P	44.3	Very low	31.1	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	76%	0.764	S	S	*	*			cis	-149.8	168.2	32.8	42.7	-22.5	0	0	0	120.2
249	G	26.6	Very low	31.4	Very low	61 Å²	61	136 Å²	136	63%	0.629	77%	0.768	S	S	*	*				77.7	118.3	116.6	0	0	0	0	0	124.3
250	E	31.5	Very low	31.6	Very low	178 Å²	178	134.1 Å²	134.1	83%	0.832	77%	0.766	S	S	*	*				84.1	102.5	128.5	-67.2	-145.6	107.4	0	0	125.8
251	T	31.9	Very low	31.9	Very low	115 Å²	115	132.6 Å²	132.6	71%	0.706	76%	0.759	S	S	*	*				84.4	132.5	125.2	73.6	0	0	0	0	124.5
252	K	29.3	Very low	32.1	Very low	195 Å²	195	135 Å²	135	85%	0.848	76%	0.763	S	S	*	*				129.5	94.1	111.8	-150.9	156	-169.7	162.8	0	120.6
253	A	30.5	Very low	32.4	Very low	83 Å²	83	134.1 Å²	134.1	69%	0.686	76%	0.759	S	S	*	*			trans	54.6	135.1	132.7	0	0	0	0	0	124.3
254	T	29.9	Very low	32.4	Very low	142 Å²	142	133.3 Å²	133.3	87%	0.871	75%	0.749	S	S	*	*				165.1	159.3	129.3	32.9	0	0	0	0	109.9
255	L	32.1	Very low	32.5	Very low	143 Å²	143	138 Å²	138	75%	0.749	75%	0.749	S	S	*	*			cis	-172.6	166.5	-35.5	-170.1	130.8	0	0	0	107.2
256	K	33.6	Very low	32.5	Very low	175 Å²	175	137.4 Å²	137.4	76%	0.761	74%	0.739	S	S	*	*			trans	106.5	152	168.5	-61	-175.1	175.7	-178.7	0	116.7
257	D	33.2	Very low	32.5	Very low	113 Å²	113	133.2 Å²	133.2	60%	0.604	73%	0.728	S	S	*	*			cis	-165.3	157.2	-23	-92.1	-22.5	0	0	0	107.8
258	D	32.5	Very low	32.2	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	73%	0.728	S	S	*	*			trans	61.4	149.8	160.9	-61.3	-19.7	0	0	0	121.6
259	I	32.7	Very low	31.6	Very low	140 Å²	140	135.6 Å²	135.6	72%	0.718	73%	0.728	S	S	*	*			cis	-167.3	126.1	-41	-117.9	169.3	0	0	0	109.6
260	S	32.5	Very low	31.7	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	73%	0.734	S	S	*	*			trans	45.3	151.6	152.7	81.6	0	0	0	0	121.7
261	Q	36	Very low	31.7	Very low	158 Å²	158	138.1 Å²	138.1	74%	0.738	73%	0.732	S	S	*	*			cis	-147.3	178.9	19.3	-60.7	172.8	-10.2	0	0	108
262	E	32.7	Very low	31.5	Very low	157 Å²	157	137.5 Å²	137.5	73%	0.734	73%	0.728	S	S	*	*			cis	-152.8	173.4	11.9	-152.1	156.9	-150.1	0	0	111.6
263	D	30.8	Very low	31.5	Very low	128 Å²	128	135.7 Å²	135.7	68%	0.684	73%	0.726	S	S	*	*			trans	65.5	80.1	162.5	-72.6	-20.2	0	0	0	123.5
264	T	32.1	Very low	31.3	Very low	108 Å²	108	136.2 Å²	136.2	66%	0.663	73%	0.725	S	S	*	*				68	114.4	112	51.6	0	0	0	0	123.9
265	Y	30.2	Very low	31.3	Very low	221 Å²	221	134.7 Å²	134.7	87%	0.867	72%	0.716	S	S	*	*				57	136.3	120	-86.5	-107	0	0	0	119.9
266	S	30.7	Very low	31.1	Very low	89 Å²	89	136.5 Å²	136.5	62%	0.622	72%	0.72	S	S	*	*			cis	-165	147	14.3	-161	0	0	0	0	113.3
267	A	30.4	Very low	31.1	Very low	74 Å²	74	135.5 Å²	135.5	61%	0.612	72%	0.722	S	S	*	*			trans	57.9	158.9	137.2	0	0	0	0	0	121.2
268	E	32.3	Very low	31.2	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	73%	0.732	S	S	*	*			cis	-175.3	178	-29.8	-86.5	-39.5	127.6	0	0	103.9
269	E	33.2	Very low	31.4	Very low	167 Å²	167	139.6 Å²	139.6	78%	0.78	73%	0.733	S	S	*	*			trans	65.1	104	155.9	-71.4	166.4	-178.1	0	0	117.3
270	T	27.9	Very low	31.1	Very low	122 Å²	122	142.6 Å²	142.6	75%	0.748	74%	0.742	S	S	*	*				61.1	134.4	81.7	67.7	0	0	0	0	113.8
271	E	31.9	Very low	31.1	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	74%	0.741	S	S	*	*				-166.6	150.1	52.4	-87.8	-161.7	138.6	0	0	114.4
272	T	27.2	Very low	30.7	Very low	102 Å²	102	141.3 Å²	141.3	63%	0.626	75%	0.748	S	S	*	*				49.8	107.3	124.8	-42.6	0	0	0	0	123.8
273	I	29.3	Very low	30.6	Very low	157 Å²	157	142 Å²	142	81%	0.805	75%	0.751	S	S	*	*			trans	48.1	127.3	132.1	-44.9	169.6	0	0	0	120.9
274	S	25.7	Very low	30.5	Very low	94 Å²	94	143.1 Å²	143.1	66%	0.657	76%	0.757	S	S	*	*				152.6	118.4	114.2	-149	0	0	0	0	117.3
275	T	31.3	Very low	30.8	Very low	110 Å²	110	143.7 Å²	143.7	68%	0.675	76%	0.762	S	S	*	*			trans	34.9	126.4	137.1	62.6	0	0	0	0	123.3
276	Q	27.8	Very low	30.6	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	76%	0.757	S	S	*	*				171.1	126.9	122.5	-90	149.6	118.8	0	0	107.8
277	L	33.3	Very low	30.7	Very low	153 Å²	153	140 Å²	140	80%	0.801	76%	0.764	S	S	*	*				75.9	134.4	63.7	-97.5	173.2	0	0	0	115.1
278	E	34.3	Very low	30.7	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	76%	0.763	S	S	*	*			trans	64.3	152.8	173.6	-62.3	168.7	-172.6	0	0	116.3
279	E	36.4	Very low	31	Very low	167 Å²	167	142.2 Å²	142.2	78%	0.78	76%	0.759	S	S	*	*			cis	-173	133.2	-30.3	176.2	-178	-178.6	0	0	105.9
280	F	28.1	Very low	31	Very low	204 Å²	204	139.5 Å²	139.5	90%	0.895	75%	0.746	S	S	*	*			trans	-168	138.1	142.7	-129.9	-93.1	0	0	0	111.5
281	A	30.9	Very low	31.6	Very low	80 Å²	80	138.5 Å²	138.5	66%	0.661	74%	0.735	S	S	*	*			trans	-100.9	152.6	173.5	0	0	0	0	0	111.4
282	V	28.4	Very low	31.5	Very low	146 Å²	146	136.1 Å²	136.1	89%	0.885	72%	0.724	S	S	*	*			trans	-131.5	140	162.3	-178.6	0	0	0	0	107
283	E	29.8	Very low	32.2	Very low	171 Å²	171	134.8 Å²	134.8	80%	0.799	72%	0.717	S	S	*	*			trans	-98.4	131.8	-171.9	-69.4	173.9	101.4	0	0	112.5
284	L	29.8	Very low	32.4	Very low	153 Å²	153	134.1 Å²	134.1	80%	0.801	72%	0.715	S	S	*	*			trans	69.2	161.8	146.6	-65.6	177.1	0	0	0	117.5
285	P	38.2	Very low	32.5	Very low	119 Å²	119	136.1 Å²	136.1	77%	0.773	72%	0.718	S	S	*	*			cis	-103.5	-155.2	10.6	42.4	-34.1	0	0	0	114.8
286	A	26	Very low	33	Very low	93 Å²	93	139.6 Å²	139.6	77%	0.769	73%	0.727	S	S	*	*			trans	-76.1	158.9	-175.1	0	0	0	0	0	112.8
287	N	31.8	Very low	33.3	Very low	141 Å²	141	138.7 Å²	138.7	75%	0.754	72%	0.723	S	S	*	*			trans	-87.7	132.2	168.9	-67	9.8	0	0	0	109.5
288	Q	32	Very low	33.5	Very low	130 Å²	130	139.7 Å²	139.7	61%	0.607	72%	0.723	S	S	*	*			trans	-129.9	134.8	152.1	-176.6	-171.5	-22.9	0	0	102.6	E290	Q288-E290 HydrophobicContact CG-CG 4.09Å; Q288-E290 VanDerWaalsContact NE2-CG 3.33Å; Q288-E290 PolarHBondContact NE2-OE1 3.33Å
289	F	37.1	Very low	33.7	Very low	152 Å²	152	134.1 Å²	134.1	67%	0.667	71%	0.707	S	S	*	*			trans	-101.9	69.1	-178.5	-95.9	-80.3	0	0	0	109.4	I291	F289-I291 PolarHBondContact O-N 3.43Å
290	E	33.6	Very low	34.3	Very low	110 Å²	110	132 Å²	132	51%	0.514	70%	0.695	S	S	.	*			trans	-64.4	108.7	166.2	-63.4	165.8	161.4	0	0	107.9	Q288	Q288-E290 HydrophobicContact CG-CG 4.09Å; Q288-E290 VanDerWaalsContact NE2-CG 3.33Å; Q288-E290 PolarHBondContact NE2-OE1 3.33Å
291	I	40.7	Very low	36.1	Very low	101 Å²	101	124.7 Å²	124.7	52%	0.518	67%	0.666	S	S	.	*			trans	-100.1	83	177.5	-54	-177.9	0	0	0	108.9	F289 P293	F289-I291 PolarHBondContact O-N 3.43Å; I291-P293 WeakPolarHBondContact O-CD 3.35Å
292	H	30.7	Very low	38.1	Very low	122 Å²	122	125 Å²	125	57%	0.565	65%	0.653	S	S	*	*			trans	-90.7	116.9	173.5	-64.4	-40.3	0	0	0	112.1	D294	H292-D294 PolarHBondContact O-N 3.41Å; H292-D294 VanDerWaalsContact O-N 3.16Å
293	P	40.1	Very low	40.5	Very low	74 Å²	74	118.9 Å²	118.9	48%	0.481	62%	0.618	S	S	.	*			trans	-87.1	60.6	-177.6	35.5	-36.9	0	0	0	114.7	I291 N295	I291-P293 WeakPolarHBondContact O-CD 3.35Å; P293-N295 PolarHBondContact O-N 3.12Å
294	D	33.4	Very low	43	Very low	142 Å²	142	115.2 Å²	115.2	76%	0.759	60%	0.601	S	S	*	*			trans	-75	87.2	173.6	178.4	17.8	0	0	0	112.3	H292	H292-D294 PolarHBondContact O-N 3.41Å; H292-D294 VanDerWaalsContact O-N 3.16Å
295	N	28.4	Very low	45.4	Very low	136 Å²	136	109.8 Å²	109.8	73%	0.727	58%	0.576	S	S	*	*	S	Bend		166.7	126.1	125.6	-96.5	-95.7	0	0	0	112.7	P293 Q297	P293-N295 PolarHBondContact O-N 3.12Å; N295-Q297 PolarHBondContact O-N 3.37Å
296	Q	42	Very low	47.3	Very low	183 Å²	183	108.9 Å²	108.9	86%	0.855	56%	0.561	S	S	*	*			trans	-36.3	117.2	174.3	-60.3	172.5	2.8	0	0	116.4
297	Q	34.4	Very low	49.9	Very low	162 Å²	162	112 Å²	112	76%	0.757	55%	0.553	S	S	*	*	S	Bend		177.4	113.6	123.4	-172.7	72.6	75.1	0	0	111.5	N295	N295-Q297 PolarHBondContact O-N 3.37Å
298	E	38.2	Very low	52.4	Low	175 Å²	175	111 Å²	111	82%	0.818	54%	0.544	S	S	*	.			trans	60.2	89.7	173.2	-66.8	173.8	145	0	0	114.4
299	A	38.1	Very low	54.9	Low	56 Å²	56	105.7 Å²	105.7	46%	0.463	52%	0.52	S	S	.	.			trans	-61.4	151.6	175.7	0	0	0	0	0	112.8
300	K	49.4	Very low	57.2	Low	121 Å²	121	100.5 Å²	100.5	53%	0.526	50%	0.5	S	S	.	.			trans	-161.1	71.3	165.5	-81.9	-136.9	92	-62.7	0	105.3	E302 T319	K300-E302 IonicContact NZ-OE1 3.1Å; K300-E302 PolarHBondContact NZ-OE1 2.92Å; K300-E302 PolarHBondContact O-N 3.12Å; K300-T319 PolarHBondContact NZ-OG1 2.95Å
301	D	64.4	Low	59.6	Low	52 Å²	52	96.9 Å²	96.9	28%	0.278	48%	0.484	S	S	.	.			trans	-91.3	73.3	-159.5	-61.6	-8.7	0	0	0	108.3
302	E	74	Confident	61.7	Low	85 Å²	85	92.7 Å²	92.7	40%	0.397	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	108.6	180	-63.2	164.2	-160.8	0	0	110	K300 E320 R673	K300-E302 IonicContact NZ-OE1 3.1Å; K300-E302 PolarHBondContact NZ-OE1 2.92Å; K300-E302 PolarHBondContact O-N 3.12Å; E302-E320 CarbonylContact C-O 3.59Å; E302-E320 WeakPolarHBondContact CA-O 3.35Å; E302-R673 IonicContact OE2-NH2 2.69Å
303	A	78.5	Confident	64.2	Low	19 Å²	19	89.8 Å²	89.8	16%	0.157	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	95.2	-174.4	0	0	0	0	0	112.6	T312 E320 T321 Q322	A303-T312 HydrophobicContact CB-CG2 4.06Å; A303-E320 PolarHBondContact N-O 2.86Å; A303-T321 HydrophobicContact CB-CG2 4.33Å; A303-T321 CarbonylContact O-C 3.53Å; A303-T321 WeakPolarHBondContact O-CA 3.39Å; A303-Q322 PolarHBondContact O-N 3.44Å
304	Q	82.9	Confident	65.9	Low	93 Å²	93	86.6 Å²	86.6	44%	0.435	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.6	-177.3	-63.1	180	-43.7	0	0	113.4	E320 Q322	Q304-E320 WeakPolarHBondContact CG-OE1 3.4Å; Q304-E320 PolarHBondContact NE2-OE1 3.15Å; Q304-Q322 CarbonylContact C-O 3.58Å; Q304-Q322 WeakPolarHBondContact CA-O 3.21Å; Q304-Q322 HydrophobicContact CG-CB 4.31Å
305	S	78.9	Confident	67.8	Low	40 Å²	40	87.5 Å²	87.5	28%	0.28	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	132.4	-177.6	-175.5	0	0	0	0	115.8	R307 Q322 G323 E324	S305-R307 VanDerWaalsContact CB-O 3.23Å; S305-R307 WeakPolarHBondContact CB-O 3.15Å; S305-R307 PolarHBondContact O-N 3.37Å; S305-R307 PolarHBondContact OG-N 3.26Å; S305-R307 PolarHBondContact OG-O 3.3Å; S305-Q322 PolarHBondContact N-O 3.28Å; S305-G323 WeakPolarHBondContact O-CA 3.33Å; S305-E324 PolarHBondContact O-N 3.49Å
306	E	79.6	Confident	69.9	Low	99 Å²	99	81.9 Å²	81.9	46%	0.463	40%	0.404	S	S	.	.	S	Bend	trans	-71.8	17.6	168.7	-55.7	174.8	161.3	0	0	113.7
307	R	80.8	Confident	71.8	Confident	158 Å²	158	78.2 Å²	78.2	60%	0.596	39%	0.387	S	S	*	.	S	Bend	trans	-161.9	165.4	-172.8	-58.5	-176.8	-169.4	67.1	33.9	110.8	S305 I309	S305-R307 VanDerWaalsContact CB-O 3.23Å; S305-R307 WeakPolarHBondContact CB-O 3.15Å; S305-R307 PolarHBondContact O-N 3.37Å; S305-R307 PolarHBondContact OG-N 3.26Å; S305-R307 PolarHBondContact OG-O 3.3Å; R307-I309 PolarHBondContact O-N 2.76Å
308	E	83.3	Confident	74.2	Confident	122 Å²	122	70.5 Å²	70.5	57%	0.57	35%	0.351	S	S	*	.			trans	-10.4	111.4	151	-168.8	-175	146.6	0	0	114.4	T310 E326	E308-T310 HydrophobicContact CG-CG2 4.15Å; E308-E326 CarbonylContact C-O 3.58Å; E308-E326 WeakPolarHBondContact CA-O 3.27Å
309	I	84.4	Confident	76.5	Confident	17 Å²	17	63.3 Å²	63.3	9%	0.087	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-102.9	113.2	169.6	-62.5	179.2	0	0	0	106.4	R307 T321 E326 I327 T328	R307-I309 PolarHBondContact O-N 2.76Å; I309-T321 HydrophobicContact CD1-CG2 4.03Å; I309-E326 PolarHBondContact N-O 2.61Å; I309-I327 HydrophobicContact CB-CG1 4.37Å; I309-I327 HydrophobicContact CB-CG2 4.45Å; I309-I327 HydrophobicContact CD1-CG1 4.41Å; I309-I327 WeakPolarHBondContact O-CA 3.01Å; I309-T328 PolarHBondContact O-N 3Å
310	T	84.7	Confident	78.9	Confident	43 Å²	43	62.5 Å²	62.5	26%	0.264	31%	0.305	S	S	.	.			trans	-87.9	-24.9	-173.4	54.8	0	0	0	0	114.4	E308	E308-T310 HydrophobicContact CG-CG2 4.15Å
311	E	84.1	Confident	80.7	Confident	35 Å²	35	56.7 Å²	56.7	16%	0.164	28%	0.28	C	S	.	.			trans	-168.4	121.9	-172.7	-173.5	-178.5	-162.6	0	0	109.2	Q313 E329	E311-Q313 HydrophobicContact CG-CG 4.38Å; E311-Q313 VanDerWaalsContact OE1-CD 3.32Å; E311-Q313 PolarHBondContact OE1-NE2 2.73Å; E311-Q313 PolarHBondContact OE1-OE1 3.35Å; E311-E329 CarbonylContact C-O 3.46Å; E311-E329 WeakPolarHBondContact CA-O 3.44Å
312	T	84.7	Confident	81.8	Confident	13 Å²	13	57.5 Å²	57.5	8%	0.08	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122	166.6	-63.6	0	0	0	0	108.3	A303 E329 T330 Q331	A303-T312 HydrophobicContact CB-CG2 4.06Å; T312-E329 PolarHBondContact N-O 3.31Å; T312-T330 HydrophobicContact CG2-CG2 4.42Å; T312-T330 CarbonylContact O-C 3.56Å; T312-T330 WeakPolarHBondContact O-CA 3.18Å; T312-Q331 PolarHBondContact O-N 2.86Å
313	Q	83.1	Confident	82.3	Confident	60 Å²	60	53.6 Å²	53.6	28%	0.28	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.3	-179	-85.7	166.5	5	0	0	111.7	E311 Q331	E311-Q313 HydrophobicContact CG-CG 4.38Å; E311-Q313 VanDerWaalsContact OE1-CD 3.32Å; E311-Q313 PolarHBondContact OE1-NE2 2.73Å; E311-Q313 PolarHBondContact OE1-OE1 3.35Å; Q313-Q331 WeakPolarHBondContact CA-O 3.43Å; Q313-Q331 HydrophobicContact CG-CB 3.97Å
314	G	75.8	Confident	82.6	Confident	7 Å²	7	56.1 Å²	56.1	7%	0.072	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	132.4	177.7	0	0	0	0	0	115	G316 Q331 E333	G314-G316 PolarHBondContact O-N 2.72Å; G314-Q331 PolarHBondContact N-O 3.11Å; G314-Q331 VanDerWaalsContact N-O 3.08Å; G314-E333 PolarHBondContact O-N 3.17Å
315	E	73.4	Confident	82.4	Confident	161 Å²	161	52.4 Å²	52.4	75%	0.752	26%	0.26	S	S	*	.	S	Bend	trans	-74.1	33.5	168	-60.8	-176.6	171.8	0	0	111.6
316	G	72.5	Confident	82.8	Confident	18 Å²	18	54.6 Å²	54.6	19%	0.186	27%	0.266	C	S	.	.	S	Bend	trans	172.8	-160	-170.6	0	0	0	0	0	115.1	G314 I318	G314-G316 PolarHBondContact O-N 2.72Å; G316-I318 PolarHBondContact O-N 2.82Å
317	E	83.3	Confident	83.2	Confident	107 Å²	107	49.9 Å²	49.9	50%	0.5	24%	0.244	S	C	.	.			trans	-61.4	107.2	-176.8	-172.4	-171.1	132.9	0	0	112.3	T319 E335	E317-T319 HydrophobicContact CG-CG2 3.83Å; E317-T319 PolarHBondContact O-N 2.69Å; E317-T319 VanDerWaalsContact OE1-CG2 3.24Å; E317-T319 WeakPolarHBondContact OE1-CG2 3.43Å; E317-E335 CarbonylContact C-O 3.2Å; E317-E335 WeakPolarHBondContact CA-O 3.39Å
318	I	85.3	Confident	83.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-89.2	100.2	172.6	-61.9	179.3	0	0	0	107.6	G316 T330 Q331 E335 I336 T337	G316-I318 PolarHBondContact O-N 2.82Å; I318-T330 HydrophobicContact CD1-CG2 4.49Å; I318-Q331 WeakPolarHBondContact CD1-O 3.31Å; I318-E335 PolarHBondContact N-O 3.15Å; I318-I336 HydrophobicContact CB-CG1 4.34Å; I318-I336 HydrophobicContact CD1-CG1 4.45Å; I318-T337 PolarHBondContact O-N 2.92Å
319	T	86.3	Confident	83.9	Confident	24 Å²	24	40.9 Å²	40.9	15%	0.147	21%	0.211	C	C	.	.			trans	-81.7	-23	-170.1	55.5	0	0	0	0	114.9	K300 E317	K300-T319 PolarHBondContact NZ-OG1 2.95Å; E317-T319 HydrophobicContact CG-CG2 3.83Å; E317-T319 PolarHBondContact O-N 2.69Å; E317-T319 VanDerWaalsContact OE1-CG2 3.24Å; E317-T319 WeakPolarHBondContact OE1-CG2 3.43Å
320	E	87	Confident	84.1	Confident	38 Å²	38	40 Å²	40	18%	0.178	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	122.3	-176.3	-170.2	-167.6	148.1	0	0	111.1	E302 A303 Q304 E338	E302-E320 CarbonylContact C-O 3.59Å; E302-E320 WeakPolarHBondContact CA-O 3.35Å; A303-E320 PolarHBondContact N-O 2.86Å; Q304-E320 WeakPolarHBondContact CG-OE1 3.4Å; Q304-E320 PolarHBondContact NE2-OE1 3.15Å; E320-E338 CarbonylContact C-O 3.59Å; E320-E338 WeakPolarHBondContact CA-O 3.16Å
321	T	87.8	Confident	84.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	112.5	167.1	-60.8	0	0	0	0	109.6	A303 I309 I327 E338 T339 Q340	A303-T321 HydrophobicContact CB-CG2 4.33Å; A303-T321 CarbonylContact O-C 3.53Å; A303-T321 WeakPolarHBondContact O-CA 3.39Å; I309-T321 HydrophobicContact CD1-CG2 4.03Å; T321-I327 HydrophobicContact CG2-CD1 4.5Å; T321-I327 HydrophobicContact CG2-CG2 4.43Å; T321-E338 PolarHBondContact N-O 2.87Å; T321-T339 CarbonylContact O-C 3.56Å; T321-T339 WeakPolarHBondContact O-CA 3.45Å; T321-Q340 PolarHBondContact O-N 2.84Å
322	Q	88	Confident	84.3	Confident	68 Å²	68	38.9 Å²	38.9	32%	0.318	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.9	-171.9	-171.2	-179.3	64.6	0	0	113.2	A303 Q304 S305 Q340	A303-Q322 PolarHBondContact O-N 3.44Å; Q304-Q322 CarbonylContact C-O 3.58Å; Q304-Q322 WeakPolarHBondContact CA-O 3.21Å; Q304-Q322 HydrophobicContact CG-CB 4.31Å; S305-Q322 PolarHBondContact N-O 3.28Å; Q322-Q340 VanDerWaalsContact CA-O 3.31Å; Q322-Q340 WeakPolarHBondContact CA-O 3.34Å
323	G	84.6	Confident	84.3	Confident	3 Å²	3	44 Å²	44	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.1	-175.4	0	0	0	0	0	116.1	S305 G325 Q340 G341 E342	S305-G323 WeakPolarHBondContact O-CA 3.33Å; G323-G325 PolarHBondContact O-N 3.08Å; G323-Q340 PolarHBondContact N-O 2.57Å; G323-G341 WeakPolarHBondContact O-CA 2.92Å; G323-E342 PolarHBondContact O-N 3.4Å
324	E	83.9	Confident	84.2	Confident	73 Å²	73	41.8 Å²	41.8	34%	0.341	22%	0.217	S	C	.	.	S	Bend	trans	-74	32.8	162.8	-60.7	-174.3	-175.5	0	0	111.7	S305	S305-E324 PolarHBondContact O-N 3.49Å
325	G	78.3	Confident	84.7	Confident	14 Å²	14	45.2 Å²	45.2	14%	0.144	23%	0.231	C	C	.	.	S	Bend	trans	-176.6	-173.6	-173.3	0	0	0	0	0	113.2	G323 I327	G323-G325 PolarHBondContact O-N 3.08Å; G325-I327 PolarHBondContact O-N 3.45Å
326	E	87.3	Confident	85.5	Confident	87 Å²	87	37.6 Å²	37.6	41%	0.407	20%	0.195	S	C	.	.			trans	-53	127.7	178.8	-170.9	178.2	140.2	0	0	111.6	E308 I309 E344	E308-E326 CarbonylContact C-O 3.58Å; E308-E326 WeakPolarHBondContact CA-O 3.27Å; I309-E326 PolarHBondContact N-O 2.61Å; E326-E344 CarbonylContact C-O 3.53Å; E326-E344 VanDerWaalsContact CA-O 3.29Å; E326-E344 WeakPolarHBondContact CA-O 3.16Å
327	I	89.3	Confident	86.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	103.3	173.2	-57.3	179.9	0	0	0	106.5	I309 T321 G325 T339 Q340 E344 I345 T346	I309-I327 HydrophobicContact CB-CG1 4.37Å; I309-I327 HydrophobicContact CB-CG2 4.45Å; I309-I327 HydrophobicContact CD1-CG1 4.41Å; I309-I327 WeakPolarHBondContact O-CA 3.01Å; T321-I327 HydrophobicContact CG2-CD1 4.5Å; T321-I327 HydrophobicContact CG2-CG2 4.43Å; G325-I327 PolarHBondContact O-N 3.45Å; I327-T339 HydrophobicContact CD1-CG2 4.45Å; I327-Q340 WeakPolarHBondContact CD1-O 3.42Å; I327-E344 PolarHBondContact N-O 3.42Å; I327-I345 HydrophobicContact CB-CG1 4.33Å; I327-I345 HydrophobicContact CD1-CG1 4.46Å; I327-I345 CarbonylContact O-C 3.58Å; I327-I345 WeakPolarHBondContact O-CA 3.41Å; I327-T346 PolarHBondContact O-N 3.45Å
328	T	88.1	Confident	86.7	Confident	41 Å²	41	36.2 Å²	36.2	25%	0.252	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-44	-171.9	-45.7	0	0	0	0	112.6	I309 T346 E347	I309-T328 PolarHBondContact O-N 3Å; T328-T346 WeakPolarHBondContact O-CB 3.41Å; T328-E347 WeakPolarHBondContact O-CB 3.19Å; T328-E347 PolarHBondContact O-N 3.22Å
329	E	89.6	Confident	87	Confident	49 Å²	49	36.3 Å²	36.3	23%	0.229	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	121.4	-169.3	-173	175.1	-171.6	0	0	110.3	E311 T312 Q331 E347	E311-E329 CarbonylContact C-O 3.46Å; E311-E329 WeakPolarHBondContact CA-O 3.44Å; T312-E329 PolarHBondContact N-O 3.31Å; E329-Q331 HydrophobicContact CG-CG 4.37Å; E329-Q331 PolarHBondContact OE1-NE2 2.96Å; E329-Q331 PolarHBondContact OE1-OE1 2.6Å; E329-E347 CarbonylContact C-O 3.54Å; E329-E347 WeakPolarHBondContact CA-O 3.37Å
330	T	89.3	Confident	87.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	115.1	173.1	-57.7	0	0	0	0	109.6	T312 I318 E347 T348 Q349	T312-T330 HydrophobicContact CG2-CG2 4.42Å; T312-T330 CarbonylContact O-C 3.56Å; T312-T330 WeakPolarHBondContact O-CA 3.18Å; I318-T330 HydrophobicContact CD1-CG2 4.49Å; T330-E347 PolarHBondContact N-O 3.43Å; T330-T348 CarbonylContact O-C 3.55Å; T330-T348 WeakPolarHBondContact O-CA 3.08Å; T330-Q349 PolarHBondContact O-N 3.01Å
331	Q	88.5	Confident	87.2	Confident	46 Å²	46	36.2 Å²	36.2	22%	0.215	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.1	-171.2	-84.4	164.9	-2.1	0	0	112.3	T312 Q313 G314 I318 E329 Q349	T312-Q331 PolarHBondContact O-N 2.86Å; Q313-Q331 WeakPolarHBondContact CA-O 3.43Å; Q313-Q331 HydrophobicContact CG-CB 3.97Å; G314-Q331 PolarHBondContact N-O 3.11Å; G314-Q331 VanDerWaalsContact N-O 3.08Å; I318-Q331 WeakPolarHBondContact CD1-O 3.31Å; E329-Q331 HydrophobicContact CG-CG 4.37Å; E329-Q331 PolarHBondContact OE1-NE2 2.96Å; E329-Q331 PolarHBondContact OE1-OE1 2.6Å; Q331-Q349 WeakPolarHBondContact CA-O 3.14Å; Q331-Q349 HydrophobicContact CG-CB 3.93Å
332	G	84.9	Confident	87.2	Confident	7 Å²	7	40.7 Å²	40.7	7%	0.072	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.3	178.9	0	0	0	0	0	114.7	G334 Q349 E351	G332-G334 PolarHBondContact O-N 3.36Å; G332-Q349 PolarHBondContact N-O 3.46Å; G332-E351 PolarHBondContact O-N 3.07Å
333	E	83.6	Confident	87.1	Confident	121 Å²	121	38.1 Å²	38.1	57%	0.565	20%	0.199	S	C	*	.	S	Bend	trans	-74.3	12.6	162.7	-61.5	-172	170.2	0	0	112.1	G314	G314-E333 PolarHBondContact O-N 3.17Å
334	G	80.7	Confident	87.4	Confident	14 Å²	14	42 Å²	42	14%	0.144	22%	0.216	C	C	.	.	S	Bend	trans	-149.8	-166.4	-173.9	0	0	0	0	0	112.6	G332 G352	G332-G334 PolarHBondContact O-N 3.36Å; G334-G352 WeakPolarHBondContact O-CA 3.07Å; G334-G352 PolarHBondContact O-N 3.17Å
335	E	87.4	Confident	87.8	Confident	79 Å²	79	38.5 Å²	38.5	37%	0.369	20%	0.2	S	C	.	.			trans	-61.7	132.8	175.5	-175.3	-176.7	135.8	0	0	110.9	E317 I318 E353	E317-E335 CarbonylContact C-O 3.2Å; E317-E335 WeakPolarHBondContact CA-O 3.39Å; I318-E335 PolarHBondContact N-O 3.15Å; E335-E353 CarbonylContact C-O 3.6Å; E335-E353 WeakPolarHBondContact CA-O 3.39Å; E335-E353 HydrophobicContact CG-CB 4.45Å
336	I	89.5	Confident	88.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	102.2	172.9	-57.2	-178.5	0	0	0	107.3	I318 T348 Q349 E353 I354 T355	I318-I336 HydrophobicContact CB-CG1 4.34Å; I318-I336 HydrophobicContact CD1-CG1 4.45Å; I336-T348 HydrophobicContact CD1-CG2 4.47Å; I336-Q349 VanDerWaalsContact CD1-O 3.28Å; I336-Q349 WeakPolarHBondContact CD1-O 3.31Å; I336-E353 PolarHBondContact N-O 3.01Å; I336-I354 HydrophobicContact CB-CG1 4.38Å; I336-I354 WeakPolarHBondContact O-CA 3.38Å; I336-T355 PolarHBondContact O-N 2.73Å
337	T	89.8	Confident	88.7	Confident	42 Å²	42	37.6 Å²	37.6	26%	0.258	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-43.7	-171.1	-43	0	0	0	0	112.9	I318 T355 E356	I318-T337 PolarHBondContact O-N 2.92Å; T337-T355 WeakPolarHBondContact O-CB 3.28Å; T337-E356 WeakPolarHBondContact O-CB 3.41Å; T337-E356 PolarHBondContact O-N 3.33Å; T337-E356 VanDerWaalsContact O-N 3.1Å
338	E	91.1	Very high	88.9	Confident	55 Å²	55	37.6 Å²	37.6	26%	0.257	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	121.9	-173.6	-174.6	-178.2	167.7	0	0	110.8	E320 T321 E356	E320-E338 CarbonylContact C-O 3.59Å; E320-E338 WeakPolarHBondContact CA-O 3.16Å; T321-E338 PolarHBondContact N-O 2.87Å; E338-E356 CarbonylContact C-O 3.58Å; E338-E356 WeakPolarHBondContact CA-O 3.43Å
339	T	91.3	Very high	89.1	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	113.4	170.3	-60.6	0	0	0	0	109.9	T321 I327 E356 T357 Q358	T321-T339 CarbonylContact O-C 3.56Å; T321-T339 WeakPolarHBondContact O-CA 3.45Å; I327-T339 HydrophobicContact CD1-CG2 4.45Å; T339-E356 PolarHBondContact N-O 2.73Å; T339-T357 CarbonylContact O-C 3.56Å; T339-T357 WeakPolarHBondContact O-CA 3.02Å; T339-Q358 PolarHBondContact O-N 3.32Å
340	Q	91.4	Very high	89	Confident	57 Å²	57	35.7 Å²	35.7	27%	0.266	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.8	-169.4	-172.8	-178	80.3	0	0	113.1	T321 Q322 G323 I327 Q358	T321-Q340 PolarHBondContact O-N 2.84Å; Q322-Q340 VanDerWaalsContact CA-O 3.31Å; Q322-Q340 WeakPolarHBondContact CA-O 3.34Å; G323-Q340 PolarHBondContact N-O 2.57Å; I327-Q340 WeakPolarHBondContact CD1-O 3.42Å; Q340-Q358 CarbonylContact C-O 3.6Å; Q340-Q358 VanDerWaalsContact CA-O 3.31Å; Q340-Q358 WeakPolarHBondContact CA-O 3.42Å; Q340-Q358 HydrophobicContact CB-CB 4.45Å; Q340-Q358 HydrophobicContact CG-CB 4.12Å
341	G	87.4	Confident	88.9	Confident	4 Å²	4	41.3 Å²	41.3	4%	0.041	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.9	-177.8	0	0	0	0	0	115.7	G323 G343 Q358 E360	G323-G341 WeakPolarHBondContact O-CA 2.92Å; G341-G343 PolarHBondContact O-N 2.92Å; G341-Q358 PolarHBondContact N-O 3.5Å; G341-E360 PolarHBondContact O-N 3.23Å
342	E	87.9	Confident	88.8	Confident	94 Å²	94	39.9 Å²	39.9	44%	0.439	21%	0.208	S	C	.	.	S	Bend	trans	-70.9	-4.4	159.8	-64.1	-169.5	176.2	0	0	111.7	G323	G323-E342 PolarHBondContact O-N 3.4Å
343	G	85.3	Confident	89.1	Confident	13 Å²	13	43.2 Å²	43.2	13%	0.134	22%	0.222	C	C	.	.	S	Bend	trans	-116.8	-170.2	-177.6	0	0	0	0	0	114	G341 G361	G341-G343 PolarHBondContact O-N 2.92Å; G343-G361 VanDerWaalsContact O-CA 3.24Å; G343-G361 WeakPolarHBondContact O-CA 3.43Å; G343-G361 PolarHBondContact O-N 3.18Å
344	E	90.4	Very high	89.5	Confident	84 Å²	84	37.5 Å²	37.5	39%	0.393	20%	0.195	S	C	.	.			trans	-65.3	132.6	167.5	-178	177	143.1	0	0	109.5	E326 I327 E362	E326-E344 CarbonylContact C-O 3.53Å; E326-E344 VanDerWaalsContact CA-O 3.29Å; E326-E344 WeakPolarHBondContact CA-O 3.16Å; I327-E344 PolarHBondContact N-O 3.42Å; E344-E362 CarbonylContact C-O 3.49Å; E344-E362 WeakPolarHBondContact CA-O 2.97Å; E344-E362 HydrophobicContact CG-CB 4.39Å
345	I	92.6	Very high	90.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113	171.1	-58.8	-179.9	0	0	0	106.1	I327 T357 Q358 E362 I363 T364	I327-I345 HydrophobicContact CB-CG1 4.33Å; I327-I345 HydrophobicContact CD1-CG1 4.46Å; I327-I345 CarbonylContact O-C 3.58Å; I327-I345 WeakPolarHBondContact O-CA 3.41Å; I345-T357 HydrophobicContact CD1-CG2 4.37Å; I345-Q358 VanDerWaalsContact CD1-O 3.32Å; I345-Q358 WeakPolarHBondContact CD1-O 3.29Å; I345-E362 PolarHBondContact N-O 3.43Å; I345-I363 HydrophobicContact CB-CG1 4.42Å; I345-I363 CarbonylContact O-C 3.59Å; I345-I363 WeakPolarHBondContact O-CA 3.31Å; I345-T364 PolarHBondContact O-N 2.87Å
346	T	92.1	Very high	90.4	Very high	35 Å²	35	37.4 Å²	37.4	22%	0.215	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-63.7	-178	-45.2	0	0	0	0	110.5	I327 T328 T364 E365	I327-T346 PolarHBondContact O-N 3.45Å; T328-T346 WeakPolarHBondContact O-CB 3.41Å; T346-T364 WeakPolarHBondContact O-CB 3.31Å; T346-E365 VanDerWaalsContact O-CB 3.31Å; T346-E365 WeakPolarHBondContact O-CB 3.38Å; T346-E365 PolarHBondContact O-N 3.4Å
347	E	92.9	Very high	90.6	Very high	47 Å²	47	37.4 Å²	37.4	22%	0.22	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.5	-169	-169	173.5	179.2	0	0	111.4	T328 E329 T330 Q349	T328-E347 WeakPolarHBondContact O-CB 3.19Å; T328-E347 PolarHBondContact O-N 3.22Å; E329-E347 CarbonylContact C-O 3.54Å; E329-E347 WeakPolarHBondContact CA-O 3.37Å; T330-E347 PolarHBondContact N-O 3.43Å; E347-Q349 HydrophobicContact CG-CG 4.41Å; E347-Q349 VanDerWaalsContact OE1-CD 3.31Å; E347-Q349 PolarHBondContact OE1-NE2 3.41Å; E347-Q349 PolarHBondContact OE1-OE1 2.87Å
348	T	93	Very high	90.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118	170.9	-57.5	0	0	0	0	109.8	T330 I336 E365 T366 E367	T330-T348 CarbonylContact O-C 3.55Å; T330-T348 WeakPolarHBondContact O-CA 3.08Å; I336-T348 HydrophobicContact CD1-CG2 4.47Å; T348-E365 PolarHBondContact N-O 2.7Å; T348-T366 CarbonylContact O-C 3.54Å; T348-T366 WeakPolarHBondContact O-CA 3.41Å; T348-E367 PolarHBondContact O-N 3Å
349	Q	91.7	Very high	90.7	Very high	42 Å²	42	34.9 Å²	34.9	20%	0.196	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.3	-169.7	-90.8	164.2	-2.9	0	0	111.6	T330 Q331 G332 I336 E347 E367	T330-Q349 PolarHBondContact O-N 3.01Å; Q331-Q349 WeakPolarHBondContact CA-O 3.14Å; Q331-Q349 HydrophobicContact CG-CB 3.93Å; G332-Q349 PolarHBondContact N-O 3.46Å; I336-Q349 VanDerWaalsContact CD1-O 3.28Å; I336-Q349 WeakPolarHBondContact CD1-O 3.31Å; E347-Q349 HydrophobicContact CG-CG 4.41Å; E347-Q349 VanDerWaalsContact OE1-CD 3.31Å; E347-Q349 PolarHBondContact OE1-NE2 3.41Å; E347-Q349 PolarHBondContact OE1-OE1 2.87Å; Q349-E367 WeakPolarHBondContact CA-O 3.06Å; Q349-E367 HydrophobicContact CG-CB 4.02Å; Q349-E367 VanDerWaalsContact CG-OE2 3.23Å; Q349-E367 WeakPolarHBondContact CG-OE2 3.43Å; Q349-E367 PolarHBondContact NE2-OE2 2.83Å
350	G	87.9	Confident	90.6	Very high	8 Å²	8	39.9 Å²	39.9	8%	0.082	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.5	178.5	0	0	0	0	0	114.7	G352 E367 G368 E369	G350-G352 PolarHBondContact O-N 3Å; G350-E367 PolarHBondContact N-O 3.08Å; G350-G368 WeakPolarHBondContact O-CA 3.43Å; G350-E369 PolarHBondContact O-N 3.39Å
351	E	88.3	Confident	90.4	Very high	119 Å²	119	37.9 Å²	37.9	56%	0.556	20%	0.198	S	C	*	.	S	Bend	trans	-72.7	-9.8	161.1	-65.7	-168	-179.1	0	0	111.7	G332	G332-E351 PolarHBondContact O-N 3.07Å
352	G	85.6	Confident	90.6	Very high	15 Å²	15	41.4 Å²	41.4	16%	0.155	21%	0.214	C	C	.	.	S	Bend	trans	-110.2	-165.8	178.6	0	0	0	0	0	114.5	G334 G350 G370	G334-G352 WeakPolarHBondContact O-CA 3.07Å; G334-G352 PolarHBondContact O-N 3.17Å; G350-G352 PolarHBondContact O-N 3Å; G352-G370 VanDerWaalsContact O-CA 3.3Å; G352-G370 WeakPolarHBondContact O-CA 3.34Å; G352-G370 PolarHBondContact O-N 2.92Å
353	E	90.4	Very high	90.9	Very high	78 Å²	78	37 Å²	37	36%	0.364	19%	0.193	S	C	.	.			trans	-67.5	136	169.8	-179.3	-177.7	141.5	0	0	110.2	E335 I336 E371	E335-E353 CarbonylContact C-O 3.6Å; E335-E353 WeakPolarHBondContact CA-O 3.39Å; E335-E353 HydrophobicContact CG-CB 4.45Å; I336-E353 PolarHBondContact N-O 3.01Å; E353-E371 CarbonylContact C-O 3.51Å; E353-E371 WeakPolarHBondContact CA-O 3.48Å; E353-E371 HydrophobicContact CG-CB 4.36Å
354	I	92.8	Very high	91.3	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108.6	171.9	-58.2	179.3	0	0	0	107	I336 T366 E367 E371 I372 T373	I336-I354 HydrophobicContact CB-CG1 4.38Å; I336-I354 WeakPolarHBondContact O-CA 3.38Å; I354-T366 HydrophobicContact CD1-CG2 4.44Å; I354-E367 VanDerWaalsContact CD1-O 3.31Å; I354-E367 WeakPolarHBondContact CD1-O 3.19Å; I354-E371 PolarHBondContact N-O 3.1Å; I354-I372 HydrophobicContact CB-CG1 4.44Å; I354-I372 WeakPolarHBondContact O-CA 3.48Å; I354-T373 PolarHBondContact O-N 2.78Å
355	T	92.6	Very high	91.5	Very high	35 Å²	35	36.6 Å²	36.6	22%	0.215	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-55.6	-174.4	-43.6	0	0	0	0	111.8	I336 T337 T373 E374	I336-T355 PolarHBondContact O-N 2.73Å; T337-T355 WeakPolarHBondContact O-CB 3.28Å; T355-T373 WeakPolarHBondContact O-CB 3.49Å; T355-E374 WeakPolarHBondContact O-CB 3.19Å; T355-E374 PolarHBondContact O-N 2.76Å
356	E	93.9	Very high	91.6	Very high	55 Å²	55	36.6 Å²	36.6	26%	0.257	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	120.9	-172.6	-170	173	-179.2	0	0	112	T337 E338 T339 Q358	T337-E356 WeakPolarHBondContact O-CB 3.41Å; T337-E356 PolarHBondContact O-N 3.33Å; T337-E356 VanDerWaalsContact O-N 3.1Å; E338-E356 CarbonylContact C-O 3.58Å; E338-E356 WeakPolarHBondContact CA-O 3.43Å; T339-E356 PolarHBondContact N-O 2.73Å; E356-Q358 HydrophobicContact CG-CG 4.42Å; E356-Q358 VanDerWaalsContact OE1-CD 3.27Å; E356-Q358 PolarHBondContact OE1-NE2 2.96Å
357	T	93.8	Very high	91.7	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.5	170.7	-59.7	0	0	0	0	110.4	T339 I345 E374 T375 E376	T339-T357 CarbonylContact O-C 3.56Å; T339-T357 WeakPolarHBondContact O-CA 3.02Å; I345-T357 HydrophobicContact CD1-CG2 4.37Å; T357-E374 PolarHBondContact N-O 2.76Å; T357-T375 CarbonylContact O-C 3.48Å; T357-T375 WeakPolarHBondContact O-CA 3.34Å; T357-E376 PolarHBondContact O-N 2.99Å
358	Q	93.3	Very high	91.5	Very high	36 Å²	36	36.1 Å²	36.1	17%	0.168	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.9	-171.2	-93.5	174.3	2.8	0	0	113.2	T339 Q340 G341 I345 E356 E376	T339-Q358 PolarHBondContact O-N 3.32Å; Q340-Q358 CarbonylContact C-O 3.6Å; Q340-Q358 VanDerWaalsContact CA-O 3.31Å; Q340-Q358 WeakPolarHBondContact CA-O 3.42Å; Q340-Q358 HydrophobicContact CB-CB 4.45Å; Q340-Q358 HydrophobicContact CG-CB 4.12Å; G341-Q358 PolarHBondContact N-O 3.5Å; I345-Q358 VanDerWaalsContact CD1-O 3.32Å; I345-Q358 WeakPolarHBondContact CD1-O 3.29Å; E356-Q358 HydrophobicContact CG-CG 4.42Å; E356-Q358 VanDerWaalsContact OE1-CD 3.27Å; E356-Q358 PolarHBondContact OE1-NE2 2.96Å; Q358-E376 CarbonylContact C-O 3.59Å; Q358-E376 WeakPolarHBondContact CA-O 3.32Å; Q358-E376 HydrophobicContact CG-CB 4.05Å; Q358-E376 PolarHBondContact NE2-OE2 3.41Å; Q358-E376 VanDerWaalsContact NE2-OE2 3.07Å
359	G	89.4	Confident	91.3	Very high	7 Å²	7	41.9 Å²	41.9	7%	0.072	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.1	179.1	0	0	0	0	0	115.7	E376 G377 E378	G359-E376 PolarHBondContact N-O 3.41Å; G359-G377 CarbonylContact O-C 3.6Å; G359-G377 WeakPolarHBondContact O-CA 3.36Å; G359-E378 PolarHBondContact O-N 3.45Å
360	E	89.9	Confident	91.2	Very high	107 Å²	107	40.6 Å²	40.6	50%	0.5	21%	0.213	S	C	.	.	S	Bend	trans	-70	-24.7	160.6	-68.8	-166.9	-174.1	0	0	111.2	G341	G341-E360 PolarHBondContact O-N 3.23Å
361	G	87.7	Confident	91.3	Very high	14 Å²	14	44.1 Å²	44.1	14%	0.144	23%	0.227	C	C	.	.	S	Bend	trans	-92.7	-170.8	176.1	0	0	0	0	0	114.2	G343 G379	G343-G361 VanDerWaalsContact O-CA 3.24Å; G343-G361 WeakPolarHBondContact O-CA 3.43Å; G343-G361 PolarHBondContact O-N 3.18Å; G361-G379 WeakPolarHBondContact O-CA 3.41Å; G361-G379 PolarHBondContact O-N 3.18Å
362	E	92.1	Very high	91.6	Very high	79 Å²	79	38.5 Å²	38.5	37%	0.369	20%	0.2	S	C	.	.			trans	-69.4	132.8	172.8	-173.5	169.1	144.7	0	0	109.6	E344 I345 E380	E344-E362 CarbonylContact C-O 3.49Å; E344-E362 WeakPolarHBondContact CA-O 2.97Å; E344-E362 HydrophobicContact CG-CB 4.39Å; I345-E362 PolarHBondContact N-O 3.43Å; E362-E380 WeakPolarHBondContact CA-O 3.34Å; E362-E380 HydrophobicContact CG-CB 4.38Å
363	I	93.6	Very high	91.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.5	171.8	-57.1	177.7	0	0	0	106	I345 T375 E376 E380 I381 T382	I345-I363 HydrophobicContact CB-CG1 4.42Å; I345-I363 CarbonylContact O-C 3.59Å; I345-I363 WeakPolarHBondContact O-CA 3.31Å; I363-T375 HydrophobicContact CD1-CG2 4.22Å; I363-E376 WeakPolarHBondContact CD1-O 3.38Å; I363-E380 PolarHBondContact N-O 2.87Å; I363-I381 HydrophobicContact CB-CG1 4.32Å; I363-I381 HydrophobicContact CD1-CG1 4.42Å; I363-I381 CarbonylContact O-C 3.57Å; I363-I381 WeakPolarHBondContact O-CA 3.42Å; I363-T382 PolarHBondContact O-N 2.92Å
364	T	93.3	Very high	92.1	Very high	32 Å²	32	38.9 Å²	38.9	20%	0.196	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-58.6	-177.2	-46.9	0	0	0	0	110.6	I345 T346 T382 E383	I345-T364 PolarHBondContact O-N 2.87Å; T346-T364 WeakPolarHBondContact O-CB 3.31Å; T364-T382 WeakPolarHBondContact O-CB 3.37Å; T364-E383 WeakPolarHBondContact O-CB 3.39Å; T364-E383 PolarHBondContact O-N 2.94Å
365	E	94.7	Very high	92.2	Very high	57 Å²	57	38.9 Å²	38.9	27%	0.266	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	124.4	-163.3	-163.5	168	165.1	0	0	109.8	T346 T348 E367	T346-E365 VanDerWaalsContact O-CB 3.31Å; T346-E365 WeakPolarHBondContact O-CB 3.38Å; T346-E365 PolarHBondContact O-N 3.4Å; T348-E365 PolarHBondContact N-O 2.7Å; E365-E367 HydrophobicContact CG-CG 4.35Å
366	T	94.4	Very high	92.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	106.9	175.2	-61.3	0	0	0	0	109.3	T348 I354 E383 T384 E385	T348-T366 CarbonylContact O-C 3.54Å; T348-T366 WeakPolarHBondContact O-CA 3.41Å; I354-T366 HydrophobicContact CD1-CG2 4.44Å; T366-E383 PolarHBondContact N-O 2.92Å; T366-E383 VanDerWaalsContact N-O 3.15Å; T366-T384 CarbonylContact O-C 3.5Å; T366-T384 WeakPolarHBondContact O-CA 3.48Å; T366-E385 PolarHBondContact O-N 3.47Å
367	E	93.6	Very high	92.1	Very high	65 Å²	65	38.5 Å²	38.5	30%	0.304	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.1	-173.7	-64.9	-176.2	121.7	0	0	111.4	T348 Q349 G350 I354 E365 E385	T348-E367 PolarHBondContact O-N 3Å; Q349-E367 WeakPolarHBondContact CA-O 3.06Å; Q349-E367 HydrophobicContact CG-CB 4.02Å; Q349-E367 VanDerWaalsContact CG-OE2 3.23Å; Q349-E367 WeakPolarHBondContact CG-OE2 3.43Å; Q349-E367 PolarHBondContact NE2-OE2 2.83Å; G350-E367 PolarHBondContact N-O 3.08Å; I354-E367 VanDerWaalsContact CD1-O 3.31Å; I354-E367 WeakPolarHBondContact CD1-O 3.19Å; E365-E367 HydrophobicContact CG-CG 4.35Å; E367-E385 CarbonylContact C-O 3.6Å; E367-E385 WeakPolarHBondContact CA-O 3.34Å
368	G	89.6	Confident	91.9	Very high	7 Å²	7	43 Å²	43	7%	0.072	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	126.9	176.9	0	0	0	0	0	114.9	G350 G370 E385 G386 E387	G350-G368 WeakPolarHBondContact O-CA 3.43Å; G368-G370 PolarHBondContact O-N 2.91Å; G368-E385 PolarHBondContact N-O 3.02Å; G368-G386 WeakPolarHBondContact O-CA 3.18Å; G368-E387 PolarHBondContact O-N 3.19Å
369	E	89.6	Confident	91.6	Very high	120 Å²	120	41.3 Å²	41.3	56%	0.561	21%	0.211	S	C	*	.	S	Bend	trans	-71.2	-18.7	162.7	-66.3	-163.4	179	0	0	111.4	G350	G350-E369 PolarHBondContact O-N 3.39Å
370	G	87.7	Confident	91.7	Very high	16 Å²	16	43.8 Å²	43.8	17%	0.165	22%	0.221	C	C	.	.	S	Bend	trans	-96.4	-162.3	177	0	0	0	0	0	115.1	G352 G368 G388	G352-G370 VanDerWaalsContact O-CA 3.3Å; G352-G370 WeakPolarHBondContact O-CA 3.34Å; G352-G370 PolarHBondContact O-N 2.92Å; G368-G370 PolarHBondContact O-N 2.91Å; G370-G388 WeakPolarHBondContact O-CA 3.41Å; G370-G388 PolarHBondContact O-N 2.97Å; G370-G388 VanDerWaalsContact O-N 3.13Å
371	E	91.1	Very high	91.9	Very high	81 Å²	81	38.7 Å²	38.7	38%	0.379	20%	0.197	S	C	.	.			trans	-77.5	134.5	172.9	179.2	171	159.1	0	0	109.8	E353 I354 E389	E353-E371 CarbonylContact C-O 3.51Å; E353-E371 WeakPolarHBondContact CA-O 3.48Å; E353-E371 HydrophobicContact CG-CB 4.36Å; I354-E371 PolarHBondContact N-O 3.1Å; E371-E389 CarbonylContact C-O 3.6Å; E371-E389 WeakPolarHBondContact CA-O 3.12Å; E371-E389 HydrophobicContact CG-CB 4.24Å
372	I	94	Very high	92.1	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.6	174.7	-58.2	178.2	0	0	0	107	I354 T384 E385 E389 I390 T391	I354-I372 HydrophobicContact CB-CG1 4.44Å; I354-I372 WeakPolarHBondContact O-CA 3.48Å; I372-T384 HydrophobicContact CD1-CG2 4.23Å; I372-E385 WeakPolarHBondContact CD1-O 3.32Å; I372-E389 PolarHBondContact N-O 3.04Å; I372-I390 HydrophobicContact CB-CG1 4.45Å; I372-I390 WeakPolarHBondContact O-CA 3.33Å; I372-T391 PolarHBondContact O-N 3.15Å
373	T	93.3	Very high	92.2	Very high	36 Å²	36	39.3 Å²	39.3	22%	0.221	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-59.6	-175.9	-57.7	0	0	0	0	111.6	I354 T355 T391 E392	I354-T373 PolarHBondContact O-N 2.78Å; T355-T373 WeakPolarHBondContact O-CB 3.49Å; T373-T391 WeakPolarHBondContact O-CB 3.43Å; T373-E392 PolarHBondContact O-N 2.8Å
374	E	94.5	Very high	92.2	Very high	65 Å²	65	39.3 Å²	39.3	30%	0.304	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	125.5	-170.3	-167.8	165.9	-178.1	0	0	111.8	T355 T357 E392	T355-E374 WeakPolarHBondContact O-CB 3.19Å; T355-E374 PolarHBondContact O-N 2.76Å; T357-E374 PolarHBondContact N-O 2.76Å; E374-E392 WeakPolarHBondContact CA-O 3.35Å
375	T	94.1	Very high	92.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	108.5	172	-56.6	0	0	0	0	109.9	T357 I363 I381 E392 I393 Q394	T357-T375 CarbonylContact O-C 3.48Å; T357-T375 WeakPolarHBondContact O-CA 3.34Å; I363-T375 HydrophobicContact CD1-CG2 4.22Å; T375-I381 HydrophobicContact CG2-CD1 4.26Å; T375-E392 PolarHBondContact N-O 2.97Å; T375-I393 CarbonylContact O-C 3.57Å; T375-I393 WeakPolarHBondContact O-CA 3.48Å; T375-Q394 PolarHBondContact O-N 3.12Å
376	E	94.2	Very high	91.9	Very high	78 Å²	78	38.9 Å²	38.9	36%	0.364	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.6	-171	-178.3	-173.4	-157.4	0	0	111.5	T357 Q358 G359 I363 Q394	T357-E376 PolarHBondContact O-N 2.99Å; Q358-E376 CarbonylContact C-O 3.59Å; Q358-E376 WeakPolarHBondContact CA-O 3.32Å; Q358-E376 HydrophobicContact CG-CB 4.05Å; Q358-E376 PolarHBondContact NE2-OE2 3.41Å; Q358-E376 VanDerWaalsContact NE2-OE2 3.07Å; G359-E376 PolarHBondContact N-O 3.41Å; I363-E376 WeakPolarHBondContact CD1-O 3.38Å; E376-Q394 CarbonylContact C-O 3.45Å; E376-Q394 WeakPolarHBondContact CA-O 3.34Å; E376-Q394 HydrophobicContact CG-CB 4.42Å
377	G	89.5	Confident	91.6	Very high	4 Å²	4	44.3 Å²	44.3	4%	0.041	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	126.3	178.6	0	0	0	0	0	115.2	G359 G379 Q394 S395 E396	G359-G377 CarbonylContact O-C 3.6Å; G359-G377 WeakPolarHBondContact O-CA 3.36Å; G377-G379 PolarHBondContact O-N 3.26Å; G377-Q394 PolarHBondContact N-O 2.83Å; G377-S395 VanDerWaalsContact O-CA 3.3Å; G377-S395 WeakPolarHBondContact O-CA 3.48Å; G377-E396 PolarHBondContact O-N 2.92Å
378	E	90.2	Very high	91.3	Very high	97 Å²	97	42 Å²	42	45%	0.453	21%	0.214	S	C	.	.	S	Bend	trans	-65.4	-16	157.9	-66.1	-163	179.5	0	0	110.7	G359 R397	G359-E378 PolarHBondContact O-N 3.45Å; E378-R397 PolarHBondContact O-NE 2.94Å; E378-R397 PolarHBondContact O-NH2 3.36Å
379	G	88.2	Confident	91.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-81.7	-170.4	175.7	0	0	0	0	0	116.9	G361 G377 S395 R397	G361-G379 WeakPolarHBondContact O-CA 3.41Å; G361-G379 PolarHBondContact O-N 3.18Å; G377-G379 PolarHBondContact O-N 3.26Å; G379-S395 PolarHBondContact O-OG 2.9Å; G379-R397 VanDerWaalsContact O-CB 3.32Å; G379-R397 WeakPolarHBondContact O-CB 3.41Å; G379-R397 WeakPolarHBondContact O-CG 3.27Å
380	E	91.1	Very high	91.5	Very high	59 Å²	59	39.5 Å²	39.5	28%	0.276	20%	0.201	S	C	.	.			trans	-83.8	140.4	162.4	178.3	169	166.8	0	0	107.6	E362 I363 E398	E362-E380 WeakPolarHBondContact CA-O 3.34Å; E362-E380 HydrophobicContact CG-CB 4.38Å; I363-E380 PolarHBondContact N-O 2.87Å; E380-E398 WeakPolarHBondContact CA-O 3.34Å; E380-E398 HydrophobicContact CG-CB 4.01Å
381	I	93.5	Very high	91.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.8	172.9	-59.9	179.5	0	0	0	106.3	I363 T375 I393 Q394 E398 I399 T400	I363-I381 HydrophobicContact CB-CG1 4.32Å; I363-I381 HydrophobicContact CD1-CG1 4.42Å; I363-I381 CarbonylContact O-C 3.57Å; I363-I381 WeakPolarHBondContact O-CA 3.42Å; T375-I381 HydrophobicContact CG2-CD1 4.26Å; I381-I393 HydrophobicContact CD1-CG2 3.75Å; I381-Q394 VanDerWaalsContact CD1-O 3.31Å; I381-Q394 WeakPolarHBondContact CD1-O 3.36Å; I381-E398 PolarHBondContact N-O 2.63Å; I381-I399 HydrophobicContact CB-CG1 4.41Å; I381-I399 CarbonylContact O-C 3.56Å; I381-I399 WeakPolarHBondContact O-CA 3.24Å; I381-T400 PolarHBondContact O-N 3.25Å
382	T	91.9	Very high	91.6	Very high	34 Å²	34	39.3 Å²	39.3	21%	0.209	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-53.2	-174	-55.7	0	0	0	0	111.7	I363 T364 T400 E401	I363-T382 PolarHBondContact O-N 2.92Å; T364-T382 WeakPolarHBondContact O-CB 3.37Å; T382-T400 VanDerWaalsContact O-CB 3.31Å; T382-T400 WeakPolarHBondContact O-CB 3.21Å; T382-E401 PolarHBondContact O-N 2.97Å
383	E	93.9	Very high	91.6	Very high	71 Å²	71	39.2 Å²	39.2	33%	0.332	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	129.5	-166.9	-155.7	154.4	-171.2	0	0	109.8	T364 T366 E401	T364-E383 WeakPolarHBondContact O-CB 3.39Å; T364-E383 PolarHBondContact O-N 2.94Å; T366-E383 PolarHBondContact N-O 2.92Å; T366-E383 VanDerWaalsContact N-O 3.15Å; E383-E401 WeakPolarHBondContact CA-O 3.44Å
384	T	93.8	Very high	91.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	112.4	174.6	-53.1	0	0	0	0	109.2	T366 I372 I393 E401 T402 E403	T366-T384 CarbonylContact O-C 3.5Å; T366-T384 WeakPolarHBondContact O-CA 3.48Å; I372-T384 HydrophobicContact CD1-CG2 4.23Å; T384-I393 HydrophobicContact CG2-CD1 3.83Å; T384-E401 PolarHBondContact N-O 2.73Å; T384-E401 VanDerWaalsContact N-O 3.12Å; T384-T402 WeakPolarHBondContact O-CA 3.36Å; T384-E403 PolarHBondContact O-N 2.73Å
385	E	92.7	Very high	91.3	Very high	74 Å²	74	37.7 Å²	37.7	35%	0.346	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.5	-177	-63.3	-150.7	156.9	0	0	111.8	T366 E367 G368 I372 E403	T366-E385 PolarHBondContact O-N 3.47Å; E367-E385 CarbonylContact C-O 3.6Å; E367-E385 WeakPolarHBondContact CA-O 3.34Å; G368-E385 PolarHBondContact N-O 3.02Å; I372-E385 WeakPolarHBondContact CD1-O 3.32Å; E385-E403 VanDerWaalsContact CA-O 3.31Å; E385-E403 WeakPolarHBondContact CA-O 3.39Å; E385-E403 HydrophobicContact CG-CB 4.29Å
386	G	89.2	Confident	91.1	Very high	6 Å²	6	42.9 Å²	42.9	6%	0.062	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	126.1	179.7	0	0	0	0	0	115.2	G368 G388 E403 G404 E405	G368-G386 WeakPolarHBondContact O-CA 3.18Å; G386-G388 VanDerWaalsContact C-N 3.35Å; G386-E403 PolarHBondContact N-O 2.72Å; G386-G404 CarbonylContact O-C 3.56Å; G386-G404 VanDerWaalsContact O-CA 3.26Å; G386-G404 WeakPolarHBondContact O-CA 3.4Å; G386-E405 PolarHBondContact O-N 3.33Å
387	E	89	Confident	90.8	Very high	114 Å²	114	43.3 Å²	43.3	53%	0.533	21%	0.211	S	C	.	.	S	Bend	trans	-72.8	-30.3	166.8	-69.2	-158.9	-180	0	0	111.6	G368	G368-E387 PolarHBondContact O-N 3.19Å
388	G	87.1	Confident	90.7	Very high	16 Å²	16	46.2 Å²	46.2	17%	0.165	22%	0.224	C	C	.	.	S	Bend	trans	-83.9	-165.2	176	0	0	0	0	0	114.6	G370 G386 G406	G370-G388 WeakPolarHBondContact O-CA 3.41Å; G370-G388 PolarHBondContact O-N 2.97Å; G370-G388 VanDerWaalsContact O-N 3.13Å; G386-G388 VanDerWaalsContact C-N 3.35Å; G388-G406 WeakPolarHBondContact O-CA 3.42Å; G388-G406 PolarHBondContact O-N 2.95Å
389	E	89.1	Confident	90.7	Very high	76 Å²	76	41.7 Å²	41.7	36%	0.355	20%	0.203	S	C	.	.			trans	-74.1	141.9	174.3	-174.7	167.5	161.5	0	0	110.3	E371 I372 E407	E371-E389 CarbonylContact C-O 3.6Å; E371-E389 WeakPolarHBondContact CA-O 3.12Å; E371-E389 HydrophobicContact CG-CB 4.24Å; I372-E389 PolarHBondContact N-O 3.04Å; E389-E407 HydrophobicContact CG-CB 4.42Å
390	I	92.7	Very high	90.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.3	175	-57.4	178.6	0	0	0	107.2	I372 I393 T402 E407 I408 T409	I372-I390 HydrophobicContact CB-CG1 4.45Å; I372-I390 WeakPolarHBondContact O-CA 3.33Å; I390-I393 HydrophobicContact CG2-CD1 3.91Å; I390-I393 HydrophobicContact CG2-CG1 4Å; I390-T402 HydrophobicContact CD1-CG2 4.21Å; I390-E407 PolarHBondContact N-O 3.33Å; I390-I408 HydrophobicContact CB-CG1 4.28Å; I390-I408 HydrophobicContact CD1-CD1 4.45Å; I390-I408 HydrophobicContact CD1-CG1 4.45Å; I390-I408 WeakPolarHBondContact O-CA 3.49Å; I390-T409 PolarHBondContact O-N 2.9Å
391	T	90.3	Very high	90.6	Very high	37 Å²	37	43.5 Å²	43.5	23%	0.227	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-59.5	-173.2	-65.3	0	0	0	0	112.1	I372 T373 T409 E410	I372-T391 PolarHBondContact O-N 3.15Å; T373-T391 WeakPolarHBondContact O-CB 3.43Å; T391-T409 VanDerWaalsContact O-CB 3.31Å; T391-T409 WeakPolarHBondContact O-CB 3.32Å; T391-E410 PolarHBondContact O-N 3.03Å
392	E	92.3	Very high	90.4	Very high	55 Å²	55	43.5 Å²	43.5	26%	0.257	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	123.6	-169.1	-171.8	157.6	-169.2	0	0	112.8	T373 E374 T375 Q394 E410	T373-E392 PolarHBondContact O-N 2.8Å; E374-E392 WeakPolarHBondContact CA-O 3.35Å; T375-E392 PolarHBondContact N-O 2.97Å; E392-Q394 HydrophobicContact CG-CG 4.21Å; E392-Q394 PolarHBondContact OE1-NE2 2.86Å; E392-E410 WeakPolarHBondContact CA-O 3.3Å
393	I	93	Very high	90.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.6	170.4	-55.1	-179.8	0	0	0	109.5	T375 I381 T384 I390 I399 T402 E410 I411 Q412	T375-I393 CarbonylContact O-C 3.57Å; T375-I393 WeakPolarHBondContact O-CA 3.48Å; I381-I393 HydrophobicContact CD1-CG2 3.75Å; T384-I393 HydrophobicContact CG2-CD1 3.83Å; I390-I393 HydrophobicContact CG2-CD1 3.91Å; I390-I393 HydrophobicContact CG2-CG1 4Å; I393-I399 HydrophobicContact CG2-CD1 3.95Å; I393-T402 HydrophobicContact CD1-CG2 3.53Å; I393-E410 PolarHBondContact N-O 2.76Å; I393-I411 HydrophobicContact CB-CG1 4.46Å; I393-I411 HydrophobicContact CB-CG2 4.4Å; I393-I411 CarbonylContact O-C 3.55Å; I393-I411 WeakPolarHBondContact O-CA 3.42Å; I393-Q412 PolarHBondContact O-N 2.9Å
394	Q	91.7	Very high	89.9	Confident	61 Å²	61	42.3 Å²	42.3	29%	0.285	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136	178.6	-64	-158.9	25.4	0	0	113.1	T375 E376 G377 I381 E392 Q412	T375-Q394 PolarHBondContact O-N 3.12Å; E376-Q394 CarbonylContact C-O 3.45Å; E376-Q394 WeakPolarHBondContact CA-O 3.34Å; E376-Q394 HydrophobicContact CG-CB 4.42Å; G377-Q394 PolarHBondContact N-O 2.83Å; I381-Q394 VanDerWaalsContact CD1-O 3.31Å; I381-Q394 WeakPolarHBondContact CD1-O 3.36Å; E392-Q394 HydrophobicContact CG-CG 4.21Å; E392-Q394 PolarHBondContact OE1-NE2 2.86Å; Q394-Q412 CarbonylContact C-O 3.57Å; Q394-Q412 WeakPolarHBondContact CA-O 3.31Å; Q394-Q412 HydrophobicContact CG-CB 4.37Å
395	S	89.6	Confident	89.5	Confident	8 Å²	8	47.4 Å²	47.4	6%	0.056	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132	174	174.5	0	0	0	0	113.1	G377 G379 R397 E398 Q412 G413 E414	G377-S395 VanDerWaalsContact O-CA 3.3Å; G377-S395 WeakPolarHBondContact O-CA 3.48Å; G379-S395 PolarHBondContact O-OG 2.9Å; S395-R397 PolarHBondContact O-N 3.2Å; S395-R397 VanDerWaalsContact O-N 3.1Å; S395-R397 WeakPolarHBondContact OG-CA 3.49Å; S395-R397 PolarHBondContact OG-N 2.95Å; S395-E398 PolarHBondContact OG-N 3.43Å; S395-Q412 PolarHBondContact N-O 3.4Å; S395-G413 WeakPolarHBondContact O-CA 3.47Å; S395-E414 PolarHBondContact O-N 3.41Å
396	E	90.5	Very high	89	Confident	109 Å²	109	43.9 Å²	43.9	51%	0.509	22%	0.215	S	C	.	.	S	Bend	trans	-69.7	5.1	166.1	-69.8	-154.8	158.8	0	0	112.9	G377	G377-E396 PolarHBondContact O-N 2.92Å
397	R	88.1	Confident	88.7	Confident	87 Å²	87	48.1 Å²	48.1	33%	0.328	23%	0.233	S	C	.	.	S	Bend	trans	-136.7	-108.4	-175.2	-56.3	-172.7	-162.6	155.2	18.8	113.1	E378 G379 S395 K415	E378-R397 PolarHBondContact O-NE 2.94Å; E378-R397 PolarHBondContact O-NH2 3.36Å; G379-R397 VanDerWaalsContact O-CB 3.32Å; G379-R397 WeakPolarHBondContact O-CB 3.41Å; G379-R397 WeakPolarHBondContact O-CG 3.27Å; S395-R397 PolarHBondContact O-N 3.2Å; S395-R397 VanDerWaalsContact O-N 3.1Å; S395-R397 WeakPolarHBondContact OG-CA 3.49Å; S395-R397 PolarHBondContact OG-N 2.95Å; R397-K415 HydrophobicContact CB-CD 4.21Å; R397-K415 VanDerWaalsContact CB-NZ 3.35Å; R397-K415 WeakPolarHBondContact O-CA 3.4Å; R397-K415 WeakPolarHBondContact O-CB 3.39Å; R397-K415 WeakPolarHBondContact O-CG 3.38Å; R397-K415 PolarHBondContact O-N 3.09Å
398	E	87.7	Confident	88.5	Confident	66 Å²	66	42.7 Å²	42.7	31%	0.308	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.9	-162	-85.3	145.9	-87.1	0	0	105.4	E380 I381 S395 K415 E416	E380-E398 WeakPolarHBondContact CA-O 3.34Å; E380-E398 HydrophobicContact CG-CB 4.01Å; I381-E398 PolarHBondContact N-O 2.63Å; S395-E398 PolarHBondContact OG-N 3.43Å; E398-K415 HydrophobicContact CG-CB 4.21Å; E398-K415 HydrophobicContact CG-CD 3.94Å; E398-K415 WeakPolarHBondContact OE1-CD 3.38Å; E398-K415 WeakPolarHBondContact OE1-CE 3.49Å; E398-K415 IonicContact OE1-NZ 3.96Å; E398-K415 PolarHBondContact OE1-NZ 3.47Å; E398-E416 WeakPolarHBondContact CA-O 3.24Å; E398-E416 HydrophobicContact CG-CB 4.27Å
399	I	89.3	Confident	88.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	115.8	172.9	-58.6	176.8	0	0	0	106	I381 I393 I411 Q412 E416 I417 T418	I381-I399 HydrophobicContact CB-CG1 4.41Å; I381-I399 CarbonylContact O-C 3.56Å; I381-I399 WeakPolarHBondContact O-CA 3.24Å; I393-I399 HydrophobicContact CG2-CD1 3.95Å; I399-I411 HydrophobicContact CD1-CG2 3.52Å; I399-Q412 WeakPolarHBondContact CD1-O 3.34Å; I399-E416 PolarHBondContact N-O 3.08Å; I399-I417 HydrophobicContact CB-CG1 4.35Å; I399-I417 CarbonylContact O-C 3.58Å; I399-I417 WeakPolarHBondContact O-CA 3.48Å; I399-T418 PolarHBondContact O-N 2.99Å
400	T	87.3	Confident	88.2	Confident	40 Å²	40	42.8 Å²	42.8	25%	0.245	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-61.1	-173.3	-68.7	0	0	0	0	111.7	I381 T382 T418 E419	I381-T400 PolarHBondContact O-N 3.25Å; T382-T400 VanDerWaalsContact O-CB 3.31Å; T382-T400 WeakPolarHBondContact O-CB 3.21Å; T400-T418 VanDerWaalsContact O-CB 3.29Å; T400-T418 WeakPolarHBondContact O-CB 3.31Å; T400-E419 PolarHBondContact O-N 2.86Å
401	E	90.1	Very high	87.9	Confident	58 Å²	58	42.8 Å²	42.8	27%	0.271	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.9	-174	-160.3	124.1	-138.7	0	0	110.8	T382 E383 T384 E403 E419	T382-E401 PolarHBondContact O-N 2.97Å; E383-E401 WeakPolarHBondContact CA-O 3.44Å; T384-E401 PolarHBondContact N-O 2.73Å; T384-E401 VanDerWaalsContact N-O 3.12Å; E401-E403 HydrophobicContact CG-CG 4.44Å; E401-E419 WeakPolarHBondContact CA-O 3.32Å
402	T	89.4	Confident	87.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	114.4	170.4	-52	0	0	0	0	108.6	T384 I390 I393 I408 I411 E419 T420 Q421	T384-T402 WeakPolarHBondContact O-CA 3.36Å; I390-T402 HydrophobicContact CD1-CG2 4.21Å; I393-T402 HydrophobicContact CD1-CG2 3.53Å; T402-I408 HydrophobicContact CG2-CD1 4.25Å; T402-I411 HydrophobicContact CG2-CD1 4.01Å; T402-E419 PolarHBondContact N-O 2.84Å; T402-T420 CarbonylContact O-C 3.58Å; T402-T420 WeakPolarHBondContact O-CA 3.39Å; T402-Q421 PolarHBondContact O-N 3.02Å
403	E	89.3	Confident	87.2	Confident	72 Å²	72	41.3 Å²	41.3	34%	0.336	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.1	175.5	-64.9	-141.9	-177.1	0	0	110.9	T384 E385 G386 E401 Q421	T384-E403 PolarHBondContact O-N 2.73Å; E385-E403 VanDerWaalsContact CA-O 3.31Å; E385-E403 WeakPolarHBondContact CA-O 3.39Å; E385-E403 HydrophobicContact CG-CB 4.29Å; G386-E403 PolarHBondContact N-O 2.72Å; E401-E403 HydrophobicContact CG-CG 4.44Å; E403-Q421 HydrophobicContact CG-CB 4.04Å; E403-Q421 HydrophobicContact CG-CG 4.14Å; E403-Q421 VanDerWaalsContact OE1-CD 3.24Å; E403-Q421 PolarHBondContact OE1-NE2 3.25Å
404	G	85.8	Confident	86.7	Confident	7 Å²	7	46.6 Å²	46.6	7%	0.072	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	128.4	175.6	0	0	0	0	0	113.3	G386 G406 Q421 S422 E423	G386-G404 CarbonylContact O-C 3.56Å; G386-G404 VanDerWaalsContact O-CA 3.26Å; G386-G404 WeakPolarHBondContact O-CA 3.4Å; G404-G406 PolarHBondContact O-N 3.08Å; G404-Q421 PolarHBondContact N-O 2.89Å; G404-S422 CarbonylContact O-C 3.59Å; G404-S422 VanDerWaalsContact O-CA 3.28Å; G404-S422 WeakPolarHBondContact O-CA 3.28Å; G404-E423 PolarHBondContact O-N 3.09Å
405	E	85.2	Confident	86.1	Confident	108 Å²	108	48 Å²	48	51%	0.505	23%	0.228	S	C	.	.	S	Bend	trans	-67.3	-16.7	156.7	-64.5	-151.3	172.6	0	0	110.2	G386 K424	G386-E405 PolarHBondContact O-N 3.33Å; E405-K424 VanDerWaalsContact O-CE 3.3Å; E405-K424 WeakPolarHBondContact O-CE 3.32Å; E405-K424 WeakPolarHBondContact O-CG 3.26Å; E405-K424 PolarHBondContact O-NZ 3.34Å
406	G	82.7	Confident	85.6	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-59.5	173.7	174.9	0	0	0	0	0	119.6	G388 G404 S422 K424	G388-G406 WeakPolarHBondContact O-CA 3.42Å; G388-G406 PolarHBondContact O-N 2.95Å; G404-G406 PolarHBondContact O-N 3.08Å; G406-S422 PolarHBondContact O-OG 3.4Å; G406-K424 VanDerWaalsContact CA-NZ 3.33Å; G406-K424 WeakPolarHBondContact O-CB 3.39Å
407	E	82.8	Confident	85.3	Confident	95 Å²	95	45.9 Å²	45.9	44%	0.444	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	140.9	148.4	-70.5	171.3	-140.2	0	0	106.6	E389 I390 K424 E425	E389-E407 HydrophobicContact CG-CB 4.42Å; I390-E407 PolarHBondContact N-O 3.33Å; E407-K424 HydrophobicContact CG-CB 3.67Å; E407-K424 HydrophobicContact CG-CD 3.86Å; E407-K424 HydrophobicContact CG-CG 4.41Å; E407-E425 HydrophobicContact CG-CB 4.36Å
408	I	85.4	Confident	84.9	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.9	176	-58.4	-176	0	0	0	107.8	I390 T402 I411 T420 Q421 E425 V426 T427	I390-I408 HydrophobicContact CB-CG1 4.28Å; I390-I408 HydrophobicContact CD1-CD1 4.45Å; I390-I408 HydrophobicContact CD1-CG1 4.45Å; I390-I408 WeakPolarHBondContact O-CA 3.49Å; T402-I408 HydrophobicContact CG2-CD1 4.25Å; I408-I411 HydrophobicContact CG2-CD1 3.95Å; I408-I411 HydrophobicContact CG2-CG1 3.98Å; I408-T420 HydrophobicContact CD1-CG2 4.08Å; I408-Q421 WeakPolarHBondContact CD1-O 3.35Å; I408-E425 PolarHBondContact N-O 3.35Å; I408-V426 HydrophobicContact CB-CG1 4.39Å; I408-V426 HydrophobicContact CB-CG2 4.34Å; I408-V426 HydrophobicContact CG2-CG1 4.39Å; I408-V426 CarbonylContact O-C 3.58Å; I408-V426 WeakPolarHBondContact O-CA 3.36Å; I408-T427 PolarHBondContact O-N 3.32Å
409	T	84.4	Confident	84.7	Confident	45 Å²	45	41.9 Å²	41.9	28%	0.276	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-62.5	-174.1	-72.1	0	0	0	0	112.2	I390 T391 T427 E428	I390-T409 PolarHBondContact O-N 2.9Å; T391-T409 VanDerWaalsContact O-CB 3.31Å; T391-T409 WeakPolarHBondContact O-CB 3.32Å; T409-T427 WeakPolarHBondContact O-CB 3.36Å; T409-T427 WeakPolarHBondContact O-CG2 3.39Å; T409-E428 PolarHBondContact O-N 2.88Å
410	E	85.6	Confident	84.4	Confident	48 Å²	48	41.8 Å²	41.8	22%	0.224	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	130	-172.6	-172.9	156	-173	0	0	113.2	T391 E392 I393 Q412	T391-E410 PolarHBondContact O-N 3.03Å; E392-E410 WeakPolarHBondContact CA-O 3.3Å; I393-E410 PolarHBondContact N-O 2.76Å; E410-Q412 HydrophobicContact CG-CG 4.24Å; E410-Q412 PolarHBondContact OE1-NE2 2.9Å
411	I	85.9	Confident	84.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.2	170.6	-54.3	-178.7	0	0	0	109.7	I393 I399 T402 I408 I417 T420 E428 T429 Q430	I393-I411 HydrophobicContact CB-CG1 4.46Å; I393-I411 HydrophobicContact CB-CG2 4.4Å; I393-I411 CarbonylContact O-C 3.55Å; I393-I411 WeakPolarHBondContact O-CA 3.42Å; I399-I411 HydrophobicContact CD1-CG2 3.52Å; T402-I411 HydrophobicContact CG2-CD1 4.01Å; I408-I411 HydrophobicContact CG2-CD1 3.95Å; I408-I411 HydrophobicContact CG2-CG1 3.98Å; I411-I417 HydrophobicContact CB-CD1 4.44Å; I411-I417 HydrophobicContact CG2-CD1 3.77Å; I411-I417 HydrophobicContact CG2-CG1 4.39Å; I411-T420 HydrophobicContact CD1-CG2 3.56Å; I411-E428 PolarHBondContact N-O 3.36Å; I411-E428 VanDerWaalsContact N-O 3.08Å; I411-T429 HydrophobicContact CB-CG2 4.35Å; I411-T429 WeakPolarHBondContact O-CA 3.29Å; I411-Q430 PolarHBondContact O-N 3.08Å
412	Q	85.1	Confident	83.8	Confident	60 Å²	60	38.9 Å²	38.9	28%	0.28	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.8	174.3	-55.4	-168.1	20.9	0	0	111.3	I393 Q394 S395 I399 E410 Q430	I393-Q412 PolarHBondContact O-N 2.9Å; Q394-Q412 CarbonylContact C-O 3.57Å; Q394-Q412 WeakPolarHBondContact CA-O 3.31Å; Q394-Q412 HydrophobicContact CG-CB 4.37Å; S395-Q412 PolarHBondContact N-O 3.4Å; I399-Q412 WeakPolarHBondContact CD1-O 3.34Å; E410-Q412 HydrophobicContact CG-CG 4.24Å; E410-Q412 PolarHBondContact OE1-NE2 2.9Å; Q412-Q430 WeakPolarHBondContact CA-O 3.31Å; Q412-Q430 HydrophobicContact CG-CB 4.31Å
413	G	82.9	Confident	83.4	Confident	2 Å²	2	43.8 Å²	43.8	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	112	174.7	0	0	0	0	0	111.4	S395 K415 Q430 T431	S395-G413 WeakPolarHBondContact O-CA 3.47Å; G413-K415 VanDerWaalsContact C-N 3.27Å; G413-K415 PolarHBondContact O-N 2.88Å; G413-K415 VanDerWaalsContact O-N 3.08Å; G413-Q430 PolarHBondContact N-O 3.01Å; G413-T431 WeakPolarHBondContact O-CA 3.31Å; G413-T431 WeakPolarHBondContact O-CB 3.37Å; G413-T431 PolarHBondContact O-OG1 3.47Å
414	E	82.3	Confident	82.7	Confident	111 Å²	111	44.4 Å²	44.4	52%	0.519	21%	0.214	S	C	.	.	S	Bend	trans	-52.3	-40.3	-168.8	-84.5	-152	158.8	0	0	113.4	S395 E432	S395-E414 PolarHBondContact O-N 3.41Å; E414-E432 WeakPolarHBondContact O-CA 3.21Å; E414-E432 WeakPolarHBondContact O-CB 3.23Å; E414-E432 PolarHBondContact O-N 3.19Å
415	K	78.8	Confident	82	Confident	89 Å²	89	45.1 Å²	45.1	39%	0.387	22%	0.215	S	C	.	.	S	Bend	trans	-99.1	-52.7	-176.1	-48.4	161.9	-175.7	162.3	0	114.1	R397 E398 G413 T431 G433	R397-K415 HydrophobicContact CB-CD 4.21Å; R397-K415 VanDerWaalsContact CB-NZ 3.35Å; R397-K415 WeakPolarHBondContact O-CA 3.4Å; R397-K415 WeakPolarHBondContact O-CB 3.39Å; R397-K415 WeakPolarHBondContact O-CG 3.38Å; R397-K415 PolarHBondContact O-N 3.09Å; E398-K415 HydrophobicContact CG-CB 4.21Å; E398-K415 HydrophobicContact CG-CD 3.94Å; E398-K415 WeakPolarHBondContact OE1-CD 3.38Å; E398-K415 WeakPolarHBondContact OE1-CE 3.49Å; E398-K415 IonicContact OE1-NZ 3.96Å; E398-K415 PolarHBondContact OE1-NZ 3.47Å; G413-K415 VanDerWaalsContact C-N 3.27Å; G413-K415 PolarHBondContact O-N 2.88Å; G413-K415 VanDerWaalsContact O-N 3.08Å; K415-T431 VanDerWaalsContact C-OG1 3.29Å; K415-T431 PolarHBondContact O-OG1 3.31Å; K415-G433 CarbonylContact O-C 3.57Å; K415-G433 WeakPolarHBondContact O-CA 3.38Å; K415-G433 PolarHBondContact O-N 2.76Å
416	E	79.7	Confident	81.5	Confident	73 Å²	73	40 Å²	40	34%	0.341	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	141.1	-172	-165.6	161.4	165.2	0	0	110.7	E398 I399 T431 G434 T436	E398-E416 WeakPolarHBondContact CA-O 3.24Å; E398-E416 HydrophobicContact CG-CB 4.27Å; I399-E416 PolarHBondContact N-O 3.08Å; E416-T431 PolarHBondContact N-OG1 2.99Å; E416-G434 WeakPolarHBondContact CA-O 3.4Å; E416-T436 PolarHBondContact OE1-OG1 2.86Å
417	I	82.9	Confident	81	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	117.8	167.7	-59.6	170	0	0	0	106.4	I399 I411 Q430 G434 V435 T436	I399-I417 HydrophobicContact CB-CG1 4.35Å; I399-I417 CarbonylContact O-C 3.58Å; I399-I417 WeakPolarHBondContact O-CA 3.48Å; I411-I417 HydrophobicContact CB-CD1 4.44Å; I411-I417 HydrophobicContact CG2-CD1 3.77Å; I411-I417 HydrophobicContact CG2-CG1 4.39Å; I417-Q430 WeakPolarHBondContact CD1-O 3.33Å; I417-G434 PolarHBondContact N-O 3.15Å; I417-G434 VanDerWaalsContact N-O 3.11Å; I417-V435 HydrophobicContact CB-CG1 4.27Å; I417-V435 HydrophobicContact CB-CG2 4.32Å; I417-V435 HydrophobicContact CD1-CG2 4.42Å; I417-V435 HydrophobicContact CG2-CG1 4.37Å; I417-V435 CarbonylContact O-C 3.56Å; I417-V435 VanDerWaalsContact O-CA 3.28Å; I417-V435 WeakPolarHBondContact O-CA 3.42Å; I417-T436 PolarHBondContact O-N 2.86Å
418	T	80.8	Confident	80.7	Confident	45 Å²	45	38.3 Å²	38.3	28%	0.276	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-54.7	-172	-58.8	0	0	0	0	112.1	I399 T400 T436 R437	I399-T418 PolarHBondContact O-N 2.99Å; T400-T418 VanDerWaalsContact O-CB 3.29Å; T400-T418 WeakPolarHBondContact O-CB 3.31Å; T418-T436 HydrophobicContact CG2-CG2 4.44Å; T418-T436 WeakPolarHBondContact O-CB 3.43Å; T418-R437 PolarHBondContact O-N 2.84Å
419	E	83.8	Confident	80.1	Confident	24 Å²	24	38.3 Å²	38.3	11%	0.112	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	123.6	-175.9	-167.7	132.3	-169.9	0	0	112	T400 E401 T402 Q421 R437 K439	T400-E419 PolarHBondContact O-N 2.86Å; E401-E419 WeakPolarHBondContact CA-O 3.32Å; T402-E419 PolarHBondContact N-O 2.84Å; E419-Q421 HydrophobicContact CG-CG 4.12Å; E419-Q421 PolarHBondContact OE1-NE2 2.88Å; E419-R437 VanDerWaalsContact CD-CD 3.42Å; E419-R437 VanDerWaalsContact CD-NH1 3.26Å; E419-R437 WeakPolarHBondContact OE1-CD 3.35Å; E419-R437 IonicContact OE1-CZ 3.13Å; E419-R437 IonicContact OE1-NE 3.63Å; E419-R437 IonicContact OE1-NH1 2.71Å; E419-R437 PolarHBondContact OE1-NH1 2.94Å; E419-R437 IonicContact OE2-CZ 3.56Å; E419-R437 IonicContact OE2-NH1 2.77Å; E419-R437 PolarHBondContact OE2-NH1 3.35Å; E419-K439 WeakPolarHBondContact OE1-CE 3.19Å; E419-K439 IonicContact OE1-NZ 2.77Å; E419-K439 PolarHBondContact OE1-NZ 3.01Å
420	T	82.7	Confident	79.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.8	171.6	-53.8	0	0	0	0	110.1	T402 I408 I411 V426 R437 V438 K439	T402-T420 CarbonylContact O-C 3.58Å; T402-T420 WeakPolarHBondContact O-CA 3.39Å; I408-T420 HydrophobicContact CD1-CG2 4.08Å; I411-T420 HydrophobicContact CD1-CG2 3.56Å; T420-V426 HydrophobicContact CG2-CG1 4.47Å; T420-V426 HydrophobicContact CG2-CG2 4.41Å; T420-R437 PolarHBondContact N-O 3.46Å; T420-R437 VanDerWaalsContact N-O 3.15Å; T420-V438 CarbonylContact O-C 3.51Å; T420-V438 WeakPolarHBondContact O-CA 3.44Å; T420-K439 PolarHBondContact O-N 3.02Å
421	Q	83.1	Confident	79.1	Confident	31 Å²	31	36.8 Å²	36.8	15%	0.145	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.7	-178.2	-47.9	-158.7	59.4	0	0	112	T402 E403 G404 I408 E419 K439	T402-Q421 PolarHBondContact O-N 3.02Å; E403-Q421 HydrophobicContact CG-CB 4.04Å; E403-Q421 HydrophobicContact CG-CG 4.14Å; E403-Q421 VanDerWaalsContact OE1-CD 3.24Å; E403-Q421 PolarHBondContact OE1-NE2 3.25Å; G404-Q421 PolarHBondContact N-O 2.89Å; I408-Q421 WeakPolarHBondContact CD1-O 3.35Å; E419-Q421 HydrophobicContact CG-CG 4.12Å; E419-Q421 PolarHBondContact OE1-NE2 2.88Å; Q421-K439 WeakPolarHBondContact CA-O 3.45Å; Q421-K439 HydrophobicContact CG-CB 4.23Å; Q421-K439 HydrophobicContact CG-CG 4.34Å
422	S	80.5	Confident	78.3	Confident	5 Å²	5	43.1 Å²	43.1	4%	0.035	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.1	173.6	171.8	0	0	0	0	113	G404 G406 K424 E425 K439 F440 V441	G404-S422 CarbonylContact O-C 3.59Å; G404-S422 VanDerWaalsContact O-CA 3.28Å; G404-S422 WeakPolarHBondContact O-CA 3.28Å; G406-S422 PolarHBondContact O-OG 3.4Å; S422-K424 VanDerWaalsContact C-N 3.28Å; S422-K424 PolarHBondContact O-N 3.49Å; S422-K424 PolarHBondContact OG-N 2.94Å; S422-E425 PolarHBondContact OG-N 2.92Å; S422-E425 PolarHBondContact OG-O 3.4Å; S422-K439 PolarHBondContact N-O 2.95Å; S422-K439 VanDerWaalsContact N-O 3.15Å; S422-F440 CarbonylContact O-C 3.49Å; S422-F440 WeakPolarHBondContact O-CA 3.31Å; S422-F440 WeakPolarHBondContact O-CB 3.42Å; S422-V441 PolarHBondContact O-N 2.86Å; S422-V441 VanDerWaalsContact O-N 3.08Å
423	E	80.9	Confident	77	Confident	104 Å²	104	40.7 Å²	40.7	49%	0.486	20%	0.197	S	C	.	.	S	Bend	trans	-69.7	-22.3	168.9	-76.8	-114.8	141.3	0	0	112.8	G404 V441 V442	G404-E423 PolarHBondContact O-N 3.09Å; E423-V441 HydrophobicContact CG-CG2 4.4Å; E423-V442 WeakPolarHBondContact O-CB 3.36Å; E423-V442 VanDerWaalsContact O-CG2 3.32Å; E423-V442 WeakPolarHBondContact O-CG2 3.37Å; E423-V442 PolarHBondContact O-N 3.02Å
424	K	75.9	Confident	76	Confident	84 Å²	84	40.9 Å²	40.9	37%	0.365	20%	0.199	S	C	.	.	S	Bend	trans	-108.7	-74.6	-171.4	-57.3	-178	-172.8	100.9	0	115.1	E405 G406 E407 S422 V442 T443	E405-K424 VanDerWaalsContact O-CE 3.3Å; E405-K424 WeakPolarHBondContact O-CE 3.32Å; E405-K424 WeakPolarHBondContact O-CG 3.26Å; E405-K424 PolarHBondContact O-NZ 3.34Å; G406-K424 VanDerWaalsContact CA-NZ 3.33Å; G406-K424 WeakPolarHBondContact O-CB 3.39Å; E407-K424 HydrophobicContact CG-CB 3.67Å; E407-K424 HydrophobicContact CG-CD 3.86Å; E407-K424 HydrophobicContact CG-CG 4.41Å; S422-K424 VanDerWaalsContact C-N 3.28Å; S422-K424 PolarHBondContact O-N 3.49Å; S422-K424 PolarHBondContact OG-N 2.94Å; K424-V442 CarbonylContact O-C 3.55Å; K424-V442 WeakPolarHBondContact O-CB 3.42Å; K424-T443 PolarHBondContact O-N 2.86Å
425	E	70.5	Confident	75.2	Confident	22 Å²	22	35.8 Å²	35.8	10%	0.103	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	142.3	-174.4	-179.4	167.7	140.7	0	0	108.7	E407 I408 S422 T427 T443 Q445 K447	E407-E425 HydrophobicContact CG-CB 4.36Å; I408-E425 PolarHBondContact N-O 3.35Å; S422-E425 PolarHBondContact OG-N 2.92Å; S422-E425 PolarHBondContact OG-O 3.4Å; E425-T427 PolarHBondContact OE1-OG1 3.22Å; E425-T443 WeakPolarHBondContact CB-O 3.32Å; E425-T443 WeakPolarHBondContact CG-O 3.31Å; E425-Q445 WeakPolarHBondContact OE1-CB 3.32Å; E425-Q445 PolarHBondContact OE1-NE2 2.83Å; E425-Q445 PolarHBondContact OE2-NE2 2.77Å; E425-K447 IonicContact OE1-NZ 3.74Å; E425-K447 PolarHBondContact OE1-NZ 2.94Å; E425-K447 VanDerWaalsContact OE1-NZ 3.12Å
426	V	75.8	Confident	74.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.1	164.7	-173.5	0	0	0	0	107.7	I408 T420 T429 V438 Q445 I446	I408-V426 HydrophobicContact CB-CG1 4.39Å; I408-V426 HydrophobicContact CB-CG2 4.34Å; I408-V426 HydrophobicContact CG2-CG1 4.39Å; I408-V426 CarbonylContact O-C 3.58Å; I408-V426 WeakPolarHBondContact O-CA 3.36Å; T420-V426 HydrophobicContact CG2-CG1 4.47Å; T420-V426 HydrophobicContact CG2-CG2 4.41Å; V426-T429 HydrophobicContact CG1-CG2 3.9Å; V426-V438 HydrophobicContact CG2-CG1 4.43Å; V426-Q445 CarbonylContact O-C 3.59Å; V426-I446 PolarHBondContact O-N 2.81Å
427	T	72.1	Confident	73.6	Confident	28 Å²	28	33.9 Å²	33.9	17%	0.172	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-49	-172.7	-84.6	0	0	0	0	114.1	I408 T409 E425 Q445 I446 K447	I408-T427 PolarHBondContact O-N 3.32Å; T409-T427 WeakPolarHBondContact O-CB 3.36Å; T409-T427 WeakPolarHBondContact O-CG2 3.39Å; E425-T427 PolarHBondContact OE1-OG1 3.22Å; T427-Q445 WeakPolarHBondContact CA-O 3.49Å; T427-Q445 VanDerWaalsContact O-O 3.11Å; T427-I446 WeakPolarHBondContact O-CA 3.41Å; T427-K447 HydrophobicContact CG2-CD 3.98Å; T427-K447 PolarHBondContact O-N 3.3Å; T427-K447 PolarHBondContact OG1-NZ 2.86Å
428	E	76.1	Confident	72.8	Confident	33 Å²	33	34 Å²	34	15%	0.154	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	134.2	-174.4	-177.1	135.8	-168.4	0	0	112	T409 I411 Q430 Q448	T409-E428 PolarHBondContact O-N 2.88Å; I411-E428 PolarHBondContact N-O 3.36Å; I411-E428 VanDerWaalsContact N-O 3.08Å; E428-Q430 HydrophobicContact CG-CG 4.2Å; E428-Q430 PolarHBondContact OE1-NE2 3.33Å; E428-Q448 PolarHBondContact OE1-NE2 2.73Å
429	T	72.4	Confident	72	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	123.4	175	54.3	0	0	0	0	110.6	I411 V426 R450	I411-T429 HydrophobicContact CB-CG2 4.35Å; I411-T429 WeakPolarHBondContact O-CA 3.29Å; V426-T429 HydrophobicContact CG1-CG2 3.9Å; T429-R450 PolarHBondContact O-N 2.71Å
430	Q	74.3	Confident	71.1	Confident	47 Å²	47	33.9 Å²	33.9	22%	0.22	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141.3	-176.7	-60.8	-169	38.2	0	0	112.7	I411 Q412 G413 I417 E428	I411-Q430 PolarHBondContact O-N 3.08Å; Q412-Q430 WeakPolarHBondContact CA-O 3.31Å; Q412-Q430 HydrophobicContact CG-CB 4.31Å; G413-Q430 PolarHBondContact N-O 3.01Å; I417-Q430 WeakPolarHBondContact CD1-O 3.33Å; E428-Q430 HydrophobicContact CG-CG 4.2Å; E428-Q430 PolarHBondContact OE1-NE2 3.33Å
431	T	73.8	Confident	69.2	Low	14 Å²	14	37.9 Å²	37.9	9%	0.086	19%	0.188	C	C	.	.			trans	-162.6	153.8	177.1	179.9	0	0	0	0	111	G413 K415 E416 G433 G434 V435 R450 G451	G413-T431 WeakPolarHBondContact O-CA 3.31Å; G413-T431 WeakPolarHBondContact O-CB 3.37Å; G413-T431 PolarHBondContact O-OG1 3.47Å; K415-T431 VanDerWaalsContact C-OG1 3.29Å; K415-T431 PolarHBondContact O-OG1 3.31Å; E416-T431 PolarHBondContact N-OG1 2.99Å; T431-G433 PolarHBondContact OG1-N 2.9Å; T431-G434 VanDerWaalsContact CG2-C 3.49Å; T431-G434 WeakPolarHBondContact CG2-O 3.37Å; T431-V435 HydrophobicContact CG2-CG2 3.51Å; T431-R450 PolarHBondContact N-O 2.93Å; T431-G451 WeakPolarHBondContact O-CA 2.92Å
432	E	69.8	Low	67.2	Low	133 Å²	133	40 Å²	40	62%	0.621	20%	0.203	S	C	*	.	S	Bend	trans	-81.5	-37.1	171	-57.2	-152.8	139	0	0	112.3	E414 E452	E414-E432 WeakPolarHBondContact O-CA 3.21Å; E414-E432 WeakPolarHBondContact O-CB 3.23Å; E414-E432 PolarHBondContact O-N 3.19Å; E432-E452 WeakPolarHBondContact O-CB 3.38Å; E432-E452 WeakPolarHBondContact O-CG 3.4Å; E432-E452 PolarHBondContact O-N 2.87Å; E432-E452 VanDerWaalsContact O-N 3.08Å
433	G	58.6	Low	65	Low	8 Å²	8	42.8 Å²	42.8	8%	0.082	22%	0.22	C	C	.	.	S	Bend	trans	-98.3	-25.8	-166.3	0	0	0	0	0	117.4	K415 T431 R453	K415-G433 CarbonylContact O-C 3.57Å; K415-G433 WeakPolarHBondContact O-CA 3.38Å; K415-G433 PolarHBondContact O-N 2.76Å; T431-G433 PolarHBondContact OG1-N 2.9Å; G433-R453 WeakPolarHBondContact O-CB 3.36Å; G433-R453 WeakPolarHBondContact O-CD 3.23Å; G433-R453 WeakPolarHBondContact O-CG 3.41Å; G433-R453 PolarHBondContact O-NH1 3.01Å; G433-R453 VanDerWaalsContact O-NH1 3.12Å
434	G	61.2	Low	63.1	Low	6 Å²	6	38 Å²	38	6%	0.062	20%	0.197	C	C	.	.			trans	151.6	158.3	171.6	0	0	0	0	0	114.9	E416 I417 T431 R453	E416-G434 WeakPolarHBondContact CA-O 3.4Å; I417-G434 PolarHBondContact N-O 3.15Å; I417-G434 VanDerWaalsContact N-O 3.11Å; T431-G434 VanDerWaalsContact CG2-C 3.49Å; T431-G434 WeakPolarHBondContact CG2-O 3.37Å; G434-R453 WeakPolarHBondContact CA-O 3.46Å
435	V	64.9	Low	61.1	Low	4 Å²	4	38 Å²	38	2%	0.024	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	110.4	172.8	-176.4	0	0	0	0	108.4	I417 T431 V438 I455	I417-V435 HydrophobicContact CB-CG1 4.27Å; I417-V435 HydrophobicContact CB-CG2 4.32Å; I417-V435 HydrophobicContact CD1-CG2 4.42Å; I417-V435 HydrophobicContact CG2-CG1 4.37Å; I417-V435 CarbonylContact O-C 3.56Å; I417-V435 VanDerWaalsContact O-CA 3.28Å; I417-V435 WeakPolarHBondContact O-CA 3.42Å; T431-V435 HydrophobicContact CG2-CG2 3.51Å; V435-V438 HydrophobicContact CG1-CG2 3.72Å; V435-I455 HydrophobicContact CB-CG1 4.17Å; V435-I455 WeakPolarHBondContact O-CA 3.3Å
436	T	57.9	Low	60	Low	50 Å²	50	37.1 Å²	37.1	31%	0.307	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-48.7	-172.9	-79.9	0	0	0	0	111.7	E416 I417 T418 T456 E457	E416-T436 PolarHBondContact OE1-OG1 2.86Å; I417-T436 PolarHBondContact O-N 2.86Å; T418-T436 HydrophobicContact CG2-CG2 4.44Å; T418-T436 WeakPolarHBondContact O-CB 3.43Å; T436-T456 WeakPolarHBondContact O-CB 3.37Å; T436-T456 PolarHBondContact O-N 3.39Å; T436-E457 PolarHBondContact O-N 3.09Å
437	R	67.4	Low	57.9	Low	73 Å²	73	40.9 Å²	40.9	28%	0.275	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	143.4	179.9	177.1	-170.7	-83.2	145.1	5.7	113.3	T418 E419 T420 K439 E457	T418-R437 PolarHBondContact O-N 2.84Å; E419-R437 VanDerWaalsContact CD-CD 3.42Å; E419-R437 VanDerWaalsContact CD-NH1 3.26Å; E419-R437 WeakPolarHBondContact OE1-CD 3.35Å; E419-R437 IonicContact OE1-CZ 3.13Å; E419-R437 IonicContact OE1-NE 3.63Å; E419-R437 IonicContact OE1-NH1 2.71Å; E419-R437 PolarHBondContact OE1-NH1 2.94Å; E419-R437 IonicContact OE2-CZ 3.56Å; E419-R437 IonicContact OE2-NH1 2.77Å; E419-R437 PolarHBondContact OE2-NH1 3.35Å; T420-R437 PolarHBondContact N-O 3.46Å; T420-R437 VanDerWaalsContact N-O 3.15Å; R437-K439 HydrophobicContact CG-CG 4.11Å; R437-E457 WeakPolarHBondContact CA-O 3.38Å; R437-E457 HydrophobicContact CG-CB 4.44Å; R437-E457 IonicContact CZ-OE2 2.6Å; R437-E457 IonicContact NE-OE2 3.12Å; R437-E457 PolarHBondContact NE-OE2 3.26Å; R437-E457 IonicContact NH2-OE2 2.57Å; R437-E457 PolarHBondContact NH2-OE2 3.05Å
438	V	65.7	Low	56.3	Low	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.3	162	-170.4	0	0	0	0	110.2	T420 V426 V435 F440 E457 T458 Q459	T420-V438 CarbonylContact O-C 3.51Å; T420-V438 WeakPolarHBondContact O-CA 3.44Å; V426-V438 HydrophobicContact CG2-CG1 4.43Å; V435-V438 HydrophobicContact CG1-CG2 3.72Å; V438-F440 HydrophobicContact CG1-CD1 4.15Å; V438-E457 PolarHBondContact N-O 3.11Å; V438-T458 HydrophobicContact CB-CG2 4.26Å; V438-Q459 PolarHBondContact O-N 3.12Å
439	K	64.8	Low	54.8	Low	56 Å²	56	40.9 Å²	40.9	24%	0.243	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.1	172	-49.9	-155.6	-155.5	76.8	0	110.8	E419 T420 Q421 S422 R437	E419-K439 WeakPolarHBondContact OE1-CE 3.19Å; E419-K439 IonicContact OE1-NZ 2.77Å; E419-K439 PolarHBondContact OE1-NZ 3.01Å; T420-K439 PolarHBondContact O-N 3.02Å; Q421-K439 WeakPolarHBondContact CA-O 3.45Å; Q421-K439 HydrophobicContact CG-CB 4.23Å; Q421-K439 HydrophobicContact CG-CG 4.34Å; S422-K439 PolarHBondContact N-O 2.95Å; S422-K439 VanDerWaalsContact N-O 3.15Å; R437-K439 HydrophobicContact CG-CG 4.11Å
440	F	63.9	Low	53.4	Low	12 Å²	12	47.8 Å²	47.8	5%	0.053	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	149.9	170	49.8	-86.3	0	0	0	113.1	S422 V438 V442 L444 Q459 G460	S422-F440 CarbonylContact O-C 3.49Å; S422-F440 WeakPolarHBondContact O-CA 3.31Å; S422-F440 WeakPolarHBondContact O-CB 3.42Å; V438-F440 HydrophobicContact CG1-CD1 4.15Å; F440-V442 VanDerWaalsContact CD2-O 3.32Å; F440-V442 WeakPolarHBondContact CD2-O 3.37Å; F440-L444 HydrophobicContact CD1-CD1 3.72Å; F440-L444 HydrophobicContact CD2-CB 4.3Å; F440-L444 HydrophobicContact CD2-CD1 4.05Å; F440-L444 HydrophobicContact CE1-CD1 3.51Å; F440-L444 HydrophobicContact CE1-CD2 4.1Å; F440-L444 HydrophobicContact CE1-CG 4.29Å; F440-L444 HydrophobicContact CE2-CB 3.69Å; F440-L444 HydrophobicContact CE2-CD1 3.82Å; F440-L444 HydrophobicContact CE2-CD2 4.23Å; F440-L444 HydrophobicContact CE2-CG 4.11Å; F440-L444 HydrophobicContact CG-CD1 4.02Å; F440-L444 HydrophobicContact CZ-CB 3.98Å; F440-L444 HydrophobicContact CZ-CD1 3.58Å; F440-L444 HydrophobicContact CZ-CD2 3.63Å; F440-L444 HydrophobicContact CZ-CG 3.91Å; F440-Q459 PolarHBondContact N-O 3.42Å; F440-G460 VanDerWaalsContact CE2-CA 3.42Å; F440-G460 WeakPolarHBondContact O-CA 3.44Å
441	V	44.7	Very low	51.8	Low	83 Å²	83	46.1 Å²	46.1	50%	0.503	23%	0.231	S	C	.	.	S	Bend	trans	-95	-34.5	-173.4	-174.7	0	0	0	0	112.8	S422 E423	S422-V441 PolarHBondContact O-N 2.86Å; S422-V441 VanDerWaalsContact O-N 3.08Å; E423-V441 HydrophobicContact CG-CG2 4.4Å
442	V	40.2	Very low	50	Low	76 Å²	76	51.7 Å²	51.7	46%	0.461	26%	0.256	S	S	.	.	S	Bend	trans	-118.7	-167.5	-176.6	-178.5	0	0	0	0	110.6	E423 K424 F440 L444	E423-V442 WeakPolarHBondContact O-CB 3.36Å; E423-V442 VanDerWaalsContact O-CG2 3.32Å; E423-V442 WeakPolarHBondContact O-CG2 3.37Å; E423-V442 PolarHBondContact O-N 3.02Å; K424-V442 CarbonylContact O-C 3.55Å; K424-V442 WeakPolarHBondContact O-CB 3.42Å; F440-V442 VanDerWaalsContact CD2-O 3.32Å; F440-V442 WeakPolarHBondContact CD2-O 3.37Å; V442-L444 PolarHBondContact O-N 2.87Å
443	T	34.3	Very low	48.6	Very low	63 Å²	63	52 Å²	52	39%	0.387	25%	0.252	S	S	.	.			trans	-57.3	127.7	-163.2	36.1	0	0	0	0	114	K424 E425	K424-T443 PolarHBondContact O-N 2.86Å; E425-T443 WeakPolarHBondContact CB-O 3.32Å; E425-T443 WeakPolarHBondContact CG-O 3.31Å
444	L	41.5	Very low	47.9	Very low	3 Å²	3	55.7 Å²	55.7	2%	0.016	27%	0.266	C	S	.	.			trans	-79.4	138.4	170.9	-162.1	65	0	0	0	110.8	F440 V442 I446 K462 I464	F440-L444 HydrophobicContact CD1-CD1 3.72Å; F440-L444 HydrophobicContact CD2-CB 4.3Å; F440-L444 HydrophobicContact CD2-CD1 4.05Å; F440-L444 HydrophobicContact CE1-CD1 3.51Å; F440-L444 HydrophobicContact CE1-CD2 4.1Å; F440-L444 HydrophobicContact CE1-CG 4.29Å; F440-L444 HydrophobicContact CE2-CB 3.69Å; F440-L444 HydrophobicContact CE2-CD1 3.82Å; F440-L444 HydrophobicContact CE2-CD2 4.23Å; F440-L444 HydrophobicContact CE2-CG 4.11Å; F440-L444 HydrophobicContact CG-CD1 4.02Å; F440-L444 HydrophobicContact CZ-CB 3.98Å; F440-L444 HydrophobicContact CZ-CD1 3.58Å; F440-L444 HydrophobicContact CZ-CD2 3.63Å; F440-L444 HydrophobicContact CZ-CG 3.91Å; V442-L444 PolarHBondContact O-N 2.87Å; L444-I446 HydrophobicContact CD1-CB 4.49Å; L444-I446 HydrophobicContact CD1-CD1 3.9Å; L444-I446 HydrophobicContact CD1-CG1 3.67Å; L444-I446 HydrophobicContact CD2-CB 4.3Å; L444-I446 HydrophobicContact CD2-CD1 4.07Å; L444-I446 HydrophobicContact CD2-CG1 4.15Å; L444-I446 HydrophobicContact CG-CB 4.28Å; L444-I446 HydrophobicContact CG-CD1 4.34Å; L444-I446 HydrophobicContact CG-CG1 3.98Å; L444-K462 WeakPolarHBondContact CB-O 3.31Å; L444-K462 PolarHBondContact N-O 2.91Å; L444-I464 HydrophobicContact CD2-CB 4.48Å; L444-I464 HydrophobicContact CD2-CG1 3.64Å
445	Q	34.4	Very low	47.3	Very low	84 Å²	84	55.7 Å²	55.7	39%	0.393	27%	0.265	S	S	.	.			trans	-138.2	69.3	149.2	-60.9	173.6	63.5	0	0	108.8	E425 V426 T427 K447	E425-Q445 WeakPolarHBondContact OE1-CB 3.32Å; E425-Q445 PolarHBondContact OE1-NE2 2.83Å; E425-Q445 PolarHBondContact OE2-NE2 2.77Å; V426-Q445 CarbonylContact O-C 3.59Å; T427-Q445 WeakPolarHBondContact CA-O 3.49Å; T427-Q445 VanDerWaalsContact O-O 3.11Å; Q445-K447 VanDerWaalsContact C-N 3.28Å; Q445-K447 HydrophobicContact CB-CG 4.37Å; Q445-K447 VanDerWaalsContact CB-NZ 3.34Å; Q445-K447 WeakPolarHBondContact O-CG 3.39Å; Q445-K447 PolarHBondContact O-N 2.82Å; Q445-K447 PolarHBondContact O-NZ 2.89Å
446	I	45.6	Very low	46.1	Very low	4 Å²	4	58.2 Å²	58.2	2%	0.021	28%	0.281	C	S	.	.			trans	-60.1	102.2	156.4	-72.7	175.9	0	0	0	105.7	V426 T427 L444 E466	V426-I446 PolarHBondContact O-N 2.81Å; T427-I446 WeakPolarHBondContact O-CA 3.41Å; L444-I446 HydrophobicContact CD1-CB 4.49Å; L444-I446 HydrophobicContact CD1-CD1 3.9Å; L444-I446 HydrophobicContact CD1-CG1 3.67Å; L444-I446 HydrophobicContact CD2-CB 4.3Å; L444-I446 HydrophobicContact CD2-CD1 4.07Å; L444-I446 HydrophobicContact CD2-CG1 4.15Å; L444-I446 HydrophobicContact CG-CB 4.28Å; L444-I446 HydrophobicContact CG-CD1 4.34Å; L444-I446 HydrophobicContact CG-CG1 3.98Å; I446-E466 PolarHBondContact O-N 3.07Å
447	K	32.2	Very low	45.7	Very low	79 Å²	79	58 Å²	58	34%	0.343	28%	0.276	S	S	.	.	S	Bend	trans	-81.7	-26.8	178.1	-69.3	162.4	-156.2	73.7	0	109.8	E425 T427 Q445	E425-K447 IonicContact OE1-NZ 3.74Å; E425-K447 PolarHBondContact OE1-NZ 2.94Å; E425-K447 VanDerWaalsContact OE1-NZ 3.12Å; T427-K447 HydrophobicContact CG2-CD 3.98Å; T427-K447 PolarHBondContact O-N 3.3Å; T427-K447 PolarHBondContact OG1-NZ 2.86Å; Q445-K447 VanDerWaalsContact C-N 3.28Å; Q445-K447 HydrophobicContact CB-CG 4.37Å; Q445-K447 VanDerWaalsContact CB-NZ 3.34Å; Q445-K447 WeakPolarHBondContact O-CG 3.39Å; Q445-K447 PolarHBondContact O-N 2.82Å; Q445-K447 PolarHBondContact O-NZ 2.89Å
448	Q	38.2	Very low	44.9	Very low	61 Å²	61	55.1 Å²	55.1	29%	0.285	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	118.9	171.4	-171	172.2	-112.1	0	0	108.8	E428	E428-Q448 PolarHBondContact OE1-NE2 2.73Å
449	S	44.3	Very low	43.9	Very low	1 Å²	1	58.7 Å²	58.7	1%	0.007	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.8	155.7	64.1	0	0	0	0	108.7	T467 Q468 E469	S449-T467 WeakPolarHBondContact OG-CG2 3.38Å; S449-T467 PolarHBondContact OG-OG1 3.28Å; S449-Q468 PolarHBondContact O-N 2.88Å; S449-E469 VanDerWaalsContact CB-OE1 3.31Å; S449-E469 WeakPolarHBondContact CB-OE1 3.4Å; S449-E469 PolarHBondContact OG-OE1 2.89Å
450	R	43.2	Very low	43	Very low	145 Å²	145	57 Å²	57	55%	0.547	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	107.6	-175.6	-176.1	174.7	168.9	-146.3	-15.5	111.6	T429 T431	T429-R450 PolarHBondContact O-N 2.71Å; T431-R450 PolarHBondContact N-O 2.93Å
451	G	41.1	Very low	41.7	Very low	12 Å²	12	63.8 Å²	63.8	12%	0.124	31%	0.313	C	S	.	.			trans	-132.2	151	168.6	0	0	0	0	0	112.2	T431 R453	T431-G451 WeakPolarHBondContact O-CA 2.92Å; G451-R453 PolarHBondContact O-N 2.84Å
452	E	36.6	Very low	41.8	Very low	132 Å²	132	63.6 Å²	63.6	62%	0.617	31%	0.306	S	S	*	.	S	Bend	trans	-74.2	-4	173.4	-60.6	-152.1	141.7	0	0	113.2	E432 K470	E432-E452 WeakPolarHBondContact O-CB 3.38Å; E432-E452 WeakPolarHBondContact O-CG 3.4Å; E432-E452 PolarHBondContact O-N 2.87Å; E432-E452 VanDerWaalsContact O-N 3.08Å; E452-K470 WeakPolarHBondContact O-CD 3.34Å; E452-K470 PolarHBondContact O-NZ 2.97Å
453	R	41.1	Very low	41.7	Very low	140 Å²	140	64.6 Å²	64.6	53%	0.528	31%	0.306	S	S	.	.	S	Bend	trans	-149.5	146.8	179.1	-43.8	-179.6	-157.8	118.2	15.9	112.1	G433 G434 G451	G433-R453 WeakPolarHBondContact O-CB 3.36Å; G433-R453 WeakPolarHBondContact O-CD 3.23Å; G433-R453 WeakPolarHBondContact O-CG 3.41Å; G433-R453 PolarHBondContact O-NH1 3.01Å; G433-R453 VanDerWaalsContact O-NH1 3.12Å; G434-R453 WeakPolarHBondContact CA-O 3.46Å; G451-R453 PolarHBondContact O-N 2.84Å
454	E	42.8	Very low	42.2	Very low	84 Å²	84	62.3 Å²	62.3	39%	0.393	29%	0.291	S	S	.	.			trans	21.9	109.1	153.9	-168.6	163.2	-158.1	0	0	118.7	T473	E454-T473 PolarHBondContact OE1-OG1 2.88Å
455	I	48	Very low	41.9	Very low	7 Å²	7	65 Å²	65	4%	0.036	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	123.4	142.7	-77.5	-178.1	0	0	0	108.4	V435 T458 E469 T473	V435-I455 HydrophobicContact CB-CG1 4.17Å; V435-I455 WeakPolarHBondContact O-CA 3.3Å; I455-T458 HydrophobicContact CD1-CG2 4.49Å; I455-T458 HydrophobicContact CG2-CG2 3.88Å; I455-E469 WeakPolarHBondContact CD1-OE1 3.4Å; I455-E469 WeakPolarHBondContact CD1-OE2 3.34Å; I455-E469 VanDerWaalsContact CG1-OE2 3.31Å; I455-E469 WeakPolarHBondContact CG1-OE2 3.41Å; I455-T473 PolarHBondContact O-N 2.95Å
456	T	41.1	Very low	42.3	Very low	57 Å²	57	64.3 Å²	64.3	35%	0.35	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-44.3	-179.9	-49.7	0	0	0	0	111.6	T436	T436-T456 WeakPolarHBondContact O-CB 3.37Å; T436-T456 PolarHBondContact O-N 3.39Å
457	E	48.2	Very low	42.2	Very low	46 Å²	46	64.5 Å²	64.5	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	120.5	-174.2	-176.7	170.8	-143.6	0	0	112.4	T436 R437 V438 Q459	T436-E457 PolarHBondContact O-N 3.09Å; R437-E457 WeakPolarHBondContact CA-O 3.38Å; R437-E457 HydrophobicContact CG-CB 4.44Å; R437-E457 IonicContact CZ-OE2 2.6Å; R437-E457 IonicContact NE-OE2 3.12Å; R437-E457 PolarHBondContact NE-OE2 3.26Å; R437-E457 IonicContact NH2-OE2 2.57Å; R437-E457 PolarHBondContact NH2-OE2 3.05Å; V438-E457 PolarHBondContact N-O 3.11Å; E457-Q459 HydrophobicContact CG-CG 4.16Å; E457-Q459 PolarHBondContact OE1-NE2 2.92Å
458	T	50.3	Low	42.6	Very low	11 Å²	11	64.8 Å²	64.8	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.6	168.3	27.8	0	0	0	0	111	V438 I455	V438-T458 HydrophobicContact CB-CG2 4.26Å; I455-T458 HydrophobicContact CD1-CG2 4.49Å; I455-T458 HydrophobicContact CG2-CG2 3.88Å
459	Q	46.4	Very low	43.1	Very low	76 Å²	76	62.5 Å²	62.5	36%	0.355	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	123.7	179.6	-61.6	-170.3	14.6	0	0	111.9	V438 F440 E457	V438-Q459 PolarHBondContact O-N 3.12Å; F440-Q459 PolarHBondContact N-O 3.42Å; E457-Q459 HydrophobicContact CG-CG 4.16Å; E457-Q459 PolarHBondContact OE1-NE2 2.92Å
460	G	45.6	Very low	42.7	Very low	21 Å²	21	67.7 Å²	67.7	22%	0.216	32%	0.32	C	S	.	.			trans	174	171.5	167.5	0	0	0	0	0	116.3	F440 K462	F440-G460 VanDerWaalsContact CE2-CA 3.42Å; F440-G460 WeakPolarHBondContact O-CA 3.44Å; G460-K462 PolarHBondContact O-N 2.75Å
461	E	37	Very low	42.4	Very low	154 Å²	154	64.6 Å²	64.6	72%	0.72	31%	0.312	S	S	*	.	S	Bend	trans	-91.2	67.2	-169.6	-68.4	-153.4	-173.3	0	0	115.9
462	K	44.8	Very low	42.6	Very low	79 Å²	79	65.8 Å²	65.8	34%	0.343	32%	0.315	S	S	.	.	S	Bend	trans	110.7	148.7	161.7	-61	178.5	-99.5	62.6	0	117.5	L444 G460 K478	L444-K462 WeakPolarHBondContact CB-O 3.31Å; L444-K462 PolarHBondContact N-O 2.91Å; G460-K462 PolarHBondContact O-N 2.75Å; K462-K478 HydrophobicContact CG-CB 4.38Å; K462-K478 HydrophobicContact CG-CD 4.25Å
463	E	38.3	Very low	42.6	Very low	98 Å²	98	61.5 Å²	61.5	46%	0.458	30%	0.298	S	S	.	.			trans	80.3	67.5	147.1	-156.3	165.8	175.4	0	0	117.6	T465	E463-T465 PolarHBondContact O-N 3.02Å
464	I	45.2	Very low	42.7	Very low	15 Å²	15	58.8 Å²	58.8	8%	0.077	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-60.1	127.3	156.3	-67.4	176.7	0	0	0	109.5	L444 E477 T481	L444-I464 HydrophobicContact CD2-CB 4.48Å; L444-I464 HydrophobicContact CD2-CG1 3.64Å; I464-E477 WeakPolarHBondContact CD1-OE1 3.46Å; I464-E477 WeakPolarHBondContact CG1-OE1 3.33Å; I464-T481 PolarHBondContact O-OG1 2.89Å
465	T	36.3	Very low	42.7	Very low	58 Å²	58	55.3 Å²	55.3	36%	0.356	28%	0.276	S	S	.	.			trans	-93.2	-58.2	175.9	-63.8	0	0	0	0	111.5	E463	E463-T465 PolarHBondContact O-N 3.02Å
466	E	42.8	Very low	42.3	Very low	70 Å²	70	59.8 Å²	59.8	33%	0.327	30%	0.296	S	S	.	.			trans	-148.5	123.5	176.5	-171.9	172	164	0	0	112.8	I446 Q468	I446-E466 PolarHBondContact O-N 3.07Å; E466-Q468 HydrophobicContact CG-CG 4.48Å; E466-Q468 PolarHBondContact OE1-NE2 2.91Å
467	T	42.2	Very low	42.6	Very low	8 Å²	8	57.9 Å²	57.9	5%	0.049	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-126.9	129	174.6	-70	0	0	0	0	109.6	S449 E469 I472	S449-T467 WeakPolarHBondContact OG-CG2 3.38Å; S449-T467 PolarHBondContact OG-OG1 3.28Å; T467-E469 HydrophobicContact CG2-CB 3.89Å; T467-E469 VanDerWaalsContact CG2-CD 3.46Å; T467-E469 HydrophobicContact CG2-CG 3.79Å; T467-E469 WeakPolarHBondContact CG2-OE1 3.44Å; T467-I472 HydrophobicContact CG2-CD1 4.09Å
468	Q	40.3	Very low	42.1	Very low	86 Å²	86	62.1 Å²	62.1	40%	0.402	30%	0.301	S	S	.	.			trans	-117.1	71.8	-178.1	-67.1	-170.5	25.5	0	0	111.3	S449 E466	S449-Q468 PolarHBondContact O-N 2.88Å; E466-Q468 HydrophobicContact CG-CG 4.48Å; E466-Q468 PolarHBondContact OE1-NE2 2.91Å
469	E	49.3	Very low	41.3	Very low	13 Å²	13	66.2 Å²	66.2	6%	0.061	32%	0.319	C	S	.	.			trans	-124.2	167.5	-170	-78.2	169.4	-145.2	0	0	114.1	S449 I455 T467 I472 G485	S449-E469 VanDerWaalsContact CB-OE1 3.31Å; S449-E469 WeakPolarHBondContact CB-OE1 3.4Å; S449-E469 PolarHBondContact OG-OE1 2.89Å; I455-E469 WeakPolarHBondContact CD1-OE1 3.4Å; I455-E469 WeakPolarHBondContact CD1-OE2 3.34Å; I455-E469 VanDerWaalsContact CG1-OE2 3.31Å; I455-E469 WeakPolarHBondContact CG1-OE2 3.41Å; T467-E469 HydrophobicContact CG2-CB 3.89Å; T467-E469 VanDerWaalsContact CG2-CD 3.46Å; T467-E469 HydrophobicContact CG2-CG 3.79Å; T467-E469 WeakPolarHBondContact CG2-OE1 3.44Å; E469-I472 HydrophobicContact CB-CG1 4.44Å; E469-G485 WeakPolarHBondContact O-CA 3.38Å
470	K	37.2	Very low	41.1	Very low	109 Å²	109	62.8 Å²	62.8	47%	0.474	30%	0.304	S	S	.	.	S	Bend	trans	-93.5	-31	-168.9	-177.9	-177.7	169.7	-164.8	0	114	E452 K487	E452-K470 WeakPolarHBondContact O-CD 3.34Å; E452-K470 PolarHBondContact O-NZ 2.97Å; K470-K487 WeakPolarHBondContact O-CB 3.43Å; K470-K487 PolarHBondContact O-N 2.98Å; K470-K487 VanDerWaalsContact O-N 3.12Å
471	E	35.9	Very low	40.6	Very low	81 Å²	81	64.5 Å²	64.5	38%	0.379	31%	0.31	S	S	.	.			trans	-163.7	132.6	-172.7	-166.8	160.7	-179.9	0	0	106.8
472	I	45.2	Very low	40.7	Very low	36 Å²	36	60.2 Å²	60.2	19%	0.185	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.3	-178.3	-58.8	175.1	0	0	0	108	T467 E469 T475	T467-I472 HydrophobicContact CG2-CD1 4.09Å; E469-I472 HydrophobicContact CB-CG1 4.44Å; I472-T475 WeakPolarHBondContact CG2-OG1 3.48Å
473	T	36.3	Very low	40.4	Very low	42 Å²	42	57.7 Å²	57.7	26%	0.258	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-50.4	-161.1	-57.1	0	0	0	0	113.4	E454 I455 T490	E454-T473 PolarHBondContact OE1-OG1 2.88Å; I455-T473 PolarHBondContact O-N 2.95Å; T473-T490 PolarHBondContact O-OG1 2.98Å
474	E	43.5	Very low	40.3	Very low	84 Å²	84	56.5 Å²	56.5	39%	0.393	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.1	173.8	-170.7	174.3	155.5	0	0	112.1	Q476	E474-Q476 PolarHBondContact OE1-NE2 2.83Å
475	T	43.2	Very low	39.7	Very low	11 Å²	11	57.2 Å²	57.2	7%	0.067	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	129	175.1	-43.7	0	0	0	0	110.1	I472 E477	I472-T475 WeakPolarHBondContact CG2-OG1 3.48Å; T475-E477 HydrophobicContact CG2-CB 4.12Å; T475-E477 HydrophobicContact CG2-CG 3.99Å; T475-E477 WeakPolarHBondContact CG2-OE1 3.42Å
476	Q	39.9	Very low	39.7	Very low	101 Å²	101	62.9 Å²	62.9	47%	0.472	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	94.4	-180	-62.2	-173.4	27.3	0	0	110	E474	E474-Q476 PolarHBondContact OE1-NE2 2.83Å
477	E	47.3	Very low	39.3	Very low	16 Å²	16	66.6 Å²	66.6	8%	0.075	32%	0.324	C	S	.	.			trans	-143.1	171.7	-162.8	-102.5	-173.2	-118.8	0	0	115	I464 T475 I480	I464-E477 WeakPolarHBondContact CD1-OE1 3.46Å; I464-E477 WeakPolarHBondContact CG1-OE1 3.33Å; T475-E477 HydrophobicContact CG2-CB 4.12Å; T475-E477 HydrophobicContact CG2-CG 3.99Å; T475-E477 WeakPolarHBondContact CG2-OE1 3.42Å; E477-I480 HydrophobicContact CB-CD1 4.13Å; E477-I480 HydrophobicContact CB-CG1 4.45Å; E477-I480 WeakPolarHBondContact OE2-CG1 3.39Å
478	K	37.2	Very low	39	Very low	136 Å²	136	70.1 Å²	70.1	59%	0.591	34%	0.339	S	S	*	.	S	Bend	trans	-111.4	-36.6	-171.8	-167.6	168.1	-172.3	163.3	0	114.5	K462	K462-K478 HydrophobicContact CG-CB 4.38Å; K462-K478 HydrophobicContact CG-CD 4.25Å
479	E	34.2	Very low	38.9	Very low	96 Å²	96	69 Å²	69	45%	0.449	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	120.7	-170.6	-169	164.1	-178	0	0	108
480	I	41.2	Very low	38.1	Very low	5 Å²	5	71.2 Å²	71.2	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.1	-176.9	-75.1	167.3	0	0	0	109.1	E477 T483 K495 E496 T498	E477-I480 HydrophobicContact CB-CD1 4.13Å; E477-I480 HydrophobicContact CB-CG1 4.45Å; E477-I480 WeakPolarHBondContact OE2-CG1 3.39Å; I480-T483 HydrophobicContact CG2-CG2 3.88Å; I480-K495 HydrophobicContact CD1-CD 4.45Å; I480-K495 VanDerWaalsContact CD1-CE 3.48Å; I480-E496 PolarHBondContact N-O 2.91Å; I480-T498 PolarHBondContact O-OG1 2.68Å
481	T	35	Very low	38.3	Very low	56 Å²	56	70.6 Å²	70.6	34%	0.344	35%	0.349	S	S	.	.			trans	-86.5	-60.8	-161.1	-35.8	0	0	0	0	112.7	I464 T498 E499	I464-T481 PolarHBondContact O-OG1 2.89Å; T481-T498 WeakPolarHBondContact CA-OG1 3.41Å; T481-T498 PolarHBondContact O-OG1 2.91Å; T481-E499 PolarHBondContact O-N 3.32Å
482	E	39.4	Very low	38.3	Very low	65 Å²	65	68 Å²	68	30%	0.304	34%	0.339	S	S	.	.			trans	-139.5	142.1	173.9	-174.2	165.6	170.6	0	0	110.3	Q484	E482-Q484 PolarHBondContact OE1-NE2 2.9Å
483	T	38.8	Very low	37.7	Very low	25 Å²	25	71.4 Å²	71.4	15%	0.153	35%	0.354	C	S	.	.			trans	-142.1	130.9	174.5	38.6	0	0	0	0	110.1	I480 R501	I480-T483 HydrophobicContact CG2-CG2 3.88Å; T483-R501 PolarHBondContact O-N 3.01Å
484	Q	35.1	Very low	37.6	Very low	74 Å²	74	77 Å²	77	35%	0.346	38%	0.377	S	S	.	.			trans	-127.1	96.8	178.8	-63.1	-166.9	38	0	0	109.9	E482	E482-Q484 PolarHBondContact OE1-NE2 2.9Å
485	G	33.7	Very low	37.7	Very low	29 Å²	29	76.1 Å²	76.1	30%	0.299	37%	0.372	S	S	.	.			trans	-140.1	152.6	-179.3	0	0	0	0	0	114	E469	E469-G485 WeakPolarHBondContact O-CA 3.38Å
486	E	35.5	Very low	37.2	Very low	177 Å²	177	80.3 Å²	80.3	83%	0.827	39%	0.391	S	S	*	.	S	Bend	trans	-104.3	21	-173.6	-71.4	-154.2	157.4	0	0	115.2
487	K	35.4	Very low	37.1	Very low	148 Å²	148	77.8 Å²	77.8	64%	0.643	38%	0.38	S	S	*	.	S	Bend	trans	-166.3	168.3	156.6	-110.3	146.6	-167.6	173.9	0	116	K470	K470-K487 WeakPolarHBondContact O-CB 3.43Å; K470-K487 PolarHBondContact O-N 2.98Å; K470-K487 VanDerWaalsContact O-N 3.12Å
488	E	35.3	Very low	36.5	Very low	82 Å²	82	80.2 Å²	80.2	38%	0.383	40%	0.396	S	S	.	.			trans	6.9	127.6	164.4	-148.7	154.8	167.3	0	0	118.5
489	I	37.5	Very low	36.5	Very low	64 Å²	64	78.7 Å²	78.7	33%	0.328	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.1	168.2	-58.7	171.8	0	0	0	106.6
490	T	34.1	Very low	36.4	Very low	59 Å²	59	76.6 Å²	76.6	36%	0.362	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-44.8	-168	24.5	0	0	0	0	114.7	T473	T473-T490 PolarHBondContact O-OG1 2.98Å
491	E	40	Very low	35.9	Very low	95 Å²	95	84.8 Å²	84.8	44%	0.444	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147.4	174.6	-164.4	162.3	161	0	0	111.7	Q493	E491-Q493 PolarHBondContact OE1-NE2 3.29Å
492	T	35.8	Very low	35.6	Very low	27 Å²	27	84.1 Å²	84.1	17%	0.166	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	132.6	165.9	-36.4	0	0	0	0	108.6	K495	T492-K495 HydrophobicContact CG2-CD 3.97Å
493	Q	32.8	Very low	35.1	Very low	108 Å²	108	90.2 Å²	90.2	51%	0.505	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.7	179.2	-61.4	-165.9	24	0	0	110.8	E491	E491-Q493 PolarHBondContact OE1-NE2 3.29Å
494	E	35.6	Very low	34.9	Very low	158 Å²	158	95.8 Å²	95.8	74%	0.738	47%	0.467	S	S	*	.	S	Bend	trans	61.5	142.5	-164.3	-54.2	-160.9	175.6	0	0	114
495	K	44.6	Very low	34.6	Very low	66 Å²	66	99.2 Å²	99.2	29%	0.287	48%	0.483	S	S	.	.			trans	-173.8	126.8	178.7	-127.6	170	165.3	136.2	0	113.3	I480 T492 I497	I480-K495 HydrophobicContact CD1-CD 4.45Å; I480-K495 VanDerWaalsContact CD1-CE 3.48Å; T492-K495 HydrophobicContact CG2-CD 3.97Å; K495-I497 HydrophobicContact CB-CG1 4.04Å; K495-I497 HydrophobicContact CD-CD1 3.79Å; K495-I497 HydrophobicContact CD-CG1 3.71Å; K495-I497 HydrophobicContact CG-CD1 4.4Å; K495-I497 HydrophobicContact CG-CG1 3.8Å
496	E	32.9	Very low	34.6	Very low	100 Å²	100	102.8 Å²	102.8	47%	0.467	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	141.7	139.5	-172.5	157.3	172.7	0	0	107.8	I480	I480-E496 PolarHBondContact N-O 2.91Å
497	I	37.7	Very low	34.4	Very low	48 Å²	48	98.2 Å²	98.2	25%	0.246	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.3	-179.2	-29.3	177.9	0	0	0	109.1	K495 T500	K495-I497 HydrophobicContact CB-CG1 4.04Å; K495-I497 HydrophobicContact CD-CD1 3.79Å; K495-I497 HydrophobicContact CD-CG1 3.71Å; K495-I497 HydrophobicContact CG-CD1 4.4Å; K495-I497 HydrophobicContact CG-CG1 3.8Å; I497-T500 HydrophobicContact CG2-CG2 3.84Å
498	T	35.5	Very low	34.2	Very low	67 Å²	67	98.4 Å²	98.4	41%	0.411	48%	0.481	S	S	.	.			trans	-92.8	-53.5	179.7	34.1	0	0	0	0	113.5	I480 T481	I480-T498 PolarHBondContact O-OG1 2.68Å; T481-T498 WeakPolarHBondContact CA-OG1 3.41Å; T481-T498 PolarHBondContact O-OG1 2.91Å
499	E	36.5	Very low	33.8	Very low	104 Å²	104	99 Å²	99	49%	0.486	49%	0.49	S	S	.	.			trans	-141.6	145.4	177.1	-165.3	150	-178.6	0	0	112.9	T481	T481-E499 PolarHBondContact O-N 3.32Å
500	T	32.3	Very low	33.4	Very low	52 Å²	52	102.6 Å²	102.6	32%	0.319	51%	0.506	S	S	.	.			trans	-149.3	123.8	179.4	40.2	0	0	0	0	110.9	I497 R504	I497-T500 HydrophobicContact CG2-CG2 3.84Å; T500-R504 PolarHBondContact O-NH2 2.67Å; T500-R504 VanDerWaalsContact O-NH2 3.15Å; T500-R504 PolarHBondContact OG1-NH2 3.13Å
501	R	30.7	Very low	33.2	Very low	176 Å²	176	106.4 Å²	106.4	66%	0.664	52%	0.518	S	S	*	.			trans	-133.1	87.3	-170.1	-173.7	176.1	170.8	-172	-10.5	112.7	T483	T483-R501 PolarHBondContact O-N 3.01Å
502	G	29.1	Very low	32.7	Very low	43 Å²	43	111 Å²	111	44%	0.443	54%	0.539	S	S	.	.	S	Bend	trans	-163.7	169.8	175.8	0	0	0	0	0	112.2	R504	G502-R504 PolarHBondContact O-N 3.22Å
503	E	29.4	Very low	32.5	Very low	193 Å²	193	114.5 Å²	114.5	90%	0.902	56%	0.561	S	S	*	*			trans	-77.7	111.7	174.1	-64.5	-162.4	161.2	0	0	109.9
504	R	33	Very low	32.3	Very low	141 Å²	141	116.8 Å²	116.8	53%	0.532	57%	0.571	S	S	.	*			trans	-93.6	127.1	-165.4	-57.6	179.5	-170.9	161.1	1.6	114.4	T500 G502	T500-R504 PolarHBondContact O-NH2 2.67Å; T500-R504 VanDerWaalsContact O-NH2 3.15Å; T500-R504 PolarHBondContact OG1-NH2 3.13Å; G502-R504 PolarHBondContact O-N 3.22Å
505	E	28.8	Very low	32	Very low	147 Å²	147	113.8 Å²	113.8	69%	0.687	56%	0.559	S	S	*	*			trans	-118.5	139.1	140.5	-168.5	149.8	-161.9	0	0	107.2
506	I	34.7	Very low	31.4	Very low	103 Å²	103	114.8 Å²	114.8	53%	0.528	57%	0.571	S	S	.	*	B	Isolated β-bridge	trans	-136.5	123.2	-177.6	-59.4	173.6	0	0	0	106.6
507	T	30.1	Very low	31.3	Very low	81 Å²	81	117.8 Å²	117.8	50%	0.497	59%	0.585	S	S	.	*			trans	-96.4	-39	-164.7	34.5	0	0	0	0	114.2
508	E	32.8	Very low	30.8	Very low	152 Å²	152	119.5 Å²	119.5	71%	0.71	60%	0.598	S	S	*	*			trans	-146.1	156.4	169.3	-158.5	150.7	169.8	0	0	113.2
509	T	27.1	Very low	30.4	Very low	94 Å²	94	124.4 Å²	124.4	58%	0.577	62%	0.616	S	S	*	*			trans	-160	124.2	176.6	-47.3	0	0	0	0	110.8
510	Q	29.1	Very low	29.9	Very low	141 Å²	141	126.9 Å²	126.9	66%	0.659	63%	0.628	S	S	*	*			trans	-95.7	141.7	171.2	-58.5	-170.3	59.1	0	0	109.9
511	K	29.5	Very low	29.5	Very low	138 Å²	138	131.9 Å²	131.9	60%	0.6	65%	0.653	S	S	*	*			trans	-146.2	117.4	-151.7	-155.3	-174.8	-156.1	-151.8	0	117.5	T513	K511-T513 HydrophobicContact CD-CG2 3.59Å; K511-T513 HydrophobicContact CG-CG2 3.67Å
512	E	28.7	Very low	29.4	Very low	192 Å²	192	132.5 Å²	132.5	90%	0.897	66%	0.663	S	S	*	*			trans	-107.9	170.9	139.3	-63.7	-152	132.5	0	0	108.9
513	T	30.7	Very low	29.1	Very low	101 Å²	101	140.6 Å²	140.6	62%	0.62	68%	0.68	S	S	*	*			trans	-143.4	131	-157	62	0	0	0	0	118.2	K511	K511-T513 HydrophobicContact CD-CG2 3.59Å; K511-T513 HydrophobicContact CG-CG2 3.67Å
514	E	28.6	Very low	28.8	Very low	156 Å²	156	137.9 Å²	137.9	73%	0.729	68%	0.677	S	S	*	*				-141.5	160.5	118.1	-161.9	137.4	-156.1	0	0	108.6
515	I	31.3	Very low	28.4	Very low	94 Å²	94	140 Å²	140	48%	0.482	69%	0.693	S	S	.	*			trans	-146.4	128.9	176.8	-58.9	177.5	0	0	0	107.2
516	T	30.6	Very low	28	Very low	88 Å²	88	139.2 Å²	139.2	54%	0.54	70%	0.699	S	S	.	*			trans	-112.9	111	-173.1	-54.4	0	0	0	0	112.3
517	E	31.7	Very low	27.6	Very low	162 Å²	162	143.7 Å²	143.7	76%	0.757	72%	0.717	S	S	*	*			trans	67	154	175.1	-159.8	144.5	-167.8	0	0	116.3
518	T	26.1	Very low	27.4	Very low	85 Å²	85	148.7 Å²	148.7	52%	0.521	73%	0.732	S	S	.	*			trans	-166.8	127.1	177.8	-33.5	0	0	0	0	108.9
519	Q	27.5	Very low	27	Very low	170 Å²	170	150 Å²	150	79%	0.794	74%	0.738	S	S	*	*			trans	-96.4	102.9	178.4	-61.5	-165.9	44.4	0	0	111.2
520	E	25.6	Very low	26.9	Very low	156 Å²	156	150.6 Å²	150.6	73%	0.729	74%	0.742	S	S	*	*			trans	-86.9	130.7	-177.2	-174.8	-168.9	-162	0	0	112.2
521	N	25.4	Very low	26.8	Very low	157 Å²	157	152.2 Å²	152.2	84%	0.84	75%	0.749	S	S	*	*			trans	-123.6	119.2	166.9	-98.9	-32.5	0	0	0	111.8
522	E	27.4	Very low	26.5	Very low	189 Å²	189	153.4 Å²	153.4	88%	0.883	76%	0.76	S	S	*	*			trans	49.9	73.8	164.7	-54.5	-143.6	130.4	0	0	120.5
523	R	24.1	Very low	26.4	Very low	212 Å²	212	149.4 Å²	149.4	80%	0.8	75%	0.749	S	S	*	*			trans	-0	144.5	143	-76.5	177.2	156.2	-157.8	-6.8	119.6
524	T	21.4	Very low	26.1	Very low	136 Å²	136	153.1 Å²	153.1	83%	0.834	76%	0.76	S	S	*	*				-154	132.3	115	-4.6	0	0	0	0	117.4
525	E	24.7	Very low	25.9	Very low	187 Å²	187	155.1 Å²	155.1	87%	0.874	77%	0.766	S	S	*	*			trans	59.6	166.3	164.7	-55.3	-141.2	126.7	0	0	120
526	T	21.6	Very low	25.5	Very low	130 Å²	130	156.3 Å²	156.3	80%	0.798	78%	0.777	S	S	*	*			trans	-154.8	138.9	-161	-50.4	0	0	0	0	111.2
527	Q	24.6	Very low	25	Very low	197 Å²	197	158 Å²	158	92%	0.921	79%	0.788	S	S	*	*			trans	-129.1	165.3	160.1	-66.6	-164	63.6	0	0	110.9
528	K	26.1	Very low	24.7	Very low	185 Å²	185	157.7 Å²	157.7	80%	0.804	79%	0.786	S	S	*	*			trans	-160.9	117.5	-152.9	175	-147.4	174.4	-176.1	0	113.5
529	E	25.6	Very low	24.5	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	79%	0.791	S	S	*	*			trans	-143.1	107.2	157.6	-97.3	-175.7	143.7	0	0	109
530	T	24.6	Very low	24.8	Very low	106 Å²	106	155.9 Å²	155.9	65%	0.65	79%	0.789	S	S	*	*				84.9	94.2	94.5	53.3	0	0	0	0	115.7
531	E	27.2	Very low	24.6	Very low	174 Å²	174	154.1 Å²	154.1	81%	0.813	79%	0.794	S	S	*	*			trans	-48.4	135.7	162.3	173.7	-173.9	-144.5	0	0	114.4
532	I	23.7	Very low	24.4	Very low	163 Å²	163	150.8 Å²	150.8	84%	0.836	80%	0.797	S	S	*	*			trans	-137.2	97.7	161.4	-54.5	-179.9	0	0	0	109.2
533	T	25.2	Very low	24.3	Very low	108 Å²	108	145.7 Å²	145.7	66%	0.663	80%	0.795	S	S	*	*			trans	-91.2	109.7	171.7	-18.5	0	0	0	0	110.2
534	E	24.7	Very low	24.2	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	80%	0.795	S	S	*	*			trans	-88.9	127.7	167.6	-172.3	161.2	-146.1	0	0	110.3	V536	E534-V536 HydrophobicContact CG-CG2 4.36Å
535	K	25.4	Very low	24.3	Very low	197 Å²	197	144 Å²	144	86%	0.857	79%	0.79	S	S	*	*			trans	-137.6	106.6	-172.6	-159.2	168.2	-169.7	164.7	0	111.6
536	V	21.5	Very low	24.3	Very low	119 Å²	119	140.1 Å²	140.1	72%	0.721	78%	0.779	S	S	*	*			trans	-147.9	145.9	-179.2	-164.2	0	0	0	0	106.1	E534	E534-V536 HydrophobicContact CG-CG2 4.36Å
537	T	21.3	Very low	24.5	Very low	125 Å²	125	142 Å²	142	77%	0.767	78%	0.779	S	S	*	*			cis	-111.9	-179.2	12.3	64.2	0	0	0	0	110.9
538	E	24.9	Very low	24.4	Very low	155 Å²	155	136.9 Å²	136.9	72%	0.724	76%	0.761	S	S	*	*			cis	-146.6	-162.6	-5.6	-136.8	-80.8	72.9	0	0	107.7
539	T	22.9	Very low	24.4	Very low	102 Å²	102	135.9 Å²	135.9	63%	0.626	76%	0.759	S	S	*	*			trans	-122.1	173	-174.1	68.8	0	0	0	0	110.3
540	P	32	Very low	24.5	Very low	114 Å²	114	134.9 Å²	134.9	74%	0.74	75%	0.754	S	S	*	*				-150.3	142.9	78.8	36.5	-16.9	0	0	0	116.3
541	S	21.9	Very low	24.6	Very low	119 Å²	119	135.8 Å²	135.8	83%	0.832	75%	0.751	S	S	*	*				162.7	137.4	105.6	54	0	0	0	0	115
542	G	21.9	Very low	24.6	Very low	87 Å²	87	136.2 Å²	136.2	90%	0.897	75%	0.75	S	S	*	*			trans	81.4	106.2	151.3	0	0	0	0	0	118.6
543	G	24.6	Very low	24.6	Very low	82 Å²	82	132.2 Å²	132.2	85%	0.845	75%	0.749	S	S	*	*			trans	166.8	69.6	168.9	0	0	0	0	0	116.7
544	E	22.7	Very low	24.8	Very low	171 Å²	171	134.9 Å²	134.9	80%	0.799	76%	0.758	S	S	*	*			trans	-14.3	142	165.6	-80.6	-179.1	106.2	0	0	121.2
545	I	24.1	Very low	24.7	Very low	142 Å²	142	132.6 Å²	132.6	73%	0.728	76%	0.756	S	S	*	*			trans	61.6	148	144.9	72.9	174.8	0	0	0	120
546	T	23.7	Very low	24.8	Very low	106 Å²	106	131.3 Å²	131.3	65%	0.65	75%	0.753	S	S	*	*			cis	-168.2	151.1	-4.5	17.3	0	0	0	0	109.8
547	E	25.7	Very low	24.9	Very low	170 Å²	170	130.3 Å²	130.3	79%	0.794	75%	0.747	S	S	*	*			trans	61.8	153.7	148	-73.6	-151.4	78.8	0	0	119.8
548	T	23.5	Very low	25	Very low	88 Å²	88	132.8 Å²	132.8	54%	0.54	75%	0.75	S	S	.	*			cis	-158	144	-12.7	-116.4	0	0	0	0	110.2
549	Q	26.3	Very low	24.9	Very low	165 Å²	165	133.6 Å²	133.6	77%	0.771	75%	0.751	S	S	*	*			trans	19.3	141.8	152.9	-49.3	156.2	70.8	0	0	121.5
550	Q	27.3	Very low	25.2	Very low	160 Å²	160	135.7 Å²	135.7	75%	0.748	75%	0.754	S	S	*	*				153	103.5	103.4	-164.3	160.3	22.2	0	0	111.2
551	E	26.7	Very low	25	Very low	124 Å²	124	138.2 Å²	138.2	58%	0.579	75%	0.753	S	S	*	*				90.9	130.3	73.8	-163.9	-159.8	-175.6	0	0	115
552	K	27	Very low	25.1	Very low	184 Å²	184	139.1 Å²	139.1	80%	0.8	75%	0.745	S	S	*	*			trans	67.6	144.4	159.8	-85.6	162.4	-176.4	149.1	0	120.7
553	G	23.9	Very low	25.3	Very low	78 Å²	78	141.6 Å²	141.6	80%	0.804	74%	0.736	S	S	*	*			trans	166.9	39.1	161.6	0	0	0	0	0	119.8
554	I	29.3	Very low	25.2	Very low	165 Å²	165	144.5 Å²	144.5	85%	0.846	74%	0.737	S	S	*	*			trans	-82.7	133.8	173.6	-33.9	172.4	0	0	0	110.5
555	T	23.2	Very low	25.4	Very low	132 Å²	132	144.8 Å²	144.8	81%	0.81	74%	0.738	S	S	*	*			trans	165.9	103.8	132.2	43.4	0	0	0	0	114.3
556	E	26.6	Very low	25.4	Very low	170 Å²	170	143.5 Å²	143.5	79%	0.794	74%	0.738	S	S	*	*				36.8	138.5	119.6	-124.5	-156.8	109.7	0	0	126
557	T	22.7	Very low	25.7	Very low	98 Å²	98	146.3 Å²	146.3	60%	0.601	74%	0.743	S	S	*	*			trans	80.3	136.1	138.9	20.6	0	0	0	0	127.8
558	Q	24.1	Very low	25.6	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	74%	0.738	S	S	*	*			trans	73.5	137.9	157.2	-61.6	176.3	35.8	0	0	118.9
559	K	23.8	Very low	25.7	Very low	172 Å²	172	145.1 Å²	145.1	75%	0.748	75%	0.752	S	S	*	*				-170.3	169.6	52.5	-170.9	173.6	175.2	55.3	0	114
560	E	29.1	Very low	25.9	Very low	145 Å²	145	145.3 Å²	145.3	68%	0.678	76%	0.758	S	S	*	*			trans	-74.7	154.4	-179.6	-23.2	112.6	96.4	0	0	116.7
561	K	26.7	Very low	25.8	Very low	167 Å²	167	146.4 Å²	146.4	73%	0.726	76%	0.763	S	S	*	*				-179	123.1	125.2	-115.8	-171.6	164.8	-75.5	0	118.4
562	E	24.3	Very low	26.1	Very low	139 Å²	139	149 Å²	149	65%	0.65	77%	0.772	S	S	*	*				33	112.6	119.2	-157.1	-174.9	152.3	0	0	123.9
563	I	26.3	Very low	26	Very low	139 Å²	139	146.9 Å²	146.9	71%	0.713	78%	0.775	S	S	*	*			trans	42.3	128.4	134.1	-34	165.7	0	0	0	122
564	T	21.6	Very low	25.9	Very low	142 Å²	142	147.1 Å²	147.1	87%	0.871	78%	0.777	S	S	*	*				166.2	175.2	123.3	37.8	0	0	0	0	114.7
565	E	27.6	Very low	25.7	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	77%	0.774	S	S	*	*			trans	-114.8	179.6	-150.2	-48.5	168.9	114.6	0	0	117.2
566	T	24.7	Very low	25.7	Very low	116 Å²	116	142.4 Å²	142.4	71%	0.712	78%	0.776	S	S	*	*			trans	110.2	151.6	141.2	-23.3	0	0	0	0	120.6
567	E	29.9	Very low	26.4	Very low	165 Å²	165	140.3 Å²	140.3	77%	0.771	78%	0.778	S	S	*	*			trans	91.4	141.1	163.3	-59.9	-79.9	107.6	0	0	118.6
568	V	23.8	Very low	26.6	Very low	111 Å²	111	140.2 Å²	140.2	67%	0.673	78%	0.781	S	S	*	*			cis	-175.1	146.3	-32.2	120.7	0	0	0	0	109.5
569	S	24.3	Very low	26.7	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	78%	0.781	S	S	*	*			trans	178.9	166.5	148.6	-87.4	0	0	0	0	115.5
570	L	30.4	Very low	26.8	Very low	168 Å²	168	134.3 Å²	134.3	88%	0.88	78%	0.775	S	S	*	*			trans	-135.2	162.7	-172.3	-75.8	150.5	0	0	0	111.9
571	E	26.5	Very low	26.7	Very low	184 Å²	184	134.7 Å²	134.7	86%	0.86	78%	0.776	S	S	*	*			trans	-163.2	178.8	144.2	-104.9	-53	151.9	0	0	110.7
572	K	32.3	Very low	26.8	Very low	178 Å²	178	134.5 Å²	134.5	77%	0.774	78%	0.775	S	S	*	*			trans	-142.8	166.6	-148.8	-160.9	172.7	-179.3	175.1	0	118.6
573	T	25.2	Very low	26.9	Very low	140 Å²	140	133.2 Å²	133.2	86%	0.859	78%	0.782	S	S	*	*			trans	88.8	144.3	165.6	75.2	0	0	0	0	117.4
574	G	22.5	Very low	26.9	Very low	82 Å²	82	135.2 Å²	135.2	85%	0.845	79%	0.786	S	S	*	*			cis	166	136.8	-13.1	0	0	0	0	0	114.3
575	G	24.2	Very low	27.2	Very low	76 Å²	76	134.9 Å²	134.9	78%	0.784	78%	0.779	S	S	*	*			trans	164.1	144.8	173.8	0	0	0	0	0	115.5
576	S	23.9	Very low	27.3	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	78%	0.775	S	S	*	*			trans	-156.5	160.1	173.6	-41.5	0	0	0	0	107.6
577	P	41.3	Very low	27.5	Very low	127 Å²	127	133 Å²	133	83%	0.825	78%	0.784	S	S	*	*				-131.7	-167	51	38.3	-16.8	0	0	0	111.9
578	S	25.7	Very low	27.7	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	79%	0.786	S	S	*	*			cis	-165.9	140.9	25.2	66.7	0	0	0	0	115.2
579	V	26.4	Very low	28	Very low	137 Å²	137	138.5 Å²	138.5	83%	0.83	80%	0.799	S	S	*	*			trans	37.7	147.2	150.4	-75.8	0	0	0	0	122.1
580	S	26.2	Very low	28.1	Very low	88 Å²	88	136.1 Å²	136.1	62%	0.615	79%	0.793	S	S	*	*			cis	-172.8	142.6	0.1	41.5	0	0	0	0	112.5
581	E	27.3	Very low	28.2	Very low	153 Å²	153	138.4 Å²	138.4	72%	0.715	80%	0.796	S	S	*	*			trans	60.1	154.3	138.7	-64.2	-168.5	132.2	0	0	121.1
582	K	28.1	Very low	28.3	Very low	162 Å²	162	137.9 Å²	137.9	70%	0.704	79%	0.794	S	S	*	*			cis	-172.7	169	-26	-111.3	172.6	-167.8	159.4	0	108.2
583	S	27.3	Very low	28.2	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	80%	0.795	S	S	*	*			trans	66.9	137.3	169.4	23.8	0	0	0	0	116.1
584	F	25.6	Very low	28.3	Very low	181 Å²	181	134.8 Å²	134.8	79%	0.794	79%	0.79	S	S	*	*			cis	83.1	100.2	33.4	-165.2	-73.1	0	0	0	113.3
585	D	27.2	Very low	28.7	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	79%	0.786	S	S	*	*				-169.2	178.5	105.6	-139.9	-39.2	0	0	0	111.7
586	S	29.7	Very low	29	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	78%	0.781	S	S	*	*			trans	-97.8	145.5	-177.8	-56.9	0	0	0	0	114.3
587	V	30	Very low	29.4	Very low	146 Å²	146	137.5 Å²	137.5	89%	0.885	77%	0.771	S	S	*	*			trans	-135.6	147	163.5	178.3	0	0	0	0	109.4
588	K	33.8	Very low	28.6	Very low	190 Å²	190	139.8 Å²	139.8	83%	0.826	77%	0.769	S	S	*	*			trans	-104.1	176.9	177.1	-83.8	-171	174	-173.9	0	111.2
589	E	29.9	Very low	29.1	Very low	201 Å²	201	144.9 Å²	144.9	94%	0.939	78%	0.775	S	S	*	*			trans	83.9	132.3	179.4	-52.5	175	-172.5	0	0	113.2
590	G	27.1	Very low	29.1	Very low	71 Å²	71	143.7 Å²	143.7	73%	0.732	77%	0.771	S	S	*	*			cis	174.6	-177.7	-6.7	0	0	0	0	0	113.8
591	K	31.3	Very low	29.3	Very low	216 Å²	216	148 Å²	148	94%	0.939	78%	0.782	S	S	*	*			trans	78.3	139.1	176.2	-143.7	175.4	-174.2	-173.7	0	116.1
592	Q	29.6	Very low	29.5	Very low	173 Å²	173	148 Å²	148	81%	0.808	79%	0.786	S	S	*	*			trans	-105.3	160.3	178.3	-75	-177.2	-11.6	0	0	111.6
593	V	29.6	Very low	29.8	Very low	133 Å²	133	149.2 Å²	149.2	81%	0.806	79%	0.794	S	S	*	*			trans	8.2	131.6	135.6	-169.3	0	0	0	0	117
594	T	26.9	Very low	30.2	Very low	121 Å²	121	152.8 Å²	152.8	74%	0.742	80%	0.799	S	S	*	*			trans	-132.6	110.4	155	44.3	0	0	0	0	110.1
595	S	30.7	Very low	30.3	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	80%	0.804	S	S	*	*			trans	-67.7	144.5	154.2	170.2	0	0	0	0	108.9
596	I	31.6	Very low	30.8	Very low	133 Å²	133	150 Å²	150	68%	0.682	81%	0.811	S	S	*	*			trans	-135.8	101.9	168.3	-60	-177.1	0	0	0	108.4	F598	I596-F598 HydrophobicContact CG2-CD2 4.15Å
597	S	31.1	Very low	31.1	Very low	94 Å²	94	155.8 Å²	155.8	66%	0.657	82%	0.816	S	S	*	*			trans	-69.1	142.4	156.5	53.1	0	0	0	0	109.9
598	F	26.1	Very low	31.6	Very low	176 Å²	176	154.4 Å²	154.4	77%	0.772	81%	0.81	S	S	*	*			trans	-114.2	105.4	173.3	-134.6	-89.7	0	0	0	111.9	I596	I596-F598 HydrophobicContact CG2-CD2 4.15Å
599	Y	35.5	Very low	31.9	Very low	203 Å²	203	154.6 Å²	154.6	80%	0.796	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-81.9	131.6	153.8	-82.7	-95.8	0	0	0	107.6
600	C	27.1	Very low	32.5	Very low	112 Å²	112	153.9 Å²	153.9	76%	0.757	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-84.2	139.6	160.7	-75.2	0	0	0	0	109.8
601	H	29.7	Very low	33.7	Very low	179 Å²	179	159.8 Å²	159.8	83%	0.829	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-100.9	145.1	169.7	-94.2	33.2	0	0	0	109.6
602	N	32.5	Very low	34.7	Very low	152 Å²	152	157.4 Å²	157.4	81%	0.813	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.2	142.4	154.9	-70.7	-17.3	0	0	0	109.2
603	E	33.2	Very low	35.7	Very low	187 Å²	187	157 Å²	157	87%	0.874	82%	0.815	S	S	*	*				178.2	168	118.6	-97.2	174	-173.1	0	0	111.7
604	E	36.6	Very low	36.8	Very low	188 Å²	188	157.9 Å²	157.9	88%	0.879	81%	0.814	S	S	*	*			trans	62.8	79.6	173.7	-60.3	-159.5	125.1	0	0	119.3
605	C	26.8	Very low	37.9	Very low	134 Å²	134	159.9 Å²	159.9	91%	0.905	82%	0.819	S	S	*	*			trans	-142.6	64.6	137.2	-167.9	0	0	0	0	111.9
606	S	38.7	Very low	39.2	Very low	125 Å²	125	162.4 Å²	162.4	87%	0.874	82%	0.824	S	S	*	*			trans	-107.2	94.5	179.6	-56.4	0	0	0	0	111.9
607	R	35.8	Very low	40.6	Very low	229 Å²	229	161.4 Å²	161.4	86%	0.864	82%	0.818	S	S	*	*			trans	-153.9	128.7	163.7	-169.9	171.4	-179.3	158.5	-0.4	110.9
608	P	39.5	Very low	42.1	Very low	116 Å²	116	160.9 Å²	160.9	75%	0.753	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.8	140.1	172.4	30.1	-34	0	0	0	110.5
609	Q	41	Very low	43.9	Very low	194 Å²	194	159.8 Å²	159.8	91%	0.907	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.6	162.2	152.8	-80.6	-179.6	-122	0	0	109.1
610	E	42.9	Very low	45.6	Very low	186 Å²	186	157.5 Å²	157.5	87%	0.869	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-92.3	155.8	-155.7	-66.5	165.1	150.5	0	0	112.2	E612	E610-E612 VanDerWaalsContact C-N 3.28Å; E610-E612 PolarHBondContact O-N 2.95Å
611	E	51	Low	48.1	Very low	195 Å²	195	154.7 Å²	154.7	91%	0.911	79%	0.793	S	S	*	*	S	Bend	trans	-78.9	62.7	-169.4	-64.1	171.3	-165.7	0	0	113.1
612	E	51.8	Low	50.3	Low	166 Å²	166	151.1 Å²	151.1	78%	0.776	79%	0.786	S	S	*	*			trans	-122.4	163.9	168.2	-61.2	-172	171.4	0	0	109.5	E610	E610-E612 VanDerWaalsContact C-N 3.28Å; E610-E612 PolarHBondContact O-N 2.95Å
613	D	51.3	Low	52.3	Low	165 Å²	165	151.1 Å²	151.1	88%	0.882	78%	0.781	S	S	*	*	S	Bend	trans	78.2	16.1	-177.7	-55.2	-17.4	0	0	0	119.8
614	I	52.9	Low	54.5	Low	152 Å²	152	143.5 Å²	143.5	78%	0.779	75%	0.75	S	S	*	*	S	Bend	trans	-96.5	-5.6	172	-55.2	177.9	0	0	0	113.2
615	L	50.6	Low	56.6	Low	163 Å²	163	138.6 Å²	138.6	85%	0.853	73%	0.73	S	S	*	*	S	Bend	trans	-110.9	-4.3	-163.5	-90.8	164.1	0	0	0	117.5
616	D	56.4	Low	59.2	Low	161 Å²	161	142 Å²	142	86%	0.861	72%	0.724	S	S	*	*			trans	-122.5	37.4	-174.6	-77.8	-53.5	0	0	0	113.6
617	I	62.7	Low	61.3	Low	112 Å²	112	138.5 Å²	138.5	57%	0.574	70%	0.702	S	S	*	*			trans	-83.5	119.1	165.2	-57.5	178.5	0	0	0	108.5	A624	I617-A624 HydrophobicContact CG2-CB 3.66Å
618	P	61.9	Low	63.7	Low	84 Å²	84	129.3 Å²	129.3	55%	0.545	68%	0.676	S	S	.	*			trans	-71.1	131.4	177.6	27.7	-31.3	0	0	0	110.9	D620 D621	P618-D620 PolarHBondContact O-N 2.94Å; P618-D620 VanDerWaalsContact O-N 3.11Å; P618-D621 HydrophobicContact CG-CB 4.22Å; P618-D621 WeakPolarHBondContact O-CB 3.38Å; P618-D621 PolarHBondContact O-N 3.48Å; P618-D621 VanDerWaalsContact O-N 3.09Å
619	L	64.4	Low	65.8	Low	152 Å²	152	126.5 Å²	126.5	80%	0.796	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-17.6	-175.5	-66.3	169.7	0	0	0	114.3	N625	L619-N625 PolarHBondContact O-ND2 3.33Å
620	D	70.8	Confident	68.2	Low	156 Å²	156	124 Å²	124	83%	0.834	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	5.7	178.6	-55.5	-53.1	0	0	0	113.2	P618 P622	P618-D620 PolarHBondContact O-N 2.94Å; P618-D620 VanDerWaalsContact O-N 3.11Å; D620-P622 WeakPolarHBondContact O-CD 3.31Å
621	D	79.3	Confident	70.3	Confident	52 Å²	52	121.1 Å²	121.1	28%	0.278	64%	0.637	S	S	.	*			trans	-72.5	117.9	175.4	173.8	19.9	0	0	0	111.3	P618 E623 A624 N625	P618-D621 HydrophobicContact CG-CB 4.22Å; P618-D621 WeakPolarHBondContact O-CB 3.38Å; P618-D621 PolarHBondContact O-N 3.48Å; P618-D621 VanDerWaalsContact O-N 3.09Å; D621-E623 VanDerWaalsContact C-N 3.27Å; D621-E623 PolarHBondContact O-N 2.84Å; D621-E623 PolarHBondContact OD1-N 2.99Å; D621-A624 HydrophobicContact CB-CB 3.99Å; D621-A624 VanDerWaalsContact OD2-CB 3.24Å; D621-A624 WeakPolarHBondContact OD2-CB 3.4Å; D621-A624 PolarHBondContact OD2-N 2.89Å; D621-A624 VanDerWaalsContact OD2-N 3.08Å; D621-N625 WeakPolarHBondContact O-CB 3.37Å; D621-N625 PolarHBondContact O-N 2.85Å; D621-N625 VanDerWaalsContact O-N 3.09Å; D621-N625 PolarHBondContact O-ND2 2.88Å
622	P	75.7	Confident	72	Confident	104 Å²	104	117.6 Å²	117.6	68%	0.675	62%	0.621	S	S	*	*	H	α-helix	trans	-66.3	-27	177.7	28.5	-35.8	0	0	0	113	D620 R626	D620-P622 WeakPolarHBondContact O-CD 3.31Å; P622-R626 WeakPolarHBondContact O-CB 3.18Å; P622-R626 PolarHBondContact O-N 3.36Å
623	E	75.7	Confident	73.7	Confident	152 Å²	152	112.6 Å²	112.6	71%	0.71	61%	0.608	S	S	*	*	H	α-helix	trans	-74.9	-48.1	-179.5	-165.6	170.7	171.6	0	0	110.8	D621 N625 R626 A627	D621-E623 VanDerWaalsContact C-N 3.27Å; D621-E623 PolarHBondContact O-N 2.84Å; D621-E623 PolarHBondContact OD1-N 2.99Å; E623-N625 VanDerWaalsContact C-N 3.33Å; E623-N625 PolarHBondContact O-N 2.8Å; E623-R626 PolarHBondContact O-N 2.88Å; E623-A627 WeakPolarHBondContact O-CB 3.3Å; E623-A627 PolarHBondContact O-N 2.9Å
624	A	79.2	Confident	75.6	Confident	28 Å²	28	106.8 Å²	106.8	23%	0.231	59%	0.587	C	S	.	*	H	α-helix	trans	-57.4	-42.1	170.8	0	0	0	0	0	112.9	I617 D621 A627 A628	I617-A624 HydrophobicContact CG2-CB 3.66Å; D621-A624 HydrophobicContact CB-CB 3.99Å; D621-A624 VanDerWaalsContact OD2-CB 3.24Å; D621-A624 WeakPolarHBondContact OD2-CB 3.4Å; D621-A624 PolarHBondContact OD2-N 2.89Å; D621-A624 VanDerWaalsContact OD2-N 3.08Å; A624-A627 PolarHBondContact O-N 2.95Å; A624-A628 WeakPolarHBondContact O-CB 3.35Å; A624-A628 PolarHBondContact O-N 2.94Å
625	N	79.8	Confident	77.4	Confident	85 Å²	85	105.5 Å²	105.5	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-68.5	-40.2	178.1	-77.6	-53.7	0	0	0	112.5	L619 D621 E623 A628 A629	L619-N625 PolarHBondContact O-ND2 3.33Å; D621-N625 WeakPolarHBondContact O-CB 3.37Å; D621-N625 PolarHBondContact O-N 2.85Å; D621-N625 VanDerWaalsContact O-N 3.09Å; D621-N625 PolarHBondContact O-ND2 2.88Å; E623-N625 VanDerWaalsContact C-N 3.33Å; E623-N625 PolarHBondContact O-N 2.8Å; N625-A628 PolarHBondContact O-N 2.89Å; N625-A629 WeakPolarHBondContact O-CB 3.35Å; N625-A629 PolarHBondContact O-N 2.86Å
626	R	80.8	Confident	79.1	Confident	205 Å²	205	106.3 Å²	106.3	77%	0.774	57%	0.568	S	S	*	*	H	α-helix	trans	-61.6	-42	172.4	177.8	178	-99.8	-160.8	-7.7	111.5	P622 E623 A629 K630	P622-R626 WeakPolarHBondContact O-CB 3.18Å; P622-R626 PolarHBondContact O-N 3.36Å; E623-R626 PolarHBondContact O-N 2.88Å; R626-A629 PolarHBondContact O-N 2.79Å; R626-K630 PolarHBondContact O-N 2.91Å; R626-K630 VanDerWaalsContact O-N 3.09Å
627	A	84.2	Confident	80.7	Confident	51 Å²	51	99.7 Å²	99.7	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-64.3	-44.8	174.9	0	0	0	0	0	112.1	E623 A624 A629 K630 I631	E623-A627 WeakPolarHBondContact O-CB 3.3Å; E623-A627 PolarHBondContact O-N 2.9Å; A624-A627 PolarHBondContact O-N 2.95Å; A627-A629 PolarHBondContact O-N 2.9Å; A627-K630 PolarHBondContact O-N 2.86Å; A627-I631 WeakPolarHBondContact O-CG1 3.28Å; A627-I631 PolarHBondContact O-N 2.87Å
628	A	85.3	Confident	81.9	Confident	37 Å²	37	99.4 Å²	99.4	31%	0.306	53%	0.534	S	S	.	.	H	α-helix	trans	-61.1	-41.9	176.9	0	0	0	0	0	112.2	A624 N625 I631 Q632	A624-A628 WeakPolarHBondContact O-CB 3.35Å; A624-A628 PolarHBondContact O-N 2.94Å; N625-A628 PolarHBondContact O-N 2.89Å; A628-I631 PolarHBondContact O-N 3.1Å; A628-Q632 VanDerWaalsContact O-CG 3.31Å; A628-Q632 WeakPolarHBondContact O-CG 3.37Å; A628-Q632 PolarHBondContact O-N 2.96Å
629	A	84.2	Confident	83.1	Confident	56 Å²	56	99 Å²	99	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-61.3	-45.9	174.5	0	0	0	0	0	111.9	N625 R626 A627 I631 Q632 A633	N625-A629 WeakPolarHBondContact O-CB 3.35Å; N625-A629 PolarHBondContact O-N 2.86Å; R626-A629 PolarHBondContact O-N 2.79Å; A627-A629 PolarHBondContact O-N 2.9Å; A629-I631 VanDerWaalsContact C-N 3.34Å; A629-I631 PolarHBondContact O-N 2.8Å; A629-Q632 PolarHBondContact O-N 2.89Å; A629-A633 WeakPolarHBondContact O-CB 3.43Å; A629-A633 PolarHBondContact O-N 2.84Å
630	K	90.7	Very high	83.9	Confident	143 Å²	143	95.1 Å²	95.1	62%	0.622	51%	0.508	S	S	*	.	H	α-helix	trans	-61.3	-40.1	177.7	-167.2	166.3	-174.7	167.8	0	112.4	R626 A627 G634	R626-K630 PolarHBondContact O-N 2.91Å; R626-K630 VanDerWaalsContact O-N 3.09Å; A627-K630 PolarHBondContact O-N 2.86Å; K630-G634 PolarHBondContact O-N 3.31Å
631	I	88	Confident	84.7	Confident	124 Å²	124	95.6 Å²	95.6	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-44.1	174.3	-67.8	165.1	0	0	0	111.2	A627 A628 A629 G634 F635	A627-I631 WeakPolarHBondContact O-CG1 3.28Å; A627-I631 PolarHBondContact O-N 2.87Å; A628-I631 PolarHBondContact O-N 3.1Å; A629-I631 VanDerWaalsContact C-N 3.34Å; A629-I631 PolarHBondContact O-N 2.8Å; I631-G634 PolarHBondContact O-N 3.43Å; I631-F635 WeakPolarHBondContact O-CB 3.32Å; I631-F635 PolarHBondContact O-N 2.81Å
632	Q	86.1	Confident	84.9	Confident	121 Å²	121	100 Å²	100	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-65.4	-41.1	178.2	-72.3	177.5	40.8	0	0	112.6	A628 A629 F635 R636	A628-Q632 VanDerWaalsContact O-CG 3.31Å; A628-Q632 WeakPolarHBondContact O-CG 3.37Å; A628-Q632 PolarHBondContact O-N 2.96Å; A629-Q632 PolarHBondContact O-N 2.89Å; Q632-F635 PolarHBondContact O-N 3.43Å; Q632-R636 WeakPolarHBondContact O-CB 3.38Å; Q632-R636 VanDerWaalsContact O-CG 3.27Å; Q632-R636 WeakPolarHBondContact O-CG 3.32Å; Q632-R636 PolarHBondContact O-N 2.99Å
633	A	88.6	Confident	85	Confident	62 Å²	62	103.4 Å²	103.4	51%	0.512	52%	0.519	S	S	.	.	H	α-helix	trans	-62	-49.6	174.9	0	0	0	0	0	111.4	A629 F635 R636 G637	A629-A633 WeakPolarHBondContact O-CB 3.43Å; A629-A633 PolarHBondContact O-N 2.84Å; A633-F635 VanDerWaalsContact C-N 3.32Å; A633-F635 PolarHBondContact O-N 2.95Å; A633-R636 PolarHBondContact O-N 3.18Å; A633-G637 PolarHBondContact O-N 3.08Å
634	G	91.1	Very high	84.5	Confident	43 Å²	43	103.2 Å²	103.2	44%	0.443	52%	0.52	S	S	.	.	H	α-helix	trans	-58.8	-40.3	176.2	0	0	0	0	0	113.2	K630 I631 H638	K630-G634 PolarHBondContact O-N 3.31Å; I631-G634 PolarHBondContact O-N 3.43Å; G634-H638 WeakPolarHBondContact O-CB 3.39Å; G634-H638 PolarHBondContact O-N 3.19Å
635	F	91.1	Very high	84.3	Confident	124 Å²	124	109.8 Å²	109.8	54%	0.544	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-41.4	175.9	-175.2	-99.7	0	0	0	112.8	I631 Q632 A633 H638 M639	I631-F635 WeakPolarHBondContact O-CB 3.32Å; I631-F635 PolarHBondContact O-N 2.81Å; Q632-F635 PolarHBondContact O-N 3.43Å; A633-F635 VanDerWaalsContact C-N 3.32Å; A633-F635 PolarHBondContact O-N 2.95Å; F635-H638 PolarHBondContact O-N 2.94Å; F635-M639 HydrophobicContact CD1-CG 4.38Å; F635-M639 HydrophobicContact CE1-CE 3.95Å; F635-M639 HydrophobicContact CE1-CG 4.08Å; F635-M639 HydrophobicContact CE2-CE 3.92Å; F635-M639 HydrophobicContact CZ-CE 3.36Å; F635-M639 HydrophobicContact CZ-CG 4.29Å; F635-M639 WeakPolarHBondContact O-CB 3.45Å; F635-M639 WeakPolarHBondContact O-CG 3.35Å; F635-M639 PolarHBondContact O-N 2.97Å
636	R	85	Confident	83	Confident	181 Å²	181	111.5 Å²	111.5	68%	0.683	56%	0.559	S	S	*	*	H	α-helix	trans	-63	-47.3	175.1	-72.2	167.9	79.8	146.9	-0.6	110.8	Q632 A633 H638 M639 T640	Q632-R636 WeakPolarHBondContact O-CB 3.38Å; Q632-R636 VanDerWaalsContact O-CG 3.27Å; Q632-R636 WeakPolarHBondContact O-CG 3.32Å; Q632-R636 PolarHBondContact O-N 2.99Å; A633-R636 PolarHBondContact O-N 3.18Å; R636-H638 PolarHBondContact O-N 2.65Å; R636-M639 PolarHBondContact O-N 2.85Å; R636-M639 VanDerWaalsContact O-N 3.17Å; R636-T640 PolarHBondContact O-N 3.22Å; R636-T640 PolarHBondContact O-OG1 2.79Å
637	G	90.1	Very high	81.4	Confident	21 Å²	21	109.5 Å²	109.5	22%	0.216	56%	0.559	C	S	.	*	H	α-helix	trans	-61.1	-40.6	175.1	0	0	0	0	0	113.5	A633 T640 R641	A633-G637 PolarHBondContact O-N 3.08Å; G637-T640 PolarHBondContact O-N 2.84Å; G637-R641 PolarHBondContact O-N 2.91Å
638	H	88.5	Confident	79.3	Confident	107 Å²	107	114.9 Å²	114.9	50%	0.495	58%	0.58	S	S	.	*	H	α-helix	trans	-62.1	-42.8	172.7	179	88.3	0	0	0	112	G634 F635 R636 R641 K642	G634-H638 WeakPolarHBondContact O-CB 3.39Å; G634-H638 PolarHBondContact O-N 3.19Å; F635-H638 PolarHBondContact O-N 2.94Å; R636-H638 PolarHBondContact O-N 2.65Å; H638-R641 PolarHBondContact O-N 2.99Å; H638-K642 VanDerWaalsContact O-CB 3.27Å; H638-K642 WeakPolarHBondContact O-CB 3.24Å; H638-K642 PolarHBondContact O-N 2.97Å
639	M	86.1	Confident	77.2	Confident	75 Å²	75	120.7 Å²	120.7	37%	0.369	60%	0.599	S	S	.	*	H	α-helix	trans	-64.5	-38.9	177.1	-78.6	-68.2	-175.4	0	0	112.7	F635 R636 K642 K643	F635-M639 HydrophobicContact CD1-CG 4.38Å; F635-M639 HydrophobicContact CE1-CE 3.95Å; F635-M639 HydrophobicContact CE1-CG 4.08Å; F635-M639 HydrophobicContact CE2-CE 3.92Å; F635-M639 HydrophobicContact CZ-CE 3.36Å; F635-M639 HydrophobicContact CZ-CG 4.29Å; F635-M639 WeakPolarHBondContact O-CB 3.45Å; F635-M639 WeakPolarHBondContact O-CG 3.35Å; F635-M639 PolarHBondContact O-N 2.97Å; R636-M639 PolarHBondContact O-N 2.85Å; R636-M639 VanDerWaalsContact O-N 3.17Å; M639-K642 PolarHBondContact O-N 3.16Å; M639-K643 VanDerWaalsContact O-CG 3.31Å; M639-K643 WeakPolarHBondContact O-CG 3.45Å; M639-K643 PolarHBondContact O-N 2.86Å; M639-K643 VanDerWaalsContact O-N 3.07Å
640	T	82.1	Confident	74.9	Confident	70 Å²	70	124.6 Å²	124.6	43%	0.429	62%	0.617	S	S	.	*	H	α-helix	trans	-63.9	-51.9	174.1	-58.5	0	0	0	0	111	R636 G637 K642 K643 M644	R636-T640 PolarHBondContact O-N 3.22Å; R636-T640 PolarHBondContact O-OG1 2.79Å; G637-T640 PolarHBondContact O-N 2.84Å; T640-K642 PolarHBondContact O-N 3.35Å; T640-K643 PolarHBondContact O-N 3.49Å; T640-M644 HydrophobicContact CG2-CE 3.81Å; T640-M644 HydrophobicContact CG2-SD 3.68Å; T640-M644 PolarHBondContact O-N 2.69Å
641	R	86.8	Confident	72.6	Confident	166 Å²	166	127.8 Å²	127.8	63%	0.626	63%	0.634	S	S	*	*	H	α-helix	trans	-60.4	-30.4	176.5	-71.6	-174.3	-72.2	-94.4	5.4	113.4	G637 H638	G637-R641 PolarHBondContact O-N 2.91Å; H638-R641 PolarHBondContact O-N 2.99Å
642	K	83.8	Confident	70.1	Confident	145 Å²	145	125.4 Å²	125.4	63%	0.63	64%	0.639	S	S	*	*	H	α-helix	trans	-72.9	-31.4	174.2	-173.1	171.3	-178.6	174.8	0	113	H638 M639 T640	H638-K642 VanDerWaalsContact O-CB 3.27Å; H638-K642 WeakPolarHBondContact O-CB 3.24Å; H638-K642 PolarHBondContact O-N 2.97Å; M639-K642 PolarHBondContact O-N 3.16Å; T640-K642 PolarHBondContact O-N 3.35Å
643	K	78.1	Confident	67.6	Low	175 Å²	175	129.3 Å²	129.3	76%	0.761	66%	0.658	S	S	*	*	H	α-helix	trans	-78.6	-28.9	175.2	-72	171.4	179	-175.8	0	113.4	M639 T640	M639-K643 VanDerWaalsContact O-CG 3.31Å; M639-K643 WeakPolarHBondContact O-CG 3.45Å; M639-K643 PolarHBondContact O-N 2.86Å; M639-K643 VanDerWaalsContact O-N 3.07Å; T640-K643 PolarHBondContact O-N 3.49Å
644	M	65.8	Low	65.3	Low	148 Å²	148	134.5 Å²	134.5	73%	0.729	67%	0.671	S	S	*	*	S	Bend	trans	-82.8	-8.9	-178.2	-73.3	171.2	161.6	0	0	114.3	T640	T640-M644 HydrophobicContact CG2-CE 3.81Å; T640-M644 HydrophobicContact CG2-SD 3.68Å; T640-M644 PolarHBondContact O-N 2.69Å
645	K	73.8	Confident	63	Low	166 Å²	166	138.7 Å²	138.7	72%	0.722	69%	0.688	S	S	*	*	S	Bend	trans	-75.4	124.8	170	-77.2	-166.3	172.8	-168	0	110.3
646	P	52.7	Low	60.3	Low	122 Å²	122	138.2 Å²	138.2	79%	0.792	70%	0.7	S	S	*	*			trans	-64.2	138.6	173.1	26.6	-33.5	0	0	0	110.8	D648	P646-D648 PolarHBondContact O-N 2.68Å
647	E	46.8	Very low	58.1	Low	163 Å²	163	134.2 Å²	134.2	76%	0.762	70%	0.7	S	S	*	*			trans	-72.7	90.6	177.8	-74.9	-165.6	-178.9	0	0	111.8	K649	E647-K649 WeakPolarHBondContact OE2-CE 3.48Å; E647-K649 IonicContact OE2-NZ 3.73Å; E647-K649 PolarHBondContact OE2-NZ 3.35Å
648	D	40.6	Very low	56	Low	163 Å²	163	139.6 Å²	139.6	87%	0.872	73%	0.729	S	S	*	*			trans	-98.7	134	152.7	-152.8	-8.5	0	0	0	110.4	P646 T650	P646-D648 PolarHBondContact O-N 2.68Å; D648-T650 PolarHBondContact O-N 3.3Å
649	K	41.4	Very low	53.7	Low	160 Å²	160	137.6 Å²	137.6	70%	0.696	74%	0.737	S	S	*	*			trans	-98.8	104.8	-149.3	-64.6	-168.1	179.9	-156.7	0	114.3	E647	E647-K649 WeakPolarHBondContact OE2-CE 3.48Å; E647-K649 IonicContact OE2-NZ 3.73Å; E647-K649 PolarHBondContact OE2-NZ 3.35Å
650	T	35.8	Very low	51.4	Low	138 Å²	138	141.3 Å²	141.3	85%	0.847	76%	0.758	S	S	*	*			trans	-135.4	114.3	149.6	43.6	0	0	0	0	111.3	D648	D648-T650 PolarHBondContact O-N 3.3Å
651	E	41.9	Very low	49.6	Very low	210 Å²	210	143.1 Å²	143.1	98%	0.981	77%	0.769	S	S	*	*			trans	-84.9	130	166.2	-66.5	175.8	-178.2	0	0	108.5
652	G	35.2	Very low	47.5	Very low	73 Å²	73	141.4 Å²	141.4	75%	0.753	77%	0.772	S	S	*	*			trans	-174	71.5	-172.1	0	0	0	0	0	117.6
653	E	34.5	Very low	44.9	Very low	203 Å²	203	141 Å²	141	95%	0.949	78%	0.777	S	S	*	*			trans	71	168.4	159.7	-137.9	154.8	-161.6	0	0	117.5
654	E	40.4	Very low	42.8	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	78%	0.777	S	S	*	*			trans	-130.8	158.4	-149.5	-67.4	-160.7	148.2	0	0	118.2
655	V	43.6	Very low	42.6	Very low	132 Å²	132	135.9 Å²	135.9	80%	0.8	78%	0.777	S	S	*	*			trans	57.2	126	154.7	-68.5	0	0	0	0	122.7
656	S	34.2	Very low	41.2	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	77%	0.774	S	S	*	*				169.7	138.1	94.7	-165.5	0	0	0	0	116.3
657	S	38.8	Very low	40.7	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	77%	0.772	S	S	*	*			trans	52.9	113.5	148.7	-164.5	0	0	0	0	125
658	T	44.3	Very low	40.5	Very low	133 Å²	133	127.6 Å²	127.6	82%	0.816	77%	0.768	S	S	*	*				26.5	142.7	118.8	-30.6	0	0	0	0	121.5
659	G	40.8	Very low	40.8	Very low	65 Å²	65	124.1 Å²	124.1	67%	0.67	76%	0.756	S	S	*	*			cis	167.3	-157.9	-1.1	0	0	0	0	0	114.6
660	D	37.8	Very low	41.1	Very low	153 Å²	153	124.8 Å²	124.8	82%	0.818	76%	0.762	S	S	*	*			trans	89.7	146.7	167.3	-63.7	-29.2	0	0	0	122.8
661	V	44	Very low	41.5	Very low	108 Å²	108	124.3 Å²	124.3	66%	0.655	76%	0.759	S	S	*	*			cis	-177.3	150	-37.7	121.9	0	0	0	0	115.4
662	L	42.4	Very low	41.5	Very low	131 Å²	131	117.8 Å²	117.8	69%	0.686	75%	0.748	S	S	*	*			trans	79	157.8	173.7	-53.2	-163.8	0	0	0	119.3
663	N	30.4	Very low	41.9	Very low	137 Å²	137	124.2 Å²	124.2	73%	0.733	75%	0.75	S	S	*	*			cis	-148.1	144.6	11.9	-166.2	62.1	0	0	0	117.3
664	S	32.8	Very low	42.4	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	75%	0.748	S	S	*	*			trans	-179.4	162.9	173.5	25.3	0	0	0	0	109.9
665	S	63.3	Low	42.5	Very low	106 Å²	106	116 Å²	116	74%	0.741	75%	0.745	S	S	*	*			cis	-162.7	-171.7	-23.4	-158.3	0	0	0	0	109.5
666	Q	42.5	Very low	42.5	Very low	139 Å²	139	114.2 Å²	114.2	65%	0.65	74%	0.744	S	S	*	*			trans	64.7	168.2	157.6	-75.2	172.2	-43.5	0	0	120
667	G	43	Very low	43	Very low	73 Å²	73	115.6 Å²	115.6	75%	0.753	75%	0.747	S	S	*	*			cis	157.2	178.3	-5.3	0	0	0	0	0	113.7
668	G	42.3	Very low	43	Very low	66 Å²	66	117.7 Å²	117.7	68%	0.68	75%	0.746	S	S	*	*			trans	71.1	174.4	163.5	0	0	0	0	0	120.3
669	S	46.8	Very low	42.8	Very low	89 Å²	89	119.7 Å²	119.7	62%	0.622	74%	0.739	S	S	*	*			cis	-178.9	-176	-20.5	58.7	0	0	0	0	109.7
670	E	48.8	Very low	42.5	Very low	174 Å²	174	122.9 Å²	122.9	81%	0.813	74%	0.741	S	S	*	*			trans	153.6	99.3	137.6	-83	-163.1	150.2	0	0	118.5
671	T	43.4	Very low	42.5	Very low	129 Å²	129	122.4 Å²	122.4	79%	0.791	74%	0.738	S	S	*	*				44.2	141.3	128.4	69	0	0	0	0	125.2
672	G	41.6	Very low	42.4	Very low	73 Å²	73	124.5 Å²	124.5	75%	0.753	75%	0.751	S	S	*	*			trans	160.9	-4.1	135.7	0	0	0	0	0	122.7
673	R	43.6	Very low	42.2	Very low	208 Å²	208	123 Å²	123	79%	0.785	75%	0.752	S	S	*	*			trans	-42.6	139.5	176.4	-62.1	174.2	161	134.7	-14.2	111.5	E302	E302-R673 IonicContact OE2-NH2 2.69Å
674	S	46	Very low	42.8	Very low	130 Å²	130	122.6 Å²	122.6	91%	0.909	75%	0.754	S	S	*	*			cis	-133.4	-151.3	1.8	62.4	0	0	0	0	110.4
675	G	42.9	Very low	44	Very low	72 Å²	72	122.4 Å²	122.4	74%	0.742	75%	0.75	S	S	*	*			cis	173.9	-169.2	10.9	0	0	0	0	0	107.8
676	A	43.4	Very low	43.3	Very low	94 Å²	94	125.9 Å²	125.9	78%	0.777	76%	0.755	S	S	*	*			cis	-173.4	-174.7	-15.2	0	0	0	0	0	110.1
677	V	44.6	Very low	43.7	Very low	143 Å²	143	131.9 Å²	131.9	87%	0.867	78%	0.783	S	S	*	*			trans	75.7	146.5	156.7	169.7	0	0	0	0	119.1
678	E	38.1	Very low	43.8	Very low	141 Å²	141	134.9 Å²	134.9	66%	0.659	78%	0.784	S	S	*	*			cis	-138.1	-103.2	0.3	-145.8	-168.1	-151.2	0	0	118.2
679	R	40.3	Very low	43.8	Very low	174 Å²	174	138.5 Å²	138.5	66%	0.657	79%	0.79	S	S	*	*			trans	-144.4	158	-157.8	-85.5	-171.7	-122.9	87.1	17.1	115.9
680	D	35.2	Very low	43.7	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	80%	0.799	S	S	*	*			cis	-151.9	159.8	7.8	-99.7	-33.4	0	0	0	112.9
681	D	37	Very low	43.4	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	80%	0.798	S	S	*	*			trans	47.3	120.2	153.2	-85.6	-31.6	0	0	0	124.2
682	T	41.3	Very low	43.4	Very low	152 Å²	152	139.9 Å²	139.9	93%	0.933	80%	0.799	S	S	*	*				-161	150.8	120.9	-4.7	0	0	0	0	114
683	S	38.6	Very low	43.5	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	80%	0.802	S	S	*	*			trans	-93.7	142	-163.5	-40.5	0	0	0	0	117.1
684	V	43	Very low	43.5	Very low	128 Å²	128	139.9 Å²	139.9	78%	0.776	80%	0.803	S	S	*	*				19.8	127.1	111.2	179	0	0	0	0	115.5
685	P	59.2	Low	43.3	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	80%	0.795	S	S	*	*				-153.1	146	89.9	39.5	-20	0	0	0	120.4
686	E	47	Very low	43.3	Very low	179 Å²	179	146.3 Å²	146.3	84%	0.836	80%	0.799	S	S	*	*			trans	39.3	128.2	131.7	-54.3	176.4	113.6	0	0	121.6
687	Q	52.3	Low	43.3	Very low	265 Å²	265	151.1 Å²	151.1	100%	1.238	80%	0.802	S	S	*	*				-155.4	0	104.4	-149.1	155.5	93.6	0	0	113.3

Retrieved 687 of 687 residues in 213.3 ms (Link to these results)

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