A0A087YE39_POEFO Loading...

SOSS complex subunit B2

AlphaFold DB , UniProt , Accession A0A087YE39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 221 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	45.6	Very low	62.8	Low	245 Å²	245	120.6 Å²	120.6	100%	1.207	71%	0.71	S	S	*	*				0	108.2	0	-72.2	171.1	178.4	0	0	107.3	A3	M1-A3 PolarHBondContact O-N 3.05Å
2	M	44.6	Very low	65.7	Low	190 Å²	190	114.8 Å²	114.8	94%	0.936	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-72.9	120.7	174.5	-68.7	-70.3	-172	0	0	107.4	A4	M2-A4 PolarHBondContact O-N 2.9Å
3	A	47.4	Very low	68.2	Low	100 Å²	100	105.9 Å²	105.9	83%	0.826	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-59.8	122.7	175.1	0	0	0	0	0	108.6	M1	M1-A3 PolarHBondContact O-N 3.05Å
4	A	45	Very low	70.2	Confident	82 Å²	82	105.6 Å²	105.6	68%	0.678	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-56.4	143.4	174	0	0	0	0	0	109.6	M2 S6	M2-A4 PolarHBondContact O-N 2.9Å; A4-S6 VanDerWaalsContact C-N 3.35Å; A4-S6 PolarHBondContact O-N 3.19Å
5	P	50.6	Low	71.9	Confident	125 Å²	125	103.5 Å²	103.5	81%	0.812	59%	0.594	S	S	*	*			trans	-66	100	171.4	27.5	-31.3	0	0	0	107.6	N7	P5-N7 PolarHBondContact O-N 3.06Å
6	S	55.8	Low	73.5	Confident	83 Å²	83	97.6 Å²	97.6	58%	0.58	56%	0.56	S	S	*	*			trans	-59.4	110.2	167.4	43.4	0	0	0	0	106.8	A4 E8	A4-S6 VanDerWaalsContact C-N 3.35Å; A4-S6 PolarHBondContact O-N 3.19Å; S6-E8 PolarHBondContact O-N 3.44Å
7	N	54.5	Low	74.7	Confident	169 Å²	169	100.2 Å²	100.2	90%	0.904	56%	0.563	S	S	*	*			trans	-69.6	69	175.3	-165.2	18.3	0	0	0	108.4	P5	P5-N7 PolarHBondContact O-N 3.06Å
8	E	72.3	Confident	75.8	Confident	67 Å²	67	98.8 Å²	98.8	31%	0.313	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-77.6	126.1	178.6	-68.7	-170.6	145.4	0	0	108.8	S6 L10 N24	S6-E8 PolarHBondContact O-N 3.44Å; E8-L10 PolarHBondContact O-N 2.96Å; E8-N24 VanDerWaalsContact CB-ND2 3.35Å; E8-N24 WeakPolarHBondContact CB-ND2 3.44Å; E8-N24 VanDerWaalsContact CD-ND2 3.3Å; E8-N24 PolarHBondContact OE2-ND2 2.84Å; E8-N24 PolarHBondContact OE2-OD1 2.86Å
9	A	85.5	Confident	76.7	Confident	76 Å²	76	96.4 Å²	96.4	63%	0.628	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-57.2	126.9	178.5	0	0	0	0	0	110.7
10	L	93.1	Very high	77.6	Confident	104 Å²	104	93.3 Å²	93.3	55%	0.545	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-80.2	133.4	174.2	-65	178.9	0	0	0	110.1	E8 N24 V26	E8-L10 PolarHBondContact O-N 2.96Å; L10-N24 CarbonylContact C-O 3.01Å; L10-N24 VanDerWaalsContact CA-O 3.31Å; L10-N24 WeakPolarHBondContact CA-O 3.36Å; L10-N24 HydrophobicContact CD2-CB 4.28Å; L10-V26 HydrophobicContact CD1-CG2 4.01Å; L10-V26 HydrophobicContact CD2-CG2 4.1Å
11	F	96.4	Very high	78.4	Confident	86 Å²	86	95.9 Å²	95.9	38%	0.377	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-91.3	145.2	172.7	-74.1	-96.5	0	0	0	110.2	L23 N24 I25	F11-L23 HydrophobicContact CB-CD2 4.43Å; F11-L23 HydrophobicContact CD1-CD2 4.11Å; F11-L23 HydrophobicContact CD2-CD2 4.26Å; F11-L23 HydrophobicContact CE1-CD2 4.44Å; F11-L23 HydrophobicContact CG-CD2 4.01Å; F11-N24 PolarHBondContact N-O 3.32Å; F11-I25 HydrophobicContact CB-CD1 4.47Å; F11-I25 HydrophobicContact CB-CG1 3.9Å
12	L	97.5	Very high	80.7	Confident	50 Å²	50	89.8 Å²	89.8	26%	0.262	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-88.7	152.6	167.1	-62.4	175.3	0	0	0	110.1	K14 D15 D51 K52	L12-K14 HydrophobicContact CB-CG 4.03Å; L12-K14 PolarHBondContact O-N 3Å; L12-D15 PolarHBondContact O-N 3.27Å; L12-D51 VanDerWaalsContact CA-OD2 3.32Å; L12-D51 WeakPolarHBondContact CA-OD2 3.14Å; L12-D51 WeakPolarHBondContact CD2-OD2 3.32Å; L12-K52 HydrophobicContact CD2-CG 4.33Å
13	I	97.9	Very high	83.2	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-57.5	-39.5	179.2	-70.5	172.5	0	0	0	111.2	D15 V16 I25 F27 D51 S53 G54 I56 F114	I13-D15 PolarHBondContact O-N 3.1Å; I13-D15 VanDerWaalsContact O-N 3.09Å; I13-V16 VanDerWaalsContact O-CB 3.29Å; I13-V16 WeakPolarHBondContact O-CB 3.22Å; I13-V16 WeakPolarHBondContact O-CG2 3.41Å; I13-V16 PolarHBondContact O-N 3.43Å; I13-I25 HydrophobicContact CG1-CG2 4.2Å; I13-F27 HydrophobicContact CD1-CB 4.42Å; I13-D51 HydrophobicContact CD1-CB 3.87Å; I13-D51 VanDerWaalsContact CD1-N 3.33Å; I13-D51 HydrophobicContact CG1-CB 4.27Å; I13-D51 PolarHBondContact N-OD2 3.29Å; I13-S53 PolarHBondContact N-OG 2.84Å; I13-G54 WeakPolarHBondContact CD1-O 3.49Å; I13-I56 HydrophobicContact CD1-CG2 3.88Å; I13-I56 HydrophobicContact CG1-CG2 4.04Å; I13-I56 HydrophobicContact CG2-CB 3.74Å; I13-I56 HydrophobicContact CG2-CD1 4.44Å; I13-I56 HydrophobicContact CG2-CG2 3.79Å; I13-F114 HydrophobicContact CG2-CD2 3.49Å; I13-F114 VanDerWaalsContact CG2-CD2 3.49Å; I13-F114 HydrophobicContact CG2-CE2 3.96Å; I13-F114 HydrophobicContact CG2-CG 4.28Å
14	K	97	Very high	85.6	Confident	102 Å²	102	76.6 Å²	76.6	44%	0.443	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-59.4	-22.4	178	67.7	169.4	-176.3	64.9	0	115.5	L12 S53 F114	L12-K14 HydrophobicContact CB-CG 4.03Å; L12-K14 PolarHBondContact O-N 3Å; K14-S53 PolarHBondContact N-OG 3.47Å; K14-F114 HydrophobicContact CB-CE1 4.24Å; K14-F114 HydrophobicContact CB-CE2 4.06Å; K14-F114 HydrophobicContact CB-CZ 3.5Å
15	D	95.9	Very high	88.1	Confident	74 Å²	74	72.7 Å²	72.7	40%	0.396	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-93.2	-3	-177	-59.2	-46.6	0	0	0	111.7	L12 I13	L12-D15 PolarHBondContact O-N 3.27Å; I13-D15 PolarHBondContact O-N 3.1Å; I13-D15 VanDerWaalsContact O-N 3.09Å
16	V	96.3	Very high	90.3	Very high	8 Å²	8	68.2 Å²	68.2	5%	0.048	38%	0.377	C	S	.	.			trans	-73.8	130.1	178	-178.5	0	0	0	0	110.3	I13 L23 I25 I56 A81 L88 L90	I13-V16 VanDerWaalsContact O-CB 3.29Å; I13-V16 WeakPolarHBondContact O-CB 3.22Å; I13-V16 WeakPolarHBondContact O-CG2 3.41Å; I13-V16 PolarHBondContact O-N 3.43Å; V16-L23 HydrophobicContact CG1-CD1 4.06Å; V16-L23 HydrophobicContact CG2-CD1 4.31Å; V16-I25 HydrophobicContact CG2-CD1 3.66Å; V16-I56 HydrophobicContact CB-CD1 4.37Å; V16-I56 HydrophobicContact CG1-CD1 4.09Å; V16-A81 HydrophobicContact CG1-CB 3.32Å; V16-L88 HydrophobicContact CG1-CD2 4.24Å; V16-L90 HydrophobicContact CG1-CD2 4Å
17	K	94.6	Very high	92.3	Very high	143 Å²	143	64.3 Å²	64.3	62%	0.622	35%	0.349	S	S	*	.			trans	-125.7	155.8	176.8	-64.8	-178	-178.4	178.4	0	110.3	G19 S20	K17-G19 PolarHBondContact O-N 3.23Å; K17-S20 PolarHBondContact N-OG 2.86Å; K17-S20 VanDerWaalsContact O-CB 3.28Å; K17-S20 WeakPolarHBondContact O-CB 3.45Å; K17-S20 PolarHBondContact O-N 2.87Å; K17-S20 VanDerWaalsContact O-N 3.09Å; K17-S20 PolarHBondContact O-OG 2.69Å; K17-S20 VanDerWaalsContact O-OG 3.07Å
18	P	94.1	Very high	94.4	Very high	75 Å²	75	56.6 Å²	56.6	49%	0.487	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	129.9	171.8	-24	32.6	0	0	0	111.5	S20 I83 L88	P18-S20 VanDerWaalsContact C-N 3.33Å; P18-I83 HydrophobicContact CB-CD1 4.2Å; P18-I83 HydrophobicContact CB-CG1 4.06Å; P18-I83 HydrophobicContact CG-CD1 3.76Å; P18-I83 HydrophobicContact CG-CG1 4.07Å; P18-L88 HydrophobicContact CB-CD1 4.37Å; P18-L88 HydrophobicContact CG-CD1 4.02Å
19	G	93.3	Very high	95.7	Very high	53 Å²	53	53.5 Å²	53.5	55%	0.546	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-5.2	179.9	0	0	0	0	0	115.1	K17 A81	K17-G19 PolarHBondContact O-N 3.23Å; G19-A81 WeakPolarHBondContact CA-O 3.2Å; G19-A81 PolarHBondContact N-O 2.8Å
20	S	94.2	Very high	96.3	Very high	34 Å²	34	51.1 Å²	51.1	24%	0.238	27%	0.27	C	S	.	.			trans	-59.7	139.9	172.4	-67.7	0	0	0	0	111.3	K17 P18 Y80 A81	K17-S20 PolarHBondContact N-OG 2.86Å; K17-S20 VanDerWaalsContact O-CB 3.28Å; K17-S20 WeakPolarHBondContact O-CB 3.45Å; K17-S20 PolarHBondContact O-N 2.87Å; K17-S20 VanDerWaalsContact O-N 3.09Å; K17-S20 PolarHBondContact O-OG 2.69Å; K17-S20 VanDerWaalsContact O-OG 3.07Å; P18-S20 VanDerWaalsContact C-N 3.33Å; S20-Y80 CarbonylContact O-C 3.52Å; S20-Y80 WeakPolarHBondContact O-CA 3.36Å; S20-Y80 WeakPolarHBondContact O-CB 3.29Å; S20-A81 PolarHBondContact O-N 2.83Å
21	K	95	Very high	96.4	Very high	147 Å²	147	51.5 Å²	51.5	64%	0.639	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	168	-177.2	-65.8	172.1	-172.7	168.9	0	109.8	L23 G79	K21-L23 PolarHBondContact O-N 3.48Å; K21-G79 CarbonylContact C-O 3.57Å
22	N	94.8	Very high	96.4	Very high	117 Å²	117	50 Å²	50	63%	0.626	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.1	36.7	-178	-59	-25	0	0	0	111.9	G79	N22-G79 PolarHBondContact N-O 2.81Å
23	L	96.1	Very high	96.2	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.3	-179.9	-64.7	174.6	0	0	0	109.6	F11 V16 K21 I25 R78 G79 A81 L90	F11-L23 HydrophobicContact CB-CD2 4.43Å; F11-L23 HydrophobicContact CD1-CD2 4.11Å; F11-L23 HydrophobicContact CD2-CD2 4.26Å; F11-L23 HydrophobicContact CE1-CD2 4.44Å; F11-L23 HydrophobicContact CG-CD2 4.01Å; V16-L23 HydrophobicContact CG1-CD1 4.06Å; V16-L23 HydrophobicContact CG2-CD1 4.31Å; K21-L23 PolarHBondContact O-N 3.48Å; L23-I25 HydrophobicContact CB-CD1 4.08Å; L23-I25 HydrophobicContact CB-CG1 4.25Å; L23-I25 HydrophobicContact CD1-CD1 4.33Å; L23-R78 PolarHBondContact O-N 3.29Å; L23-G79 PolarHBondContact N-O 3.14Å; L23-G79 PolarHBondContact O-N 3.4Å; L23-A81 HydrophobicContact CD1-CB 4.1Å; L23-L90 HydrophobicContact CD1-CD2 3.88Å
24	N	96.9	Very high	95.8	Very high	11 Å²	11	60 Å²	60	6%	0.059	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	107.3	171.9	-63.1	-36.6	0	0	0	107.8	E8 L10 F11 L76 T77 R78	E8-N24 VanDerWaalsContact CB-ND2 3.35Å; E8-N24 WeakPolarHBondContact CB-ND2 3.44Å; E8-N24 VanDerWaalsContact CD-ND2 3.3Å; E8-N24 PolarHBondContact OE2-ND2 2.84Å; E8-N24 PolarHBondContact OE2-OD1 2.86Å; L10-N24 CarbonylContact C-O 3.01Å; L10-N24 VanDerWaalsContact CA-O 3.31Å; L10-N24 WeakPolarHBondContact CA-O 3.36Å; L10-N24 HydrophobicContact CD2-CB 4.28Å; F11-N24 PolarHBondContact N-O 3.32Å; N24-L76 CarbonylContact C-O 3.56Å; N24-L76 VanDerWaalsContact CA-O 3.27Å; N24-L76 WeakPolarHBondContact CA-O 3.32Å; N24-T77 VanDerWaalsContact OD1-CA 3.25Å; N24-T77 WeakPolarHBondContact OD1-CA 3.48Å; N24-R78 PolarHBondContact OD1-N 2.9Å
25	I	97.4	Very high	95.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.6	-170.8	-56.9	175.2	0	0	0	108.3	F11 I13 V16 L23 F27 L76 L90	F11-I25 HydrophobicContact CB-CD1 4.47Å; F11-I25 HydrophobicContact CB-CG1 3.9Å; I13-I25 HydrophobicContact CG1-CG2 4.2Å; V16-I25 HydrophobicContact CG2-CD1 3.66Å; L23-I25 HydrophobicContact CB-CD1 4.08Å; L23-I25 HydrophobicContact CB-CG1 4.25Å; L23-I25 HydrophobicContact CD1-CD1 4.33Å; I25-F27 HydrophobicContact CB-CD1 4.47Å; I25-F27 HydrophobicContact CG2-CD1 4.01Å; I25-L76 PolarHBondContact N-O 2.88Å; I25-L76 PolarHBondContact O-N 3.28Å; I25-L90 HydrophobicContact CD1-CD1 4.12Å; I25-L90 HydrophobicContact CD1-CD2 4.22Å
26	V	98.1	Very high	95.5	Very high	30 Å²	30	59 Å²	59	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.3	166.9	176.5	0	0	0	0	107.5	L10 I73 I74 K75 I101 M106	L10-V26 HydrophobicContact CD1-CG2 4.01Å; L10-V26 HydrophobicContact CD2-CG2 4.1Å; V26-I73 HydrophobicContact CG1-CG2 3.82Å; V26-I74 WeakPolarHBondContact CA-O 3.47Å; V26-K75 HydrophobicContact CG2-CB 4.16Å; V26-K75 HydrophobicContact CG2-CG 4.06Å; V26-I101 HydrophobicContact CG1-CD1 3.85Å; V26-I101 HydrophobicContact CG2-CD1 4.21Å; V26-M106 HydrophobicContact CG1-CE 4.18Å; V26-M106 HydrophobicContact CG1-SD 4.05Å; V26-M106 WeakPolarHBondContact O-CE 3.21Å
27	F	98.4	Very high	95.3	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.009	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160	180	54.9	-106.9	0	0	0	110.9	I13 I25 V29 V49 A50 I58 I73 I74 L76 L98	I13-F27 HydrophobicContact CD1-CB 4.42Å; I25-F27 HydrophobicContact CB-CD1 4.47Å; I25-F27 HydrophobicContact CG2-CD1 4.01Å; F27-V29 HydrophobicContact CE2-CG2 4.34Å; F27-V49 HydrophobicContact CB-CB 4.13Å; F27-V49 HydrophobicContact CB-CG2 4.3Å; F27-V49 HydrophobicContact CD1-CG2 4.21Å; F27-V49 HydrophobicContact CD2-CB 3.45Å; F27-V49 VanDerWaalsContact CD2-CB 3.45Å; F27-V49 HydrophobicContact CD2-CG1 3.56Å; F27-V49 HydrophobicContact CD2-CG2 3.91Å; F27-V49 HydrophobicContact CE2-CB 3.97Å; F27-V49 HydrophobicContact CE2-CG1 3.58Å; F27-V49 HydrophobicContact CE2-CG2 4.26Å; F27-V49 HydrophobicContact CG-CB 3.83Å; F27-V49 HydrophobicContact CG-CG1 4.38Å; F27-V49 HydrophobicContact CG-CG2 3.88Å; F27-V49 HydrophobicContact CZ-CG1 4.4Å; F27-A50 CarbonylContact C-O 3.53Å; F27-A50 VanDerWaalsContact CA-O 3.29Å; F27-A50 WeakPolarHBondContact CA-O 3.16Å; F27-A50 WeakPolarHBondContact CB-O 3.48Å; F27-I58 HydrophobicContact CE1-CD1 4.08Å; F27-I58 HydrophobicContact CZ-CD1 3.67Å; F27-I73 WeakPolarHBondContact O-CA 3.17Å; F27-I74 HydrophobicContact CD2-CB 4.29Å; F27-I74 HydrophobicContact CE2-CB 3.71Å; F27-I74 HydrophobicContact CE2-CD1 4.35Å; F27-I74 HydrophobicContact CE2-CG1 4.46Å; F27-I74 HydrophobicContact CE2-CG2 4.18Å; F27-I74 HydrophobicContact CZ-CB 4.11Å; F27-I74 HydrophobicContact CZ-CG2 4.08Å; F27-I74 PolarHBondContact N-O 2.79Å; F27-I74 PolarHBondContact O-N 2.86Å; F27-L76 HydrophobicContact CE1-CB 3.76Å; F27-L76 HydrophobicContact CE1-CD2 4.3Å; F27-L76 HydrophobicContact CZ-CB 4.43Å; F27-L98 HydrophobicContact CZ-CD2 4.15Å
28	I	98.4	Very high	95.1	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	141.3	167.4	-171.1	167.9	0	0	0	110	L30 V49 A50 D72 I73 M106 Y108	I28-L30 HydrophobicContact CG2-CD2 4.01Å; I28-V49 CarbonylContact O-C 3.55Å; I28-V49 VanDerWaalsContact O-CA 3.25Å; I28-V49 WeakPolarHBondContact O-CA 3.43Å; I28-A50 WeakPolarHBondContact CG2-O 3.35Å; I28-A50 PolarHBondContact N-O 2.86Å; I28-A50 PolarHBondContact O-N 2.82Å; I28-D72 CarbonylContact C-O 3.5Å; I28-D72 WeakPolarHBondContact CA-O 3.44Å; I28-I73 HydrophobicContact CG1-CG1 4.41Å; I28-M106 HydrophobicContact CB-CB 4.18Å; I28-M106 HydrophobicContact CB-CG 4.46Å; I28-M106 HydrophobicContact CB-SD 4.12Å; I28-M106 HydrophobicContact CD1-CB 4.31Å; I28-Y108 HydrophobicContact CD1-CD1 4.48Å; I28-Y108 HydrophobicContact CG2-CD1 3.65Å; I28-Y108 HydrophobicContact CG2-CE1 4.45Å; I28-Y108 HydrophobicContact CG2-CG 3.75Å
29	V	98.4	Very high	95	Very high	3 Å²	3	67.5 Å²	67.5	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	124.4	175.4	-177.3	0	0	0	0	109.4	F27 V49 I68 Q69 G71 D72 I74	F27-V29 HydrophobicContact CE2-CG2 4.34Å; V29-V49 HydrophobicContact CG2-CG1 4.09Å; V29-I68 HydrophobicContact CB-CG2 4.39Å; V29-I68 HydrophobicContact CG1-CG2 3.93Å; V29-I68 HydrophobicContact CG2-CG2 3.82Å; V29-Q69 WeakPolarHBondContact CB-O 3.32Å; V29-G71 PolarHBondContact O-N 2.85Å; V29-D72 HydrophobicContact CG2-CB 4.14Å; V29-D72 PolarHBondContact N-O 2.88Å; V29-I74 HydrophobicContact CG2-CD1 3.76Å; V29-I74 HydrophobicContact CG2-CG1 4.41Å
30	L	97.7	Very high	94.8	Very high	26 Å²	26	71.1 Å²	71.1	14%	0.136	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-52.2	179.1	-56.8	-174.2	0	0	0	111.3	I28 K48 A50 Y108 E110	I28-L30 HydrophobicContact CG2-CD2 4.01Å; L30-K48 HydrophobicContact CB-CB 4.49Å; L30-K48 HydrophobicContact CB-CD 4.36Å; L30-K48 HydrophobicContact CB-CG 4.41Å; L30-K48 HydrophobicContact CD1-CD 4.17Å; L30-K48 HydrophobicContact CD1-CG 4.33Å; L30-K48 PolarHBondContact N-O 2.74Å; L30-A50 HydrophobicContact CD1-CB 3.57Å; L30-A50 HydrophobicContact CD2-CB 4.29Å; L30-A50 HydrophobicContact CG-CB 3.96Å; L30-Y108 HydrophobicContact CD1-CD2 4.2Å; L30-Y108 HydrophobicContact CD1-CE2 4.11Å; L30-Y108 HydrophobicContact CD2-CD1 4.31Å; L30-Y108 HydrophobicContact CD2-CD2 3.69Å; L30-Y108 HydrophobicContact CD2-CE1 4.08Å; L30-Y108 HydrophobicContact CD2-CE2 3.43Å; L30-Y108 VanDerWaalsContact CD2-CE2 3.43Å; L30-Y108 HydrophobicContact CD2-CG 4.12Å; L30-Y108 HydrophobicContact CG-CE2 4.43Å; L30-E110 HydrophobicContact CD1-CG 3.78Å
31	E	97.1	Very high	94.7	Very high	111 Å²	111	71.3 Å²	71.3	52%	0.519	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.4	-173.8	-62.6	173.9	-168.9	0	0	111.1	C47 K48	E31-C47 CarbonylContact O-C 3.55Å; E31-C47 VanDerWaalsContact O-CA 3.29Å; E31-C47 WeakPolarHBondContact O-CA 3.09Å; E31-K48 HydrophobicContact CB-CB 4.04Å; E31-K48 HydrophobicContact CG-CD 4.5Å; E31-K48 PolarHBondContact N-O 3.28Å; E31-K48 PolarHBondContact O-N 2.92Å
32	I	96.1	Very high	94.6	Very high	56 Å²	56	67.2 Å²	67.2	29%	0.287	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.8	169.2	-65.7	175.8	0	0	0	108.4	R45 I68 P70	I32-R45 VanDerWaalsContact CG2-CD 3.44Å; I32-R45 HydrophobicContact CG2-CG 3.82Å; I32-I68 WeakPolarHBondContact CD1-O 3.45Å; I32-P70 HydrophobicContact CD1-CG 4.25Å; I32-P70 HydrophobicContact CG1-CG 4.31Å
33	G	92.5	Very high	94.6	Very high	38 Å²	38	65.9 Å²	65.9	39%	0.392	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-162.2	177.6	0	0	0	0	0	113.2	S46	G33-S46 WeakPolarHBondContact CA-O 3.34Å; G33-S46 PolarHBondContact N-O 2.89Å
34	R	89.3	Confident	94.5	Very high	220 Å²	220	66.5 Å²	66.5	83%	0.83	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	141.5	-174.3	-61.7	-175.7	-174.6	-162	1.3	111.9	S46	R34-S46 PolarHBondContact O-N 3.05Å
35	V	93.4	Very high	94.4	Very high	72 Å²	72	68.2 Å²	68.2	44%	0.436	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.7	166.7	-177	0	0	0	0	108.6	E43 R45	V35-E43 HydrophobicContact CG1-CB 4.25Å; V35-R45 HydrophobicContact CG2-CB 4.4Å; V35-R45 HydrophobicContact CG2-CG 4.17Å
36	T	93.2	Very high	94.3	Very high	83 Å²	83	70.6 Å²	70.6	51%	0.509	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.1	174.8	57.9	0	0	0	0	109.1	E43 V44	T36-E43 CarbonylContact O-C 3.56Å; T36-V44 PolarHBondContact N-O 2.86Å; T36-V44 PolarHBondContact O-N 3.23Å; T36-V44 PolarHBondContact OG1-O 2.88Å
37	K	92.9	Very high	94.3	Very high	148 Å²	148	69.3 Å²	69.3	64%	0.643	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.6	176.7	-160.1	167.8	-175.7	167.6	0	109.4	G41 H42 E43	K37-G41 WeakPolarHBondContact CE-O 3.34Å; K37-H42 CarbonylContact C-O 3.55Å; K37-H42 WeakPolarHBondContact CA-O 3.48Å; K37-E43 HydrophobicContact CG-CG 4.48Å
38	T	90.7	Very high	94.2	Very high	41 Å²	41	71.4 Å²	71.4	25%	0.252	36%	0.363	S	S	.	.			trans	-74.4	164.5	174.1	69.5	0	0	0	0	110.3	D40 G41 H42 V44 W61	T38-D40 PolarHBondContact O-N 3.15Å; T38-G41 PolarHBondContact O-N 2.84Å; T38-H42 HydrophobicContact CG2-CB 4.35Å; T38-H42 PolarHBondContact N-O 3.1Å; T38-H42 WeakPolarHBondContact OG1-CB 3.43Å; T38-H42 PolarHBondContact OG1-N 2.91Å; T38-H42 VanDerWaalsContact OG1-N 3.14Å; T38-H42 PolarHBondContact OG1-O 3.34Å; T38-V44 HydrophobicContact CG2-CG2 3.9Å; T38-W61 HydrophobicContact CG2-CH2 3.8Å; T38-W61 HydrophobicContact CG2-CZ3 3.65Å
39	K	90.8	Very high	94.2	Very high	216 Å²	216	71.1 Å²	71.1	94%	0.939	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.3	176.8	-64.8	-175.5	178.7	-176.9	0	112.5	G41	K39-G41 PolarHBondContact O-N 2.51Å
40	D	89.6	Confident	94.2	Very high	130 Å²	130	71 Å²	71	70%	0.695	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	2.5	-178.8	-51.1	-30.2	0	0	0	112.2	T38	T38-D40 PolarHBondContact O-N 3.15Å
41	G	91.6	Very high	94.3	Very high	37 Å²	37	69.9 Å²	69.9	38%	0.381	36%	0.355	S	S	.	.	S	Bend	trans	92	-0.7	174.3	0	0	0	0	0	115.7	K37 T38 K39	K37-G41 WeakPolarHBondContact CE-O 3.34Å; T38-G41 PolarHBondContact O-N 2.84Å; K39-G41 PolarHBondContact O-N 2.51Å
42	H	93.1	Very high	94.3	Very high	61 Å²	61	71.6 Å²	71.6	28%	0.282	36%	0.36	S	S	.	.			trans	-73.4	138.3	176.9	-68.2	-77.5	0	0	0	111.9	K37 T38 W61 D62	K37-H42 CarbonylContact C-O 3.55Å; K37-H42 WeakPolarHBondContact CA-O 3.48Å; T38-H42 HydrophobicContact CG2-CB 4.35Å; T38-H42 PolarHBondContact N-O 3.1Å; T38-H42 WeakPolarHBondContact OG1-CB 3.43Å; T38-H42 PolarHBondContact OG1-N 2.91Å; T38-H42 VanDerWaalsContact OG1-N 3.14Å; T38-H42 PolarHBondContact OG1-O 3.34Å; H42-W61 HydrophobicContact CB-CE3 3.8Å; H42-W61 HydrophobicContact CB-CZ3 3.81Å; H42-D62 IonicContact CE1-OD1 3.43Å; H42-D62 IonicContact CE1-OD2 3.55Å; H42-D62 IonicContact CG-OD1 3.9Å; H42-D62 IonicContact ND1-OD1 2.77Å; H42-D62 PolarHBondContact ND1-OD1 3Å; H42-D62 IonicContact ND1-OD2 2.71Å; H42-D62 PolarHBondContact ND1-OD2 3.36Å
43	E	94.5	Very high	94.4	Very high	90 Å²	90	69.9 Å²	69.9	42%	0.421	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.5	174.2	-65.1	-169.6	166.2	0	0	110.3	V35 T36 K37 W61 D62	V35-E43 HydrophobicContact CG1-CB 4.25Å; T36-E43 CarbonylContact O-C 3.56Å; K37-E43 HydrophobicContact CG-CG 4.48Å; E43-W61 CarbonylContact O-C 3.57Å; E43-W61 WeakPolarHBondContact O-CA 3.27Å; E43-D62 PolarHBondContact O-N 2.79Å
44	V	95.1	Very high	94.6	Very high	15 Å²	15	68 Å²	68	9%	0.091	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.6	178.2	-170	0	0	0	0	108.5	T36 T38 V60 W61	T36-V44 PolarHBondContact N-O 2.86Å; T36-V44 PolarHBondContact O-N 3.23Å; T36-V44 PolarHBondContact OG1-O 2.88Å; T38-V44 HydrophobicContact CG2-CG2 3.9Å; V44-V60 WeakPolarHBondContact CA-O 3.43Å; V44-W61 HydrophobicContact CG1-CD2 4.46Å; V44-W61 HydrophobicContact CG2-CD2 3.56Å; V44-W61 HydrophobicContact CG2-CE3 3.5Å; V44-W61 HydrophobicContact CG2-CG 4.29Å; V44-W61 HydrophobicContact CG2-CH2 3.72Å; V44-W61 HydrophobicContact CG2-CZ2 3.78Å; V44-W61 HydrophobicContact CG2-CZ3 3.58Å
45	R	95	Very high	95.1	Very high	47 Å²	47	57.6 Å²	57.6	18%	0.177	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	179	-171.7	-179.8	-83.7	-168.5	-1.2	109.2	I32 V35 V60 G65 S66	I32-R45 VanDerWaalsContact CG2-CD 3.44Å; I32-R45 HydrophobicContact CG2-CG 3.82Å; V35-R45 HydrophobicContact CG2-CB 4.4Å; V35-R45 HydrophobicContact CG2-CG 4.17Å; R45-V60 PolarHBondContact N-O 3.26Å; R45-V60 PolarHBondContact O-N 3.2Å; R45-G65 WeakPolarHBondContact CD-O 3.36Å; R45-G65 VanDerWaalsContact CZ-O 3.23Å; R45-G65 PolarHBondContact NE-O 3.45Å; R45-G65 PolarHBondContact NH1-O 2.81Å; R45-S66 PolarHBondContact NH1-O 2.83Å
46	S	95.1	Very high	95.3	Very high	51 Å²	51	54.1 Å²	54.1	36%	0.357	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.3	173.3	-171.4	0	0	0	0	108.9	G33 R34 I58	G33-S46 WeakPolarHBondContact CA-O 3.34Å; G33-S46 PolarHBondContact N-O 2.89Å; R34-S46 PolarHBondContact O-N 3.05Å; S46-I58 CarbonylContact C-O 3.55Å; S46-I58 WeakPolarHBondContact CA-O 3.29Å
47	C	96.9	Very high	95.5	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.02	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144	177.4	-51.2	0	0	0	0	110	E31 V49 A57 I58	E31-C47 CarbonylContact O-C 3.55Å; E31-C47 VanDerWaalsContact O-CA 3.29Å; E31-C47 WeakPolarHBondContact O-CA 3.09Å; C47-V49 HydrophobicContact CB-CG1 4.42Å; C47-A57 CarbonylContact O-C 3.53Å; C47-A57 VanDerWaalsContact O-CA 3.31Å; C47-A57 WeakPolarHBondContact O-CA 3.33Å; C47-I58 HydrophobicContact CB-CG2 3.86Å; C47-I58 PolarHBondContact N-O 3.49Å; C47-I58 PolarHBondContact O-N 2.77Å
48	K	97.7	Very high	95.7	Very high	46 Å²	46	44 Å²	44	20%	0.2	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.8	167.5	-172.7	-172.1	-176.9	-172.7	0	107.8	L30 E31 E110	L30-K48 HydrophobicContact CB-CB 4.49Å; L30-K48 HydrophobicContact CB-CD 4.36Å; L30-K48 HydrophobicContact CB-CG 4.41Å; L30-K48 HydrophobicContact CD1-CD 4.17Å; L30-K48 HydrophobicContact CD1-CG 4.33Å; L30-K48 PolarHBondContact N-O 2.74Å; E31-K48 HydrophobicContact CB-CB 4.04Å; E31-K48 HydrophobicContact CG-CD 4.5Å; E31-K48 PolarHBondContact N-O 3.28Å; E31-K48 PolarHBondContact O-N 2.92Å; K48-E110 IonicContact NZ-OE2 3.15Å; K48-E110 PolarHBondContact NZ-OE2 2.77Å
49	V	98.4	Very high	96	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	155.6	179.5	-57.9	0	0	0	0	110.1	F27 I28 V29 C47 S55 I56 I58	F27-V49 HydrophobicContact CB-CB 4.13Å; F27-V49 HydrophobicContact CB-CG2 4.3Å; F27-V49 HydrophobicContact CD1-CG2 4.21Å; F27-V49 HydrophobicContact CD2-CB 3.45Å; F27-V49 VanDerWaalsContact CD2-CB 3.45Å; F27-V49 HydrophobicContact CD2-CG1 3.56Å; F27-V49 HydrophobicContact CD2-CG2 3.91Å; F27-V49 HydrophobicContact CE2-CB 3.97Å; F27-V49 HydrophobicContact CE2-CG1 3.58Å; F27-V49 HydrophobicContact CE2-CG2 4.26Å; F27-V49 HydrophobicContact CG-CB 3.83Å; F27-V49 HydrophobicContact CG-CG1 4.38Å; F27-V49 HydrophobicContact CG-CG2 3.88Å; F27-V49 HydrophobicContact CZ-CG1 4.4Å; I28-V49 CarbonylContact O-C 3.55Å; I28-V49 VanDerWaalsContact O-CA 3.25Å; I28-V49 WeakPolarHBondContact O-CA 3.43Å; V29-V49 HydrophobicContact CG2-CG1 4.09Å; C47-V49 HydrophobicContact CB-CG1 4.42Å; V49-S55 CarbonylContact O-C 3.58Å; V49-S55 VanDerWaalsContact O-CA 3.23Å; V49-S55 WeakPolarHBondContact O-CA 3.32Å; V49-S55 WeakPolarHBondContact O-CB 3.47Å; V49-I56 HydrophobicContact CG2-CG2 3.72Å; V49-I56 WeakPolarHBondContact CG2-O 3.27Å; V49-I56 PolarHBondContact N-O 3.38Å; V49-I56 PolarHBondContact O-N 2.98Å; V49-I56 VanDerWaalsContact O-O 3.1Å; V49-I58 HydrophobicContact CG1-CG2 3.55Å; V49-I58 HydrophobicContact CG2-CB 4.37Å; V49-I58 HydrophobicContact CG2-CG2 4.12Å
50	A	98.6	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	159	-176.9	0	0	0	0	0	113.6	F27 I28 L30 G54 Y108	F27-A50 CarbonylContact C-O 3.53Å; F27-A50 VanDerWaalsContact CA-O 3.29Å; F27-A50 WeakPolarHBondContact CA-O 3.16Å; F27-A50 WeakPolarHBondContact CB-O 3.48Å; I28-A50 WeakPolarHBondContact CG2-O 3.35Å; I28-A50 PolarHBondContact N-O 2.86Å; I28-A50 PolarHBondContact O-N 2.82Å; L30-A50 HydrophobicContact CD1-CB 3.57Å; L30-A50 HydrophobicContact CD2-CB 4.29Å; L30-A50 HydrophobicContact CG-CB 3.96Å; A50-G54 WeakPolarHBondContact CA-O 3.48Å; A50-G54 WeakPolarHBondContact CB-O 3.37Å; A50-Y108 HydrophobicContact CB-CD2 4.02Å; A50-Y108 HydrophobicContact CB-CG 4.3Å
51	D	98.1	Very high	96.4	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	-174.2	166.9	75.1	2.6	0	0	0	108.5	L12 I13 S53 G54 M106 Y108 S109	L12-D51 VanDerWaalsContact CA-OD2 3.32Å; L12-D51 WeakPolarHBondContact CA-OD2 3.14Å; L12-D51 WeakPolarHBondContact CD2-OD2 3.32Å; I13-D51 HydrophobicContact CD1-CB 3.87Å; I13-D51 VanDerWaalsContact CD1-N 3.33Å; I13-D51 HydrophobicContact CG1-CB 4.27Å; I13-D51 PolarHBondContact N-OD2 3.29Å; D51-S53 PolarHBondContact O-N 3.48Å; D51-S53 VanDerWaalsContact OD1-CA 3.32Å; D51-S53 WeakPolarHBondContact OD1-CA 3.25Å; D51-S53 VanDerWaalsContact OD1-CB 3.26Å; D51-S53 WeakPolarHBondContact OD1-CB 3.37Å; D51-S53 PolarHBondContact OD1-N 3.09Å; D51-S53 PolarHBondContact OD1-OG 2.88Å; D51-S53 PolarHBondContact OD2-OG 2.93Å; D51-G54 PolarHBondContact N-O 3.36Å; D51-G54 VanDerWaalsContact N-O 3.09Å; D51-G54 PolarHBondContact O-N 3.24Å; D51-G54 PolarHBondContact OD1-N 3.24Å; D51-M106 HydrophobicContact CB-CE 3.91Å; D51-Y108 CarbonylContact O-C 3.59Å; D51-Y108 WeakPolarHBondContact O-CA 3.44Å; D51-S109 PolarHBondContact O-N 2.84Å
52	K	97.6	Very high	96.5	Very high	146 Å²	146	27.3 Å²	27.3	64%	0.635	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.7	179.2	66.5	177.8	178.6	-179.2	0	115	L12	L12-K52 HydrophobicContact CD2-CG 4.33Å
53	S	98.1	Very high	96.5	Very high	20 Å²	20	30.6 Å²	30.6	14%	0.14	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-15.6	-174	76.2	0	0	0	0	114.4	I13 K14 D51	I13-S53 PolarHBondContact N-OG 2.84Å; K14-S53 PolarHBondContact N-OG 3.47Å; D51-S53 PolarHBondContact O-N 3.48Å; D51-S53 VanDerWaalsContact OD1-CA 3.32Å; D51-S53 WeakPolarHBondContact OD1-CA 3.25Å; D51-S53 VanDerWaalsContact OD1-CB 3.26Å; D51-S53 WeakPolarHBondContact OD1-CB 3.37Å; D51-S53 PolarHBondContact OD1-N 3.09Å; D51-S53 PolarHBondContact OD1-OG 2.88Å; D51-S53 PolarHBondContact OD2-OG 2.93Å
54	G	97.8	Very high	96.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.8	-168.3	177.7	0	0	0	0	0	112.3	I13 A50 D51 S109 P112	I13-G54 WeakPolarHBondContact CD1-O 3.49Å; A50-G54 WeakPolarHBondContact CA-O 3.48Å; A50-G54 WeakPolarHBondContact CB-O 3.37Å; D51-G54 PolarHBondContact N-O 3.36Å; D51-G54 VanDerWaalsContact N-O 3.09Å; D51-G54 PolarHBondContact O-N 3.24Å; D51-G54 PolarHBondContact OD1-N 3.24Å; G54-S109 CarbonylContact C-O 3.53Å; G54-S109 WeakPolarHBondContact CA-O 3.37Å; G54-P112 WeakPolarHBondContact CA-O 3.37Å
55	S	98.3	Very high	96.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	154.3	-179	68.8	0	0	0	0	113.3	V49 E110 P112 N113 F114	V49-S55 CarbonylContact O-C 3.58Å; V49-S55 VanDerWaalsContact O-CA 3.23Å; V49-S55 WeakPolarHBondContact O-CA 3.32Å; V49-S55 WeakPolarHBondContact O-CB 3.47Å; S55-E110 WeakPolarHBondContact CB-O 3.39Å; S55-E110 PolarHBondContact OG-O 2.86Å; S55-P112 PolarHBondContact N-O 3.03Å; S55-N113 CarbonylContact O-C 3.58Å; S55-N113 WeakPolarHBondContact O-CA 3.48Å; S55-N113 WeakPolarHBondContact OG-CA 3.35Å; S55-N113 WeakPolarHBondContact OG-CB 3.29Å; S55-F114 WeakPolarHBondContact O-CD2 3.42Å; S55-F114 PolarHBondContact O-N 2.56Å
56	I	98	Very high	96	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.7	178.2	-165.8	166	0	0	0	109.4	I13 V16 V49 L88 L90 F114 S115	I13-I56 HydrophobicContact CD1-CG2 3.88Å; I13-I56 HydrophobicContact CG1-CG2 4.04Å; I13-I56 HydrophobicContact CG2-CB 3.74Å; I13-I56 HydrophobicContact CG2-CD1 4.44Å; I13-I56 HydrophobicContact CG2-CG2 3.79Å; V16-I56 HydrophobicContact CB-CD1 4.37Å; V16-I56 HydrophobicContact CG1-CD1 4.09Å; V49-I56 HydrophobicContact CG2-CG2 3.72Å; V49-I56 WeakPolarHBondContact CG2-O 3.27Å; V49-I56 PolarHBondContact N-O 3.38Å; V49-I56 PolarHBondContact O-N 2.98Å; V49-I56 VanDerWaalsContact O-O 3.1Å; I56-L88 HydrophobicContact CD1-CD2 4.09Å; I56-L88 HydrophobicContact CD1-CG 4.06Å; I56-L90 HydrophobicContact CD1-CD1 4.24Å; I56-L90 HydrophobicContact CD1-CD2 4.36Å; I56-L90 HydrophobicContact CD1-CG 3.82Å; I56-L90 HydrophobicContact CG1-CG 4.32Å; I56-L90 HydrophobicContact CG2-CD1 3.56Å; I56-L90 HydrophobicContact CG2-CG 4.17Å; I56-F114 HydrophobicContact CB-CB 4.48Å; I56-F114 HydrophobicContact CD1-CB 4.41Å; I56-F114 HydrophobicContact CG1-CB 4.39Å; I56-S115 WeakPolarHBondContact CG1-OG 3.48Å
57	A	97.2	Very high	96	Very high	15 Å²	15	28.9 Å²	28.9	12%	0.124	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	137.7	173.7	0	0	0	0	0	109.9	C47 T89 L90 S115	C47-A57 CarbonylContact O-C 3.53Å; C47-A57 VanDerWaalsContact O-CA 3.31Å; C47-A57 WeakPolarHBondContact O-CA 3.33Å; A57-T89 HydrophobicContact CB-CG2 4.47Å; A57-T89 CarbonylContact O-C 3.54Å; A57-T89 WeakPolarHBondContact O-CA 3.32Å; A57-L90 PolarHBondContact O-N 3.34Å; A57-S115 VanDerWaalsContact CB-OG 3.3Å; A57-S115 WeakPolarHBondContact CB-OG 3.25Å; A57-S115 PolarHBondContact N-OG 2.99Å
58	I	97.5	Very high	95.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.2	169.4	-172.1	172.1	0	0	0	109.3	F27 S46 C47 V49 V60 L76 L90 L98	F27-I58 HydrophobicContact CE1-CD1 4.08Å; F27-I58 HydrophobicContact CZ-CD1 3.67Å; S46-I58 CarbonylContact C-O 3.55Å; S46-I58 WeakPolarHBondContact CA-O 3.29Å; C47-I58 HydrophobicContact CB-CG2 3.86Å; C47-I58 PolarHBondContact N-O 3.49Å; C47-I58 PolarHBondContact O-N 2.77Å; V49-I58 HydrophobicContact CG1-CG2 3.55Å; V49-I58 HydrophobicContact CG2-CB 4.37Å; V49-I58 HydrophobicContact CG2-CG2 4.12Å; I58-V60 HydrophobicContact CD1-CG2 4.26Å; I58-V60 HydrophobicContact CG1-CG2 4.1Å; I58-V60 HydrophobicContact CG2-CG2 4.21Å; I58-L76 HydrophobicContact CD1-CD2 4.42Å; I58-L90 WeakPolarHBondContact CA-O 3.31Å; I58-L90 HydrophobicContact CB-CB 3.99Å; I58-L90 HydrophobicContact CD1-CB 4.34Å; I58-L90 HydrophobicContact CG1-CB 3.87Å; I58-L90 WeakPolarHBondContact CG1-O 3.31Å; I58-L98 HydrophobicContact CD1-CD2 4.12Å
59	S	96.7	Very high	95.9	Very high	10 Å²	10	32 Å²	32	7%	0.07	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.5	170.5	-65.3	0	0	0	0	110.2	T89 L90	S59-T89 WeakPolarHBondContact OG-CG2 3.37Å; S59-L90 PolarHBondContact N-O 3.33Å
60	V	96.1	Very high	95.9	Very high	2 Å²	2	35 Å²	35	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.2	-179	-169.2	0	0	0	0	109.4	V44 R45 I58 L64 I68 L98	V44-V60 WeakPolarHBondContact CA-O 3.43Å; R45-V60 PolarHBondContact N-O 3.26Å; R45-V60 PolarHBondContact O-N 3.2Å; I58-V60 HydrophobicContact CD1-CG2 4.26Å; I58-V60 HydrophobicContact CG1-CG2 4.1Å; I58-V60 HydrophobicContact CG2-CG2 4.21Å; V60-L64 HydrophobicContact CG1-CB 3.64Å; V60-I68 HydrophobicContact CB-CD1 4.1Å; V60-I68 HydrophobicContact CG1-CD1 3.83Å; V60-I68 HydrophobicContact CG2-CD1 3.71Å; V60-L98 HydrophobicContact CG1-CD1 3.73Å; V60-L98 HydrophobicContact CG2-CD1 3.96Å
61	W	93.5	Very high	95.8	Very high	37 Å²	37	35.5 Å²	35.5	14%	0.14	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.9	-170.5	-68.4	69.6	0	0	0	112	T38 H42 E43 V44 P216	T38-W61 HydrophobicContact CG2-CH2 3.8Å; T38-W61 HydrophobicContact CG2-CZ3 3.65Å; H42-W61 HydrophobicContact CB-CE3 3.8Å; H42-W61 HydrophobicContact CB-CZ3 3.81Å; E43-W61 CarbonylContact O-C 3.57Å; E43-W61 WeakPolarHBondContact O-CA 3.27Å; V44-W61 HydrophobicContact CG1-CD2 4.46Å; V44-W61 HydrophobicContact CG2-CD2 3.56Å; V44-W61 HydrophobicContact CG2-CE3 3.5Å; V44-W61 HydrophobicContact CG2-CG 4.29Å; V44-W61 HydrophobicContact CG2-CH2 3.72Å; V44-W61 HydrophobicContact CG2-CZ2 3.78Å; V44-W61 HydrophobicContact CG2-CZ3 3.58Å; W61-P216 HydrophobicContact CH2-CG 3.93Å; W61-P216 HydrophobicContact CZ3-CG 3.76Å
62	D	93.4	Very high	95.8	Very high	26 Å²	26	35.9 Å²	35.9	14%	0.139	19%	0.189	C	C	.	.	H	α-helix	trans	53.6	-143.5	173.6	-55.4	-34.4	0	0	0	113.1	H42 E43 L64 G65 S66 R214	H42-D62 IonicContact CE1-OD1 3.43Å; H42-D62 IonicContact CE1-OD2 3.55Å; H42-D62 IonicContact CG-OD1 3.9Å; H42-D62 IonicContact ND1-OD1 2.77Å; H42-D62 PolarHBondContact ND1-OD1 3Å; H42-D62 IonicContact ND1-OD2 2.71Å; H42-D62 PolarHBondContact ND1-OD2 3.36Å; E43-D62 PolarHBondContact O-N 2.79Å; D62-L64 PolarHBondContact O-N 3.05Å; D62-G65 WeakPolarHBondContact O-CA 3.11Å; D62-G65 PolarHBondContact O-N 3.28Å; D62-S66 PolarHBondContact O-N 3.39Å; D62-R214 IonicContact OD2-NH1 2.69Å; D62-R214 PolarHBondContact OD2-NH1 3.25Å
63	E	92.5	Very high	95.9	Very high	129 Å²	129	29.9 Å²	29.9	60%	0.603	16%	0.164	S	C	*	.	H	α-helix	trans	-55.2	-32.3	-178.8	-174.1	178.4	-170.3	0	0	113.5	G65 S66 L67	E63-G65 PolarHBondContact O-N 3.41Å; E63-S66 PolarHBondContact O-N 3.35Å; E63-S66 VanDerWaalsContact O-N 3.09Å; E63-S66 PolarHBondContact O-OG 2.83Å; E63-L67 HydrophobicContact CG-CD1 4.26Å; E63-L67 HydrophobicContact CG-CG 4.47Å; E63-L67 WeakPolarHBondContact O-CG 3.47Å; E63-L67 PolarHBondContact O-N 3.36Å; E63-L67 VanDerWaalsContact O-N 3.15Å
64	L	90.4	Very high	95.9	Very high	17 Å²	17	29.2 Å²	29.2	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-37	174.9	-73	-179.3	0	0	0	111.8	V60 D62 S66 I68 I210 N212	V60-L64 HydrophobicContact CG1-CB 3.64Å; D62-L64 PolarHBondContact O-N 3.05Å; L64-S66 VanDerWaalsContact C-N 3.32Å; L64-I68 WeakPolarHBondContact O-CG1 3.18Å; L64-I210 HydrophobicContact CD2-CB 3.63Å; L64-I210 HydrophobicContact CD2-CD1 3.78Å; L64-I210 HydrophobicContact CD2-CG1 4.29Å; L64-I210 HydrophobicContact CD2-CG2 3.37Å; L64-I210 HydrophobicContact CG-CG2 4.22Å; L64-N212 HydrophobicContact CD1-CB 3.99Å
65	G	92.2	Very high	95.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-65	-38.6	176.2	0	0	0	0	0	111.6	R45 D62 E63	R45-G65 WeakPolarHBondContact CD-O 3.36Å; R45-G65 VanDerWaalsContact CZ-O 3.23Å; R45-G65 PolarHBondContact NE-O 3.45Å; R45-G65 PolarHBondContact NH1-O 2.81Å; D62-G65 WeakPolarHBondContact O-CA 3.11Å; D62-G65 PolarHBondContact O-N 3.28Å; E63-G65 PolarHBondContact O-N 3.41Å
66	S	92.6	Very high	95.8	Very high	54 Å²	54	32.1 Å²	32.1	38%	0.378	17%	0.171	S	C	.	.	H	α-helix	trans	-71.9	-30.4	-177.7	66.3	0	0	0	0	113.5	R45 D62 E63 L64	R45-S66 PolarHBondContact NH1-O 2.83Å; D62-S66 PolarHBondContact O-N 3.39Å; E63-S66 PolarHBondContact O-N 3.35Å; E63-S66 VanDerWaalsContact O-N 3.09Å; E63-S66 PolarHBondContact O-OG 2.83Å; L64-S66 VanDerWaalsContact C-N 3.32Å
67	L	94.2	Very high	95.8	Very high	96 Å²	96	33.1 Å²	33.1	50%	0.503	18%	0.177	S	C	.	.	H	α-helix	trans	-76.5	-27.3	-178.6	-66.7	173.9	0	0	0	114.3	E63 I210	E63-L67 HydrophobicContact CG-CD1 4.26Å; E63-L67 HydrophobicContact CG-CG 4.47Å; E63-L67 WeakPolarHBondContact O-CG 3.47Å; E63-L67 PolarHBondContact O-N 3.36Å; E63-L67 VanDerWaalsContact O-N 3.15Å; L67-I210 HydrophobicContact CD1-CD1 3.98Å
68	I	95.8	Very high	95.7	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.067	19%	0.193	C	C	.	.			trans	-66.4	137.1	-178.2	-70.6	169.4	0	0	0	111	V29 I32 V60 L64 I74 L98	V29-I68 HydrophobicContact CB-CG2 4.39Å; V29-I68 HydrophobicContact CG1-CG2 3.93Å; V29-I68 HydrophobicContact CG2-CG2 3.82Å; I32-I68 WeakPolarHBondContact CD1-O 3.45Å; V60-I68 HydrophobicContact CB-CD1 4.1Å; V60-I68 HydrophobicContact CG1-CD1 3.83Å; V60-I68 HydrophobicContact CG2-CD1 3.71Å; L64-I68 WeakPolarHBondContact O-CG1 3.18Å; I68-I74 HydrophobicContact CD1-CD1 4.05Å; I68-I74 HydrophobicContact CG1-CD1 3.83Å; I68-I74 HydrophobicContact CG2-CD1 4.28Å; I68-L98 HydrophobicContact CD1-CD1 4.42Å
69	Q	97.1	Very high	95.7	Very high	101 Å²	101	38.1 Å²	38.1	47%	0.472	19%	0.192	S	C	.	.			trans	-123.9	154	174.9	-62.8	-57.9	-46.5	0	0	112	V29 D72	V29-Q69 WeakPolarHBondContact CB-O 3.32Å; Q69-D72 PolarHBondContact N-OD2 2.85Å; Q69-D72 WeakPolarHBondContact O-CB 3.43Å; Q69-D72 VanDerWaalsContact O-CG 3.31Å; Q69-D72 PolarHBondContact O-N 3.09Å
70	P	97.8	Very high	95.7	Very high	63 Å²	63	39.5 Å²	39.5	41%	0.409	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	139.4	168.1	-21.2	34.9	0	0	0	110.9	I32 D72	I32-P70 HydrophobicContact CD1-CG 4.25Å; I32-P70 HydrophobicContact CG1-CG 4.31Å; P70-D72 VanDerWaalsContact C-N 3.34Å
71	G	97.9	Very high	95.7	Very high	10 Å²	10	39.4 Å²	39.4	10%	0.103	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-11.9	-175.9	0	0	0	0	0	114.7	V29 I73 E103 F104	V29-G71 PolarHBondContact O-N 2.85Å; G71-I73 PolarHBondContact O-N 3.26Å; G71-E103 CarbonylContact O-C 3.52Å; G71-E103 WeakPolarHBondContact O-CA 3.29Å; G71-F104 PolarHBondContact O-N 2.8Å
72	D	98.3	Very high	95.8	Very high	11 Å²	11	39.9 Å²	39.9	6%	0.059	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	134.3	176.2	-75.6	-18	0	0	0	111.4	I28 V29 Q69 P70 I74 K100	I28-D72 CarbonylContact C-O 3.5Å; I28-D72 WeakPolarHBondContact CA-O 3.44Å; V29-D72 HydrophobicContact CG2-CB 4.14Å; V29-D72 PolarHBondContact N-O 2.88Å; Q69-D72 PolarHBondContact N-OD2 2.85Å; Q69-D72 WeakPolarHBondContact O-CB 3.43Å; Q69-D72 VanDerWaalsContact O-CG 3.31Å; Q69-D72 PolarHBondContact O-N 3.09Å; P70-D72 VanDerWaalsContact C-N 3.34Å; D72-I74 HydrophobicContact CB-CD1 4.13Å; D72-I74 HydrophobicContact CB-CG1 4.04Å; D72-K100 HydrophobicContact CB-CD 4.47Å; D72-K100 WeakPolarHBondContact OD1-CE 3.15Å; D72-K100 IonicContact OD1-NZ 2.86Å; D72-K100 PolarHBondContact OD1-NZ 3.07Å
73	I	98.3	Very high	95.7	Very high	21 Å²	21	41.1 Å²	41.1	11%	0.108	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	116.9	169.7	-55.2	167.4	0	0	0	107.6	V26 F27 I28 G71 I101 G102 M106	V26-I73 HydrophobicContact CG1-CG2 3.82Å; F27-I73 WeakPolarHBondContact O-CA 3.17Å; I28-I73 HydrophobicContact CG1-CG1 4.41Å; G71-I73 PolarHBondContact O-N 3.26Å; I73-I101 HydrophobicContact CB-CG1 4.36Å; I73-I101 HydrophobicContact CG2-CD1 4.05Å; I73-I101 HydrophobicContact CG2-CG1 3.79Å; I73-I101 WeakPolarHBondContact O-CG1 3.39Å; I73-I101 PolarHBondContact O-N 2.71Å; I73-G102 PolarHBondContact N-O 2.83Å; I73-G102 PolarHBondContact O-N 2.87Å; I73-M106 HydrophobicContact CD1-CB 3.67Å; I73-M106 HydrophobicContact CG1-CB 3.84Å; I73-M106 HydrophobicContact CG2-SD 3.87Å
74	I	98.1	Very high	95.5	Very high	6 Å²	6	41 Å²	41	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.5	-172.4	-58.7	177.2	0	0	0	109.6	V26 F27 V29 I68 D72 L98 Q99	V26-I74 WeakPolarHBondContact CA-O 3.47Å; F27-I74 HydrophobicContact CD2-CB 4.29Å; F27-I74 HydrophobicContact CE2-CB 3.71Å; F27-I74 HydrophobicContact CE2-CD1 4.35Å; F27-I74 HydrophobicContact CE2-CG1 4.46Å; F27-I74 HydrophobicContact CE2-CG2 4.18Å; F27-I74 HydrophobicContact CZ-CB 4.11Å; F27-I74 HydrophobicContact CZ-CG2 4.08Å; F27-I74 PolarHBondContact N-O 2.79Å; F27-I74 PolarHBondContact O-N 2.86Å; V29-I74 HydrophobicContact CG2-CD1 3.76Å; V29-I74 HydrophobicContact CG2-CG1 4.41Å; I68-I74 HydrophobicContact CD1-CD1 4.05Å; I68-I74 HydrophobicContact CG1-CD1 3.83Å; I68-I74 HydrophobicContact CG2-CD1 4.28Å; D72-I74 HydrophobicContact CB-CD1 4.13Å; D72-I74 HydrophobicContact CB-CG1 4.04Å; I74-L98 HydrophobicContact CG2-CB 3.96Å; I74-L98 HydrophobicContact CG2-CD2 3.8Å; I74-L98 HydrophobicContact CG2-CG 4.45Å; I74-Q99 CarbonylContact C-O 3.47Å; I74-Q99 WeakPolarHBondContact CA-O 3.43Å
75	K	97.5	Very high	95.3	Very high	61 Å²	61	48.1 Å²	48.1	27%	0.265	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.7	166	-175	-179.9	179.7	-174.8	0	108.7	V26 T77 Q99 I101	V26-K75 HydrophobicContact CG2-CB 4.16Å; V26-K75 HydrophobicContact CG2-CG 4.06Å; K75-T77 HydrophobicContact CD-CG2 4.36Å; K75-T77 HydrophobicContact CG-CG2 4.27Å; K75-Q99 PolarHBondContact N-O 2.92Å; K75-Q99 PolarHBondContact O-N 3.06Å; K75-I101 HydrophobicContact CB-CD1 4.26Å; K75-I101 HydrophobicContact CB-CG2 4.06Å
76	L	97.4	Very high	95	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	127.1	166.5	169.5	62.2	0	0	0	108.7	N24 I25 F27 I58 L90 T92 D97 L98	N24-L76 CarbonylContact C-O 3.56Å; N24-L76 VanDerWaalsContact CA-O 3.27Å; N24-L76 WeakPolarHBondContact CA-O 3.32Å; I25-L76 PolarHBondContact N-O 2.88Å; I25-L76 PolarHBondContact O-N 3.28Å; F27-L76 HydrophobicContact CE1-CB 3.76Å; F27-L76 HydrophobicContact CE1-CD2 4.3Å; F27-L76 HydrophobicContact CZ-CB 4.43Å; I58-L76 HydrophobicContact CD1-CD2 4.42Å; L76-L90 HydrophobicContact CD2-CD1 4.5Å; L76-T92 HydrophobicContact CD1-CG2 4.32Å; L76-D97 WeakPolarHBondContact CA-O 3.26Å; L76-L98 HydrophobicContact CB-CD2 3.81Å; L76-L98 HydrophobicContact CD1-CD2 3.65Å; L76-L98 HydrophobicContact CD1-CG 4.43Å; L76-L98 HydrophobicContact CG-CD2 4.27Å
77	T	96.9	Very high	95	Very high	21 Å²	21	47.2 Å²	47.2	13%	0.129	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.5	168.4	75.4	0	0	0	0	111.8	N24 K75 G79 G96 D97	N24-T77 VanDerWaalsContact OD1-CA 3.25Å; N24-T77 WeakPolarHBondContact OD1-CA 3.48Å; K75-T77 HydrophobicContact CD-CG2 4.36Å; K75-T77 HydrophobicContact CG-CG2 4.27Å; T77-G79 PolarHBondContact O-N 3.01Å; T77-G96 WeakPolarHBondContact O-CA 3.48Å; T77-D97 WeakPolarHBondContact CB-OD1 3.35Å; T77-D97 VanDerWaalsContact CG2-OD1 3.29Å; T77-D97 WeakPolarHBondContact CG2-OD1 3.2Å; T77-D97 PolarHBondContact N-O 2.91Å; T77-D97 PolarHBondContact O-N 2.79Å; T77-D97 PolarHBondContact OG1-N 3.13Å; T77-D97 PolarHBondContact OG1-OD1 3.28Å
78	R	95.6	Very high	95	Very high	121 Å²	121	43.4 Å²	43.4	46%	0.457	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.7	36.9	179.9	-56.8	177	-180	164.8	-5.3	113	L23 N24 G93 G95	L23-R78 PolarHBondContact O-N 3.29Å; N24-R78 PolarHBondContact OD1-N 2.9Å; R78-G93 WeakPolarHBondContact O-CA 3.41Å; R78-G93 PolarHBondContact O-N 2.78Å; R78-G93 VanDerWaalsContact O-N 3.13Å; R78-G95 WeakPolarHBondContact CD-O 3.44Å; R78-G95 PolarHBondContact NH1-O 2.97Å
79	G	96.9	Very high	95	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	168.1	174.2	0	0	0	0	0	112.2	K21 N22 L23 T77 Y91	K21-G79 CarbonylContact C-O 3.57Å; N22-G79 PolarHBondContact N-O 2.81Å; L23-G79 PolarHBondContact N-O 3.14Å; L23-G79 PolarHBondContact O-N 3.4Å; T77-G79 PolarHBondContact O-N 3.01Å; G79-Y91 CarbonylContact C-O 3.52Å; G79-Y91 VanDerWaalsContact CA-O 3.27Å; G79-Y91 WeakPolarHBondContact CA-O 3.23Å
80	Y	97.2	Very high	95.1	Very high	39 Å²	39	38.2 Å²	38.2	15%	0.153	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	159.5	170.7	75.4	-86.7	0	0	0	110.9	S20 L90 Y91 T92 D215 R217	S20-Y80 CarbonylContact O-C 3.52Å; S20-Y80 WeakPolarHBondContact O-CA 3.36Å; S20-Y80 WeakPolarHBondContact O-CB 3.29Å; Y80-L90 WeakPolarHBondContact O-CA 3.3Å; Y80-Y91 HydrophobicContact CD2-CD2 4.14Å; Y80-Y91 HydrophobicContact CE1-CG 4.1Å; Y80-Y91 AromaticContact CE2-CD2 3.52Å; Y80-Y91 HydrophobicContact CE2-CD2 3.52Å; Y80-Y91 HydrophobicContact CE2-CE2 4.39Å; Y80-Y91 AromaticContact CE2-CG 3.88Å; Y80-Y91 HydrophobicContact CE2-CG 3.88Å; Y80-Y91 AromaticContact CZ-CD2 3.75Å; Y80-Y91 AromaticContact CZ-CG 3.59Å; Y80-Y91 PolarHBondContact N-O 3Å; Y80-Y91 PolarHBondContact O-N 2.57Å; Y80-T92 WeakPolarHBondContact CE1-O 3.4Å; Y80-D215 PolarHBondContact OH-OD2 3.29Å; Y80-R217 PolarHBondContact OH-NH2 3.08Å; Y80-R217 VanDerWaalsContact OH-NH2 3.09Å
81	A	96.8	Very high	95	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.8	179.6	0	0	0	0	0	110.8	V16 G19 S20 L23 L88 T89 L90	V16-A81 HydrophobicContact CG1-CB 3.32Å; G19-A81 WeakPolarHBondContact CA-O 3.2Å; G19-A81 PolarHBondContact N-O 2.8Å; S20-A81 PolarHBondContact O-N 2.83Å; L23-A81 HydrophobicContact CD1-CB 4.1Å; A81-L88 HydrophobicContact CB-CD1 3.91Å; A81-T89 WeakPolarHBondContact CA-O 3.48Å; A81-L90 HydrophobicContact CB-CD2 3.99Å
82	S	95.2	Very high	94.9	Very high	46 Å²	46	36.1 Å²	36.1	32%	0.322	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.8	176.8	-174.8	0	0	0	0	110.5	T89	S82-T89 PolarHBondContact N-O 2.8Å; S82-T89 PolarHBondContact O-N 2.74Å
83	I	92.3	Very high	94.7	Very high	52 Å²	52	35.9 Å²	35.9	27%	0.267	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	130.7	169.7	-58.2	-53.3	0	0	0	109.2	P18 C87 L88 L121	P18-I83 HydrophobicContact CB-CD1 4.2Å; P18-I83 HydrophobicContact CB-CG1 4.06Å; P18-I83 HydrophobicContact CG-CD1 3.76Å; P18-I83 HydrophobicContact CG-CG1 4.07Å; I83-C87 WeakPolarHBondContact CA-O 3.29Å; I83-L88 HydrophobicContact CD1-CB 3.89Å; I83-L88 HydrophobicContact CD1-CD1 4.01Å; I83-L121 HydrophobicContact CD1-CD1 3.85Å; I83-L121 HydrophobicContact CG1-CD1 4.3Å
84	W	86.7	Confident	94.3	Very high	127 Å²	127	44.4 Å²	44.4	48%	0.481	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	119.2	171.6	176.6	-107.2	0	0	0	109.4	G86 C87 Y91	W84-G86 PolarHBondContact O-N 3.07Å; W84-G86 VanDerWaalsContact O-N 3.14Å; W84-C87 PolarHBondContact N-O 3.43Å; W84-C87 WeakPolarHBondContact O-CB 3.35Å; W84-C87 PolarHBondContact O-N 3.14Å; W84-Y91 VanDerWaalsContact CB-OH 3.25Å; W84-Y91 WeakPolarHBondContact CB-OH 3.38Å
85	K	86.1	Confident	94	Very high	166 Å²	166	46.3 Å²	46.3	72%	0.722	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	37.2	-176.1	-59.5	-177.3	175.8	-176.5	0	113.4	C87	K85-C87 VanDerWaalsContact C-N 3.33Å
86	G	87.6	Confident	93.8	Very high	4 Å²	4	43.5 Å²	43.5	4%	0.041	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-8.5	-178.8	0	0	0	0	0	115.5	W84 L122	W84-G86 PolarHBondContact O-N 3.07Å; W84-G86 VanDerWaalsContact O-N 3.14Å; G86-L122 VanDerWaalsContact CA-CD2 3.4Å
87	C	91.1	Very high	93.6	Very high	33 Å²	33	44.5 Å²	44.5	22%	0.223	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.3	-178.2	-60	0	0	0	0	111.1	I83 W84 K85 T89 S115	I83-C87 WeakPolarHBondContact CA-O 3.29Å; W84-C87 PolarHBondContact N-O 3.43Å; W84-C87 WeakPolarHBondContact O-CB 3.35Å; W84-C87 PolarHBondContact O-N 3.14Å; K85-C87 VanDerWaalsContact C-N 3.33Å; C87-T89 PolarHBondContact O-N 3.37Å; C87-T89 PolarHBondContact O-OG1 2.71Å; C87-T89 VanDerWaalsContact O-OG1 3.09Å; C87-S115 VanDerWaalsContact CB-O 3.24Å; C87-S115 WeakPolarHBondContact CB-O 3.44Å; C87-S115 PolarHBondContact SG-O 2.95Å
88	L	94.8	Very high	93.6	Very high	16 Å²	16	44 Å²	44	8%	0.084	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	120.1	168.1	-179.6	61.6	0	0	0	109	V16 P18 I56 A81 I83 F114 S115	V16-L88 HydrophobicContact CG1-CD2 4.24Å; P18-L88 HydrophobicContact CB-CD1 4.37Å; P18-L88 HydrophobicContact CG-CD1 4.02Å; I56-L88 HydrophobicContact CD1-CD2 4.09Å; I56-L88 HydrophobicContact CD1-CG 4.06Å; A81-L88 HydrophobicContact CB-CD1 3.91Å; I83-L88 HydrophobicContact CD1-CB 3.89Å; I83-L88 HydrophobicContact CD1-CD1 4.01Å; L88-F114 WeakPolarHBondContact CB-O 3.34Å; L88-F114 HydrophobicContact CD2-CB 4.47Å; L88-S115 WeakPolarHBondContact O-CB 3.28Å; L88-S115 PolarHBondContact O-OG 3.2Å
89	T	96.4	Very high	93.6	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.5	-173	-52.6	0	0	0	0	109.9	A57 S59 A81 S82 C87 Y91	A57-T89 HydrophobicContact CB-CG2 4.47Å; A57-T89 CarbonylContact O-C 3.54Å; A57-T89 WeakPolarHBondContact O-CA 3.32Å; S59-T89 WeakPolarHBondContact OG-CG2 3.37Å; A81-T89 WeakPolarHBondContact CA-O 3.48Å; S82-T89 PolarHBondContact N-O 2.8Å; S82-T89 PolarHBondContact O-N 2.74Å; C87-T89 PolarHBondContact O-N 3.37Å; C87-T89 PolarHBondContact O-OG1 2.71Å; C87-T89 VanDerWaalsContact O-OG1 3.09Å; T89-Y91 HydrophobicContact CG2-CE1 4.1Å; T89-Y91 HydrophobicContact CG2-CE2 3.94Å; T89-Y91 VanDerWaalsContact O-CD2 3.29Å; T89-Y91 WeakPolarHBondContact O-CD2 3.08Å; T89-Y91 VanDerWaalsContact O-CE2 3.28Å; T89-Y91 WeakPolarHBondContact O-CE2 3.49Å
90	L	97.6	Very high	93.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	148.9	171.5	-72.4	177.7	0	0	0	111.5	V16 L23 I25 I56 A57 I58 S59 L76 Y80 A81	V16-L90 HydrophobicContact CG1-CD2 4Å; L23-L90 HydrophobicContact CD1-CD2 3.88Å; I25-L90 HydrophobicContact CD1-CD1 4.12Å; I25-L90 HydrophobicContact CD1-CD2 4.22Å; I56-L90 HydrophobicContact CD1-CD1 4.24Å; I56-L90 HydrophobicContact CD1-CD2 4.36Å; I56-L90 HydrophobicContact CD1-CG 3.82Å; I56-L90 HydrophobicContact CG1-CG 4.32Å; I56-L90 HydrophobicContact CG2-CD1 3.56Å; I56-L90 HydrophobicContact CG2-CG 4.17Å; A57-L90 PolarHBondContact O-N 3.34Å; I58-L90 WeakPolarHBondContact CA-O 3.31Å; I58-L90 HydrophobicContact CB-CB 3.99Å; I58-L90 HydrophobicContact CD1-CB 4.34Å; I58-L90 HydrophobicContact CG1-CB 3.87Å; I58-L90 WeakPolarHBondContact CG1-O 3.31Å; S59-L90 PolarHBondContact N-O 3.33Å; L76-L90 HydrophobicContact CD2-CD1 4.5Å; Y80-L90 WeakPolarHBondContact O-CA 3.3Å; A81-L90 HydrophobicContact CB-CD2 3.99Å
91	Y	97.2	Very high	93.6	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	153.1	178.7	-61.1	-81	0	0	0	110.1	G79 Y80 W84 T89 R217	G79-Y91 CarbonylContact C-O 3.52Å; G79-Y91 VanDerWaalsContact CA-O 3.27Å; G79-Y91 WeakPolarHBondContact CA-O 3.23Å; Y80-Y91 HydrophobicContact CD2-CD2 4.14Å; Y80-Y91 HydrophobicContact CE1-CG 4.1Å; Y80-Y91 AromaticContact CE2-CD2 3.52Å; Y80-Y91 HydrophobicContact CE2-CD2 3.52Å; Y80-Y91 HydrophobicContact CE2-CE2 4.39Å; Y80-Y91 AromaticContact CE2-CG 3.88Å; Y80-Y91 HydrophobicContact CE2-CG 3.88Å; Y80-Y91 AromaticContact CZ-CD2 3.75Å; Y80-Y91 AromaticContact CZ-CG 3.59Å; Y80-Y91 PolarHBondContact N-O 3Å; Y80-Y91 PolarHBondContact O-N 2.57Å; W84-Y91 VanDerWaalsContact CB-OH 3.25Å; W84-Y91 WeakPolarHBondContact CB-OH 3.38Å; T89-Y91 HydrophobicContact CG2-CE1 4.1Å; T89-Y91 HydrophobicContact CG2-CE2 3.94Å; T89-Y91 VanDerWaalsContact O-CD2 3.29Å; T89-Y91 WeakPolarHBondContact O-CD2 3.08Å; T89-Y91 VanDerWaalsContact O-CE2 3.28Å; T89-Y91 WeakPolarHBondContact O-CE2 3.49Å; Y91-R217 VanDerWaalsContact CZ-NH2 3.35Å; Y91-R217 PolarHBondContact OH-NH1 3.37Å
92	T	95.9	Very high	93.5	Very high	24 Å²	24	47.6 Å²	47.6	15%	0.147	24%	0.241	C	C	.	.			trans	-75.2	124.9	170.5	-48.6	0	0	0	0	110	L76 Y80	L76-T92 HydrophobicContact CD1-CG2 4.32Å; Y80-T92 WeakPolarHBondContact CE1-O 3.4Å
93	G	93	Very high	93.5	Very high	7 Å²	7	50.2 Å²	50.2	7%	0.072	25%	0.248	C	C	.	.			trans	-84.4	177.7	179.6	0	0	0	0	0	113.8	R78 G95 G96	R78-G93 WeakPolarHBondContact O-CA 3.41Å; R78-G93 PolarHBondContact O-N 2.78Å; R78-G93 VanDerWaalsContact O-N 3.13Å; G93-G95 PolarHBondContact O-N 2.98Å; G93-G96 PolarHBondContact O-N 2.85Å
94	R	90.4	Very high	93.2	Very high	200 Å²	200	54.6 Å²	54.6	76%	0.755	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	124.1	-179.7	179.2	175.3	178.3	166.4	-3	110.3	G96 R218	R94-G96 PolarHBondContact O-N 2.74Å; R94-R218 VanDerWaalsContact CB-NH1 3.32Å
95	G	90.9	Very high	93.4	Very high	46 Å²	46	54.4 Å²	54.4	47%	0.474	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	16	-177.3	0	0	0	0	0	113.3	R78 G93	R78-G95 WeakPolarHBondContact CD-O 3.44Å; R78-G95 PolarHBondContact NH1-O 2.97Å; G93-G95 PolarHBondContact O-N 2.98Å
96	G	93.6	Very high	93.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.01	26%	0.258	C	S	.	.			trans	-92.4	170.4	166.7	0	0	0	0	0	111.8	T77 G93 R94	T77-G96 WeakPolarHBondContact O-CA 3.48Å; G93-G96 PolarHBondContact O-N 2.85Å; R94-G96 PolarHBondContact O-N 2.74Å
97	D	94.6	Very high	94.2	Very high	22 Å²	22	54 Å²	54	12%	0.118	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	165.4	-178.7	66.8	-2	0	0	0	112.3	L76 T77 T209 I210	L76-D97 WeakPolarHBondContact CA-O 3.26Å; T77-D97 WeakPolarHBondContact CB-OD1 3.35Å; T77-D97 VanDerWaalsContact CG2-OD1 3.29Å; T77-D97 WeakPolarHBondContact CG2-OD1 3.2Å; T77-D97 PolarHBondContact N-O 2.91Å; T77-D97 PolarHBondContact O-N 2.79Å; T77-D97 PolarHBondContact OG1-N 3.13Å; T77-D97 PolarHBondContact OG1-OD1 3.28Å; D97-T209 VanDerWaalsContact OD2-CG2 3.32Å; D97-T209 WeakPolarHBondContact OD2-CG2 3.45Å; D97-I210 WeakPolarHBondContact CB-O 3.36Å
98	L	95.9	Very high	94.5	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.052	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.4	168.4	-70.1	172.9	0	0	0	106.9	F27 I58 V60 I68 I74 L76	F27-L98 HydrophobicContact CZ-CD2 4.15Å; I58-L98 HydrophobicContact CD1-CD2 4.12Å; V60-L98 HydrophobicContact CG1-CD1 3.73Å; V60-L98 HydrophobicContact CG2-CD1 3.96Å; I68-L98 HydrophobicContact CD1-CD1 4.42Å; I74-L98 HydrophobicContact CG2-CB 3.96Å; I74-L98 HydrophobicContact CG2-CD2 3.8Å; I74-L98 HydrophobicContact CG2-CG 4.45Å; L76-L98 HydrophobicContact CB-CD2 3.81Å; L76-L98 HydrophobicContact CD1-CD2 3.65Å; L76-L98 HydrophobicContact CD1-CG 4.43Å; L76-L98 HydrophobicContact CG-CD2 4.27Å
99	Q	96.1	Very high	94.7	Very high	33 Å²	33	58.5 Å²	58.5	15%	0.154	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.4	-179.3	-170.6	-179.4	31	0	0	109.4	I74 K75 I101 S207 T209	I74-Q99 CarbonylContact C-O 3.47Å; I74-Q99 WeakPolarHBondContact CA-O 3.43Å; K75-Q99 PolarHBondContact N-O 2.92Å; K75-Q99 PolarHBondContact O-N 3.06Å; Q99-I101 HydrophobicContact CB-CG2 4.43Å; Q99-I101 HydrophobicContact CG-CG2 4.1Å; Q99-I101 PolarHBondContact O-N 2.87Å; Q99-S207 PolarHBondContact NE2-OG 3.14Å; Q99-T209 PolarHBondContact NE2-OG1 3.09Å; Q99-T209 VanDerWaalsContact NE2-OG1 3.1Å
100	K	96.3	Very high	94.7	Very high	90 Å²	90	62.1 Å²	62.1	39%	0.391	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	120.3	168.2	-179.3	173.1	172.5	166.7	0	108.1	D72 G102 E103	D72-K100 HydrophobicContact CB-CD 4.47Å; D72-K100 WeakPolarHBondContact OD1-CE 3.15Å; D72-K100 IonicContact OD1-NZ 2.86Å; D72-K100 PolarHBondContact OD1-NZ 3.07Å; K100-G102 WeakPolarHBondContact CE-O 3.28Å; K100-E103 IonicContact NZ-OE2 3.97Å; K100-E103 PolarHBondContact NZ-OE2 2.75Å
101	I	96.8	Very high	94.7	Very high	90 Å²	90	67.4 Å²	67.4	46%	0.462	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-9.3	-178.5	60.6	164.4	0	0	0	112.9	V26 I73 K75 Q99	V26-I101 HydrophobicContact CG1-CD1 3.85Å; V26-I101 HydrophobicContact CG2-CD1 4.21Å; I73-I101 HydrophobicContact CB-CG1 4.36Å; I73-I101 HydrophobicContact CG2-CD1 4.05Å; I73-I101 HydrophobicContact CG2-CG1 3.79Å; I73-I101 WeakPolarHBondContact O-CG1 3.39Å; I73-I101 PolarHBondContact O-N 2.71Å; K75-I101 HydrophobicContact CB-CD1 4.26Å; K75-I101 HydrophobicContact CB-CG2 4.06Å; Q99-I101 HydrophobicContact CB-CG2 4.43Å; Q99-I101 HydrophobicContact CG-CG2 4.1Å; Q99-I101 PolarHBondContact O-N 2.87Å
102	G	95.7	Very high	94.6	Very high	24 Å²	24	70.4 Å²	70.4	25%	0.247	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-167.7	177.9	0	0	0	0	0	112.4	I73 K100	I73-G102 PolarHBondContact N-O 2.83Å; I73-G102 PolarHBondContact O-N 2.87Å; K100-G102 WeakPolarHBondContact CE-O 3.28Å
103	E	95.6	Very high	94.6	Very high	100 Å²	100	71.5 Å²	71.5	47%	0.467	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	154.1	176.9	53	-174.3	-151.9	0	0	111.4	G71 K100 C105	G71-E103 CarbonylContact O-C 3.52Å; G71-E103 WeakPolarHBondContact O-CA 3.29Å; K100-E103 IonicContact NZ-OE2 3.97Å; K100-E103 PolarHBondContact NZ-OE2 2.75Å; E103-C105 PolarHBondContact O-N 2.95Å
104	F	84.3	Confident	94.7	Very high	145 Å²	145	74 Å²	74	64%	0.636	39%	0.391	S	S	*	.	S	Bend	trans	62.2	-43.6	172.3	-61.5	-77.6	0	0	0	118.6	G71 M106	G71-F104 PolarHBondContact O-N 2.8Å; F104-M106 VanDerWaalsContact C-N 3.32Å; F104-M106 PolarHBondContact O-N 3.44Å
105	C	91.7	Very high	94.8	Very high	123 Å²	123	64.9 Å²	64.9	83%	0.831	36%	0.358	S	S	*	.			trans	-88.8	18.2	-164	-62.9	0	0	0	0	115.4	E103	E103-C105 PolarHBondContact O-N 2.95Å
106	M	94.6	Very high	94.7	Very high	42 Å²	42	68.9 Å²	68.9	21%	0.207	36%	0.364	C	S	.	.			trans	-90.6	129.7	178.1	-178.1	172.7	177.5	0	0	110.9	V26 I28 D51 I73 F104 Y108	V26-M106 HydrophobicContact CG1-CE 4.18Å; V26-M106 HydrophobicContact CG1-SD 4.05Å; V26-M106 WeakPolarHBondContact O-CE 3.21Å; I28-M106 HydrophobicContact CB-CB 4.18Å; I28-M106 HydrophobicContact CB-CG 4.46Å; I28-M106 HydrophobicContact CB-SD 4.12Å; I28-M106 HydrophobicContact CD1-CB 4.31Å; D51-M106 HydrophobicContact CB-CE 3.91Å; I73-M106 HydrophobicContact CD1-CB 3.67Å; I73-M106 HydrophobicContact CG1-CB 3.84Å; I73-M106 HydrophobicContact CG2-SD 3.87Å; F104-M106 VanDerWaalsContact C-N 3.32Å; F104-M106 PolarHBondContact O-N 3.44Å; M106-Y108 WeakPolarHBondContact O-CD1 3.37Å
107	V	96	Very high	93.8	Very high	118 Å²	118	72.4 Å²	72.4	72%	0.715	39%	0.388	S	S	*	.			trans	-71.6	129.2	172.3	-179.5	0	0	0	0	109.8
108	Y	97.9	Very high	92.3	Very high	102 Å²	102	74.3 Å²	74.3	40%	0.4	40%	0.398	S	S	.	.			trans	-140	162.4	-179.6	70.1	-89.5	0	0	0	112.7	I28 L30 A50 D51 M106 E110	I28-Y108 HydrophobicContact CD1-CD1 4.48Å; I28-Y108 HydrophobicContact CG2-CD1 3.65Å; I28-Y108 HydrophobicContact CG2-CE1 4.45Å; I28-Y108 HydrophobicContact CG2-CG 3.75Å; L30-Y108 HydrophobicContact CD1-CD2 4.2Å; L30-Y108 HydrophobicContact CD1-CE2 4.11Å; L30-Y108 HydrophobicContact CD2-CD1 4.31Å; L30-Y108 HydrophobicContact CD2-CD2 3.69Å; L30-Y108 HydrophobicContact CD2-CE1 4.08Å; L30-Y108 HydrophobicContact CD2-CE2 3.43Å; L30-Y108 VanDerWaalsContact CD2-CE2 3.43Å; L30-Y108 HydrophobicContact CD2-CG 4.12Å; L30-Y108 HydrophobicContact CG-CE2 4.43Å; A50-Y108 HydrophobicContact CB-CD2 4.02Å; A50-Y108 HydrophobicContact CB-CG 4.3Å; D51-Y108 CarbonylContact O-C 3.59Å; D51-Y108 WeakPolarHBondContact O-CA 3.44Å; M106-Y108 WeakPolarHBondContact O-CD1 3.37Å; Y108-E110 HydrophobicContact CD2-CG 4.13Å; Y108-E110 HydrophobicContact CE2-CG 3.73Å
109	S	97.8	Very high	91	Very high	43 Å²	43	78.6 Å²	78.6	30%	0.301	43%	0.426	S	S	.	.			trans	-123.2	135	167.2	-176.2	0	0	0	0	109.2	D51 G54 V111	D51-S109 PolarHBondContact O-N 2.84Å; G54-S109 CarbonylContact C-O 3.53Å; G54-S109 WeakPolarHBondContact CA-O 3.37Å; S109-V111 PolarHBondContact OG-N 3.24Å; S109-V111 PolarHBondContact OG-O 2.91Å
110	E	96.9	Very high	89.6	Confident	80 Å²	80	83.4 Å²	83.4	37%	0.374	45%	0.449	S	S	.	.			trans	-79.8	-22.6	174	-59.7	-160.1	-152.3	0	0	113	L30 K48 S55 Y108	L30-E110 HydrophobicContact CD1-CG 3.78Å; K48-E110 IonicContact NZ-OE2 3.15Å; K48-E110 PolarHBondContact NZ-OE2 2.77Å; S55-E110 WeakPolarHBondContact CB-O 3.39Å; S55-E110 PolarHBondContact OG-O 2.86Å; Y108-E110 HydrophobicContact CD2-CG 4.13Å; Y108-E110 HydrophobicContact CE2-CG 3.73Å
111	V	96.8	Very high	88	Confident	112 Å²	112	81.8 Å²	81.8	68%	0.679	44%	0.444	S	S	*	.			trans	-117.7	137.6	-173.1	-179.3	0	0	0	0	109.6	S109	S109-V111 PolarHBondContact OG-N 3.24Å; S109-V111 PolarHBondContact OG-O 2.91Å
112	P	96	Very high	86.4	Confident	67 Å²	67	80.9 Å²	80.9	44%	0.435	44%	0.439	S	S	.	.	S	Bend	cis	-72.3	154.5	-4.7	32	-35.5	0	0	0	112.4	G54 S55 F114	G54-P112 WeakPolarHBondContact CA-O 3.37Å; S55-P112 PolarHBondContact N-O 3.03Å; P112-F114 HydrophobicContact CG-CD2 4.45Å; P112-F114 HydrophobicContact CG-CE1 4.12Å; P112-F114 HydrophobicContact CG-CE2 3.73Å; P112-F114 HydrophobicContact CG-CZ 3.5Å
113	N	96.4	Very high	85	Confident	46 Å²	46	82 Å²	82	25%	0.246	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-90.8	104.9	169.7	175.2	4.3	0	0	0	109.1	S55 S115 E116	S55-N113 CarbonylContact O-C 3.58Å; S55-N113 WeakPolarHBondContact O-CA 3.48Å; S55-N113 WeakPolarHBondContact OG-CA 3.35Å; S55-N113 WeakPolarHBondContact OG-CB 3.29Å; N113-S115 PolarHBondContact O-N 3.09Å; N113-S115 WeakPolarHBondContact OD1-CB 3.36Å; N113-S115 PolarHBondContact OD1-N 3.15Å; N113-E116 HydrophobicContact CB-CG 3.86Å; N113-E116 WeakPolarHBondContact O-CG 3.43Å; N113-E116 PolarHBondContact O-N 3.43Å
114	F	94.7	Very high	83.4	Confident	60 Å²	60	82.7 Å²	82.7	26%	0.263	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.9	-177.2	-67.5	-83	0	0	0	113.6	I13 K14 S55 I56 L88 P112	I13-F114 HydrophobicContact CG2-CD2 3.49Å; I13-F114 VanDerWaalsContact CG2-CD2 3.49Å; I13-F114 HydrophobicContact CG2-CE2 3.96Å; I13-F114 HydrophobicContact CG2-CG 4.28Å; K14-F114 HydrophobicContact CB-CE1 4.24Å; K14-F114 HydrophobicContact CB-CE2 4.06Å; K14-F114 HydrophobicContact CB-CZ 3.5Å; S55-F114 WeakPolarHBondContact O-CD2 3.42Å; S55-F114 PolarHBondContact O-N 2.56Å; I56-F114 HydrophobicContact CB-CB 4.48Å; I56-F114 HydrophobicContact CD1-CB 4.41Å; I56-F114 HydrophobicContact CG1-CB 4.39Å; L88-F114 WeakPolarHBondContact CB-O 3.34Å; L88-F114 HydrophobicContact CD2-CB 4.47Å; P112-F114 HydrophobicContact CG-CD2 4.45Å; P112-F114 HydrophobicContact CG-CE1 4.12Å; P112-F114 HydrophobicContact CG-CE2 3.73Å; P112-F114 HydrophobicContact CG-CZ 3.5Å
115	S	93.2	Very high	82.2	Confident	9 Å²	9	78.6 Å²	78.6	6%	0.063	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.6	175.7	-61.2	0	0	0	0	114.1	I56 A57 C87 L88 N113	I56-S115 WeakPolarHBondContact CG1-OG 3.48Å; A57-S115 VanDerWaalsContact CB-OG 3.3Å; A57-S115 WeakPolarHBondContact CB-OG 3.25Å; A57-S115 PolarHBondContact N-OG 2.99Å; C87-S115 VanDerWaalsContact CB-O 3.24Å; C87-S115 WeakPolarHBondContact CB-O 3.44Å; C87-S115 PolarHBondContact SG-O 2.95Å; L88-S115 WeakPolarHBondContact O-CB 3.28Å; L88-S115 PolarHBondContact O-OG 3.2Å; N113-S115 PolarHBondContact O-N 3.09Å; N113-S115 WeakPolarHBondContact OD1-CB 3.36Å; N113-S115 PolarHBondContact OD1-N 3.15Å
116	E	88.4	Confident	80.5	Confident	129 Å²	129	79.1 Å²	79.1	60%	0.603	44%	0.437	S	S	*	.	S	Bend	trans	-54.4	131.3	173.3	-77.4	-178.7	-177.5	0	0	109.9	N113 N118	N113-E116 HydrophobicContact CB-CG 3.86Å; N113-E116 WeakPolarHBondContact O-CG 3.43Å; N113-E116 PolarHBondContact O-N 3.43Å; E116-N118 PolarHBondContact O-N 3Å
117	P	74.4	Confident	78.7	Confident	76 Å²	76	83.8 Å²	83.8	49%	0.494	46%	0.458	S	S	.	.			trans	-59.4	111.8	-180	-14.5	23.9	0	0	0	109	P119 L122	P117-P119 VanDerWaalsContact O-CD 3.27Å; P117-P119 WeakPolarHBondContact O-CD 3.48Å; P117-L122 HydrophobicContact CB-CD1 4.35Å
118	N	63.5	Low	76.7	Confident	62 Å²	62	85.9 Å²	85.9	33%	0.332	46%	0.46	S	S	.	.			trans	-77.8	117.4	171.6	-177.9	-11.8	0	0	0	108.3	E116 E120 L121 L122	E116-N118 PolarHBondContact O-N 3Å; N118-E120 PolarHBondContact O-N 3.28Å; N118-E120 WeakPolarHBondContact OD1-CB 3.25Å; N118-E120 PolarHBondContact OD1-N 3.15Å; N118-L121 HydrophobicContact CB-CB 4.23Å; N118-L121 HydrophobicContact CB-CD1 3.94Å; N118-L121 HydrophobicContact CB-CG 3.98Å; N118-L121 PolarHBondContact O-N 2.79Å; N118-L121 VanDerWaalsContact O-N 3.16Å; N118-L122 PolarHBondContact O-N 2.55Å
119	P	67.5	Low	74.4	Confident	99 Å²	99	88.6 Å²	88.6	64%	0.643	48%	0.482	S	S	*	.	H	α-helix	trans	-56.4	-31.9	177.6	-22.8	33.9	0	0	0	113.3	P117 L122 A123	P117-P119 VanDerWaalsContact O-CD 3.27Å; P117-P119 WeakPolarHBondContact O-CD 3.48Å; P119-L122 PolarHBondContact O-N 3.38Å; P119-A123 PolarHBondContact O-N 2.83Å; P119-A123 VanDerWaalsContact O-N 3.14Å
120	E	67.6	Low	72	Confident	135 Å²	135	95.6 Å²	95.6	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-70.1	-38.3	179.3	-64.9	-175.8	154.2	0	0	112.5	N118 L122 A123 Q124	N118-E120 PolarHBondContact O-N 3.28Å; N118-E120 WeakPolarHBondContact OD1-CB 3.25Å; N118-E120 PolarHBondContact OD1-N 3.15Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-A123 PolarHBondContact O-N 3.22Å; E120-Q124 WeakPolarHBondContact O-CG 3.24Å; E120-Q124 PolarHBondContact O-N 2.66Å
121	L	61.7	Low	69.4	Low	56 Å²	56	97 Å²	97	29%	0.293	53%	0.526	S	S	.	.	H	α-helix	trans	-68.9	-34.7	177.5	-68.7	178.5	0	0	0	111.5	I83 N118 A125	I83-L121 HydrophobicContact CD1-CD1 3.85Å; I83-L121 HydrophobicContact CG1-CD1 4.3Å; N118-L121 HydrophobicContact CB-CB 4.23Å; N118-L121 HydrophobicContact CB-CD1 3.94Å; N118-L121 HydrophobicContact CB-CG 3.98Å; N118-L121 PolarHBondContact O-N 2.79Å; N118-L121 VanDerWaalsContact O-N 3.16Å; L121-A125 PolarHBondContact O-N 3Å
122	L	64.1	Low	66.7	Low	70 Å²	70	95.1 Å²	95.1	37%	0.366	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-39.3	173.2	-73.7	170	0	0	0	111.9	G86 P117 N118 P119 E120	G86-L122 VanDerWaalsContact CA-CD2 3.4Å; P117-L122 HydrophobicContact CB-CD1 4.35Å; N118-L122 PolarHBondContact O-N 2.55Å; P119-L122 PolarHBondContact O-N 3.38Å; E120-L122 VanDerWaalsContact C-N 3.33Å
123	A	65.8	Low	64.3	Low	48 Å²	48	101.6 Å²	101.6	40%	0.397	55%	0.55	S	S	.	.	H	α-helix	trans	-65.4	-38.1	178.2	0	0	0	0	0	112.7	P119 E120 N126 Q127	P119-A123 PolarHBondContact O-N 2.83Å; P119-A123 VanDerWaalsContact O-N 3.14Å; E120-A123 PolarHBondContact O-N 3.22Å; A123-N126 PolarHBondContact O-N 3.07Å; A123-Q127 PolarHBondContact O-N 3.23Å
124	Q	62	Low	61.7	Low	114 Å²	114	105.2 Å²	105.2	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-72.3	-35.6	179.4	-67.7	174.9	25.8	0	0	112.9	E120 N126 Q127 Q128	E120-Q124 WeakPolarHBondContact O-CG 3.24Å; E120-Q124 PolarHBondContact O-N 2.66Å; Q124-N126 PolarHBondContact O-N 3.09Å; Q124-Q127 PolarHBondContact O-N 3.09Å; Q124-Q127 VanDerWaalsContact O-N 3.08Å; Q124-Q128 PolarHBondContact O-N 2.86Å
125	A	59.1	Low	59.2	Low	60 Å²	60	109.6 Å²	109.6	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-61	-31.8	175	0	0	0	0	0	112.6	L121	L121-A125 PolarHBondContact O-N 3Å
126	N	56.9	Low	57.2	Low	134 Å²	134	117 Å²	117	72%	0.717	64%	0.636	S	S	*	*	H	α-helix	trans	-78.1	-19.9	176.2	-72.8	-17.6	0	0	0	113.6	A123 Q124	A123-N126 PolarHBondContact O-N 3.07Å; Q124-N126 PolarHBondContact O-N 3.09Å
127	Q	57.1	Low	54.9	Low	139 Å²	139	118.4 Å²	118.4	65%	0.65	65%	0.648	S	S	*	*	H	α-helix	trans	-82.7	-26.9	178.9	-70.3	175.8	16.7	0	0	112.9	A123 Q124 N129 K130	A123-Q127 PolarHBondContact O-N 3.23Å; Q124-Q127 PolarHBondContact O-N 3.09Å; Q124-Q127 VanDerWaalsContact O-N 3.08Å; Q127-N129 PolarHBondContact O-N 3.29Å; Q127-K130 PolarHBondContact O-N 2.88Å; Q127-K130 VanDerWaalsContact O-N 3.15Å
128	Q	52.8	Low	53.8	Low	162 Å²	162	121.4 Å²	121.4	76%	0.757	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-68.8	-14.3	178	-92	179.3	-18.5	0	0	114.7	Q124 K130	Q124-Q128 PolarHBondContact O-N 2.86Å; Q128-K130 VanDerWaalsContact C-N 3.3Å
129	N	49.4	Very low	52.8	Low	160 Å²	160	129.3 Å²	129.3	86%	0.856	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-86.9	7.5	172.7	-96.4	-0.9	0	0	0	113.9	Q127	Q127-N129 PolarHBondContact O-N 3.29Å
130	K	47.8	Very low	51.2	Low	189 Å²	189	128.6 Å²	128.6	82%	0.822	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-125.2	32.8	-177.1	-132.2	-177.3	-170.6	-174.2	0	114.4	Q127 Q128	Q127-K130 PolarHBondContact O-N 2.88Å; Q127-K130 VanDerWaalsContact O-N 3.15Å; Q128-K130 VanDerWaalsContact C-N 3.3Å
131	S	41.6	Very low	49.9	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	70%	0.701	S	S	*	*			trans	-98.6	63.2	164	60.3	0	0	0	0	110.9
132	G	41.7	Very low	49.3	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	72%	0.72	S	S	*	*			trans	-82.2	129.5	154.2	0	0	0	0	0	108.1
133	K	44.5	Very low	48.6	Very low	203 Å²	203	134.1 Å²	134.1	88%	0.883	74%	0.74	S	S	*	*			trans	-44.8	140.7	-174.2	-62	170.4	178.6	177.9	0	113.3	D135	K133-D135 PolarHBondContact O-N 2.96Å
134	P	41.4	Very low	47.9	Very low	123 Å²	123	138 Å²	138	80%	0.799	76%	0.761	S	S	*	*			trans	-72.8	124.3	163	29.4	-27.8	0	0	0	108.8	Q136	P134-Q136 PolarHBondContact O-N 3.41Å
135	D	43.4	Very low	46.8	Very low	152 Å²	152	140.3 Å²	140.3	81%	0.813	78%	0.777	S	S	*	*			trans	-65.6	110.2	171.8	-159.8	-42.9	0	0	0	108.4	K133	K133-D135 PolarHBondContact O-N 2.96Å
136	Q	50	Low	45.9	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	79%	0.794	S	S	*	*			trans	-97.8	100.6	172.9	-177.6	175.8	17.2	0	0	106.9	P134	P134-Q136 PolarHBondContact O-N 3.41Å
137	N	40.9	Very low	45	Very low	158 Å²	158	147.2 Å²	147.2	85%	0.845	80%	0.8	S	S	*	*			trans	-139.6	113	154.8	-123.8	7.7	0	0	0	112.1
138	Q	50.1	Low	44.1	Very low	138 Å²	138	145.5 Å²	145.5	65%	0.645	80%	0.803	S	S	*	*			trans	-83.5	140.6	179.9	-94.4	-175.9	15.4	0	0	111.7
139	R	42.7	Very low	43.3	Very low	228 Å²	228	141 Å²	141	86%	0.86	80%	0.8	S	S	*	*			trans	75.3	123.9	136.1	-69.2	175.3	177.7	-155.4	0.2	120.2
140	G	34.6	Very low	42.9	Very low	84 Å²	84	140.3 Å²	140.3	87%	0.866	80%	0.802	S	S	*	*			trans	-168.7	134.7	153.8	0	0	0	0	0	110
141	N	41	Very low	42.1	Very low	158 Å²	158	136 Å²	136	85%	0.845	80%	0.802	S	S	*	*			trans	-107.3	147.9	-153.5	-141.4	23.4	0	0	0	113.3
142	S	48.1	Very low	42	Very low	99 Å²	99	135.2 Å²	135.2	69%	0.692	80%	0.802	S	S	*	*			trans	80.6	164.3	153.1	-43.7	0	0	0	0	120.5
143	P	49.6	Very low	42.6	Very low	120 Å²	120	137.4 Å²	137.4	78%	0.779	80%	0.803	S	S	*	*				-123.6	-176.9	-81	37.8	-18.9	0	0	0	113.2
144	P	51.9	Low	43	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	80%	0.8	S	S	*	*			trans	-89.9	142.2	-166.8	35	-29.4	0	0	0	113.2
145	N	37.5	Very low	42.7	Very low	163 Å²	163	131.4 Å²	131.4	87%	0.872	80%	0.799	S	S	*	*			trans	-122.4	126.2	173.4	-162.4	14.5	0	0	0	111.7
146	Q	41.1	Very low	42.4	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	80%	0.804	S	S	*	*			trans	-85.8	135.2	173.4	-63.6	171.8	8.5	0	0	109.1
147	N	38.7	Very low	41.7	Very low	156 Å²	156	128 Å²	128	83%	0.834	80%	0.803	S	S	*	*			trans	-166.3	171	140.7	-150.3	1.8	0	0	0	112.4
148	S	38	Very low	41.5	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	80%	0.803	S	S	*	*			trans	-129.8	160	-138.1	-27.1	0	0	0	0	111.6
149	G	34.6	Very low	41.2	Very low	68 Å²	68	127.3 Å²	127.3	70%	0.701	81%	0.814	S	S	*	*			trans	89.5	143.8	160.5	0	0	0	0	0	115.4
150	T	41.1	Very low	41.8	Very low	146 Å²	146	122 Å²	122	90%	0.896	81%	0.81	S	S	*	*			cis	-171.6	155.3	11.3	-7.6	0	0	0	0	110.4
151	A	32	Very low	42.8	Very low	99 Å²	99	122.3 Å²	122.3	82%	0.818	80%	0.796	S	S	*	*			trans	72	120.7	146.5	0	0	0	0	0	124.4
152	A	39.5	Very low	42.7	Very low	94 Å²	94	124.3 Å²	124.3	78%	0.777	80%	0.798	S	S	*	*			trans	-84.4	-171.5	156.9	0	0	0	0	0	110.8
153	P	54.3	Low	42.3	Very low	117 Å²	117	124 Å²	124	76%	0.76	80%	0.801	S	S	*	*			cis	-147.7	-144	14	39.8	-13.4	0	0	0	114.2
154	P	53.7	Low	41.6	Very low	125 Å²	125	125.9 Å²	125.9	81%	0.812	81%	0.805	S	S	*	*				-129.3	173.3	-56.3	27.7	-7	0	0	0	116.4
155	G	34.3	Very low	41	Very low	75 Å²	75	126.9 Å²	126.9	77%	0.773	80%	0.803	S	S	*	*			trans	109.2	141.5	149.8	0	0	0	0	0	116.3
156	N	37.3	Very low	41.8	Very low	171 Å²	171	123.8 Å²	123.8	91%	0.914	79%	0.792	S	S	*	*			cis	-169.3	142.5	7.5	-143.5	22.7	0	0	0	110.5
157	G	35.4	Very low	41.7	Very low	74 Å²	74	121.3 Å²	121.3	76%	0.763	79%	0.789	S	S	*	*			trans	75.1	154.8	155.5	0	0	0	0	0	119.3
158	A	36.7	Very low	41.7	Very low	101 Å²	101	120.5 Å²	120.5	84%	0.835	79%	0.79	S	S	*	*			cis	-170.7	135.6	-19	0	0	0	0	0	106.4
159	M	42.7	Very low	41.7	Very low	180 Å²	180	119.6 Å²	119.6	89%	0.887	80%	0.797	S	S	*	*			trans	-87.2	166.5	159.3	-65.3	-84.1	-138.8	0	0	107.3
160	P	56.5	Low	42.2	Very low	118 Å²	118	121.1 Å²	121.1	77%	0.766	80%	0.803	S	S	*	*			cis	-151.4	-134	42.3	34.9	-4.8	0	0	0	113.5
161	P	54.9	Low	43.1	Very low	90 Å²	90	119.5 Å²	119.5	58%	0.584	80%	0.795	S	S	*	*				-132.1	-169.3	-103.2	45.1	-24.9	0	0	0	116
162	F	39.3	Very low	43.3	Very low	200 Å²	200	126.5 Å²	126.5	88%	0.877	80%	0.8	S	S	*	*			trans	-37.2	142.6	178.5	-3.9	-81.9	0	0	0	119.7
163	A	38.8	Very low	43.2	Very low	92 Å²	92	129.2 Å²	129.2	76%	0.76	80%	0.802	S	S	*	*				141.4	141.2	120.8	0	0	0	0	0	117.5
164	N	35.5	Very low	43.2	Very low	160 Å²	160	128 Å²	128	86%	0.856	79%	0.794	S	S	*	*			trans	83.3	116.8	150.4	-78.5	7.8	0	0	0	124.5
165	N	40	Very low	42.3	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	79%	0.788	S	S	*	*			trans	-8.9	169.2	141	-129.7	24.8	0	0	0	119
166	P	54	Low	42.7	Very low	98 Å²	98	133.6 Å²	133.6	64%	0.636	79%	0.794	S	S	*	*			cis	-146.7	-177.4	20.8	39.2	-16	0	0	0	117.3
167	T	38.5	Very low	42.7	Very low	129 Å²	129	129.2 Å²	129.2	79%	0.791	79%	0.789	S	S	*	*			trans	-178.8	105.6	147.9	22.1	0	0	0	0	109.9
168	T	38.6	Very low	42.7	Very low	139 Å²	139	133.6 Å²	133.6	85%	0.853	80%	0.795	S	S	*	*				73.8	121.8	90.4	56.7	0	0	0	0	117.2
169	G	37.2	Very low	42.9	Very low	85 Å²	85	133.3 Å²	133.3	88%	0.876	79%	0.793	S	S	*	*			trans	144.1	98.9	152.1	0	0	0	0	0	115.5
170	A	46.4	Very low	42.4	Very low	100 Å²	100	127.9 Å²	127.9	83%	0.826	78%	0.783	S	S	*	*			trans	-100	-156.1	-177	0	0	0	0	0	112.6
171	P	59.7	Low	41.6	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	79%	0.791	S	S	*	*				-124.6	179.4	-102.4	37.3	-18.3	0	0	0	114.2
172	R	36.7	Very low	40.9	Very low	247 Å²	247	134.4 Å²	134.4	93%	0.932	80%	0.795	S	S	*	*			trans	167.1	136.2	140.4	-91.1	161	-174.2	-176.6	3	114.8
173	D	35.9	Very low	40.8	Very low	150 Å²	150	133 Å²	133	80%	0.802	80%	0.797	S	S	*	*			trans	-80.2	-168.3	162.8	-160.6	17.9	0	0	0	109.9
174	P	55.8	Low	40.6	Very low	92 Å²	92	132.5 Å²	132.5	60%	0.597	80%	0.801	S	S	*	*			cis	-128.8	-174.3	-31.3	15.1	10.7	0	0	0	113.6
175	T	34.6	Very low	40.6	Very low	114 Å²	114	136.2 Å²	136.2	70%	0.699	80%	0.803	S	S	*	*			trans	112.6	135.4	139.7	-31.6	0	0	0	0	119.3
176	F	42.3	Very low	40.4	Very low	204 Å²	204	133.8 Å²	133.8	90%	0.895	80%	0.798	S	S	*	*			trans	133.5	105.7	153.3	-79	-71	0	0	0	108.3
177	G	36.3	Very low	39.5	Very low	78 Å²	78	134.7 Å²	134.7	80%	0.804	80%	0.802	S	S	*	*				88	137.9	53.7	0	0	0	0	0	109
178	N	36.5	Very low	39.3	Very low	167 Å²	167	135.2 Å²	135.2	89%	0.893	81%	0.805	S	S	*	*			cis	-173.3	169.7	-13.9	-167.3	26.7	0	0	0	106.1
179	A	40	Very low	38.8	Very low	95 Å²	95	131.4 Å²	131.4	79%	0.785	79%	0.793	S	S	*	*			trans	81.7	133.4	163.9	0	0	0	0	0	118.8
180	G	33.1	Very low	38.8	Very low	66 Å²	66	135.7 Å²	135.7	68%	0.68	80%	0.796	S	S	*	*			cis	153.7	161.7	-2.7	0	0	0	0	0	112
181	R	40.2	Very low	38.1	Very low	248 Å²	248	134.7 Å²	134.7	94%	0.936	80%	0.795	S	S	*	*			trans	82.9	148.4	164.3	-59.5	179.9	179.8	-166.9	-0.4	118.4
182	S	40.2	Very low	37	Very low	96 Å²	96	134 Å²	134	67%	0.671	80%	0.799	S	S	*	*			cis	161.4	147	-40.9	53.2	0	0	0	0	108.2
183	N	36.4	Very low	38	Very low	170 Å²	170	127.8 Å²	127.8	91%	0.909	79%	0.791	S	S	*	*			trans	80	127.2	155	-83.7	9	0	0	0	122.1
184	G	34.3	Very low	38.8	Very low	83 Å²	83	126.4 Å²	126.4	86%	0.856	79%	0.79	S	S	*	*			trans	178.7	104.4	153.7	0	0	0	0	0	111.5
185	R	36.4	Very low	38.2	Very low	238 Å²	238	128.4 Å²	128.4	90%	0.898	80%	0.8	S	S	*	*			trans	-112.9	159.2	-169.9	-177.6	-175.7	-175.5	168.4	2.1	110.3
186	S	36.3	Very low	38.4	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	81%	0.81	S	S	*	*			trans	90.8	147.5	152.1	83.9	0	0	0	0	117.8
187	T	33.9	Very low	38.3	Very low	116 Å²	116	126 Å²	126	71%	0.712	81%	0.806	S	S	*	*			cis	178.7	156.8	-7.9	27.7	0	0	0	0	108.2
188	T	34.1	Very low	38.4	Very low	141 Å²	141	128 Å²	128	87%	0.865	81%	0.807	S	S	*	*			trans	74.6	137.5	154.6	-35.5	0	0	0	0	117.3
189	G	29.5	Very low	38.5	Very low	58 Å²	58	123.3 Å²	123.3	60%	0.598	80%	0.799	S	S	*	*			cis	153.9	152.3	5	0	0	0	0	0	109.5
190	N	35.5	Very low	38.9	Very low	176 Å²	176	124.7 Å²	124.7	94%	0.941	80%	0.8	S	S	*	*			trans	70.6	140.1	165.4	-58.4	-10.1	0	0	0	118.1
191	G	33	Very low	39.4	Very low	78 Å²	78	127.4 Å²	127.4	80%	0.804	81%	0.805	S	S	*	*			cis	179.3	163.6	5.6	0	0	0	0	0	110.8
192	A	35.4	Very low	39.4	Very low	96 Å²	96	121.3 Å²	121.3	79%	0.793	80%	0.795	S	S	*	*			trans	-99	-177.3	160.4	0	0	0	0	0	108.8
193	P	59	Low	39.6	Very low	118 Å²	118	123.7 Å²	123.7	77%	0.766	81%	0.806	S	S	*	*			cis	-128.1	-152.6	-11.9	43.4	-23.1	0	0	0	110
194	P	51.5	Low	39.7	Very low	120 Å²	120	121 Å²	121	78%	0.779	80%	0.796	S	S	*	*				-142.2	177.5	51.4	35.3	-10.8	0	0	0	117.1
195	V	44.3	Very low	40.3	Very low	135 Å²	135	127.4 Å²	127.4	82%	0.818	80%	0.8	S	S	*	*			trans	-59.2	153.9	179.6	-67.2	0	0	0	0	116.1
196	N	37.9	Very low	40.4	Very low	171 Å²	171	120.8 Å²	120.8	91%	0.914	79%	0.791	S	S	*	*			trans	-141.7	131.8	150.5	-135.2	13.1	0	0	0	111
197	A	39.8	Very low	40.9	Very low	96 Å²	96	119.9 Å²	119.9	79%	0.793	78%	0.784	S	S	*	*			trans	-95.9	137.8	-174.2	0	0	0	0	0	111.2
198	S	38.5	Very low	41.4	Very low	120 Å²	120	118.1 Å²	118.1	84%	0.839	77%	0.773	S	S	*	*			trans	-159.2	110.7	163.3	57.4	0	0	0	0	112.6
199	G	39.7	Very low	42	Very low	69 Å²	69	115.5 Å²	115.5	71%	0.711	76%	0.757	S	S	*	*			trans	79.2	136.8	142.4	0	0	0	0	0	119.5
200	P	47.6	Very low	42.9	Very low	124 Å²	124	115.3 Å²	115.3	81%	0.805	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-83.3	135	170.2	33.2	-28.8	0	0	0	110.4
201	P	43.4	Very low	43.5	Very low	123 Å²	123	111 Å²	111	80%	0.799	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-84.6	130.2	168.5	30.5	-27.3	0	0	0	110.5
202	T	40.4	Very low	44.4	Very low	119 Å²	119	108.9 Å²	108.9	73%	0.73	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-54.3	137.9	170.1	47.4	0	0	0	0	112.3	T204	T202-T204 PolarHBondContact O-N 3.18Å
203	T	43.8	Very low	45.1	Very low	146 Å²	146	107.3 Å²	107.3	90%	0.896	69%	0.689	S	S	*	*			trans	-63.2	98.7	173.9	50.9	0	0	0	0	111.7
204	T	38.4	Very low	44.9	Very low	115 Å²	115	107.4 Å²	107.4	71%	0.706	67%	0.674	S	S	*	*			trans	-98.6	120.5	161.9	43.9	0	0	0	0	108.6	T202 S206	T202-T204 PolarHBondContact O-N 3.18Å; T204-S206 PolarHBondContact O-N 3.18Å
205	K	47.9	Very low	45.4	Very low	216 Å²	216	102.6 Å²	102.6	94%	0.939	64%	0.642	S	S	*	*			trans	-63.2	93.6	173.2	-69.4	-179.8	178.6	179.3	0	108.9	S207	K205-S207 PolarHBondContact O-N 2.96Å
206	S	38.2	Very low	45.8	Very low	99 Å²	99	98.4 Å²	98.4	69%	0.692	62%	0.617	S	S	*	*			trans	-79.5	92.7	169.3	27.2	0	0	0	0	108.7	T204 V208	T204-S206 PolarHBondContact O-N 3.18Å; S206-V208 VanDerWaalsContact C-N 3.35Å; S206-V208 PolarHBondContact O-N 3.19Å
207	S	46.2	Very low	46.7	Very low	81 Å²	81	95.2 Å²	95.2	57%	0.566	59%	0.593	S	S	*	*			trans	-67.5	99.6	159.7	-178.9	0	0	0	0	107	Q99 K205 T209	Q99-S207 PolarHBondContact NE2-OG 3.14Å; K205-S207 PolarHBondContact O-N 2.96Å; S207-T209 PolarHBondContact O-N 2.93Å
208	V	45.5	Very low	47.5	Very low	79 Å²	79	96.7 Å²	96.7	48%	0.479	58%	0.578	S	S	.	*			trans	-84.4	99.2	179.8	-161.8	0	0	0	0	108	S206 I210	S206-V208 VanDerWaalsContact C-N 3.35Å; S206-V208 PolarHBondContact O-N 3.19Å; V208-I210 HydrophobicContact CB-CG1 4.23Å; V208-I210 HydrophobicContact CG1-CD1 3.7Å; V208-I210 HydrophobicContact CG1-CG1 3.36Å; V208-I210 PolarHBondContact O-N 2.91Å
209	T	45.6	Very low	48	Very low	86 Å²	86	95.3 Å²	95.3	53%	0.528	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.7	105.7	167.1	-54.6	0	0	0	0	107.9	D97 Q99 S207	D97-T209 VanDerWaalsContact OD2-CG2 3.32Å; D97-T209 WeakPolarHBondContact OD2-CG2 3.45Å; Q99-T209 PolarHBondContact NE2-OG1 3.09Å; Q99-T209 VanDerWaalsContact NE2-OG1 3.1Å; S207-T209 PolarHBondContact O-N 2.93Å
210	I	50	Low	48	Very low	54 Å²	54	101.4 Å²	101.4	28%	0.277	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.1	98.8	179	-45.7	178.5	0	0	0	110	L64 L67 D97 V208	L64-I210 HydrophobicContact CD2-CB 3.63Å; L64-I210 HydrophobicContact CD2-CD1 3.78Å; L64-I210 HydrophobicContact CD2-CG1 4.29Å; L64-I210 HydrophobicContact CD2-CG2 3.37Å; L64-I210 HydrophobicContact CG-CG2 4.22Å; L67-I210 HydrophobicContact CD1-CD1 3.98Å; D97-I210 WeakPolarHBondContact CB-O 3.36Å; V208-I210 HydrophobicContact CB-CG1 4.23Å; V208-I210 HydrophobicContact CG1-CD1 3.7Å; V208-I210 HydrophobicContact CG1-CG1 3.36Å; V208-I210 PolarHBondContact O-N 2.91Å
211	S	46.4	Very low	47.5	Very low	85 Å²	85	109.9 Å²	109.9	59%	0.594	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.8	134.2	175.8	58.9	0	0	0	0	111.8
212	N	53.4	Low	47.7	Very low	34 Å²	34	109.3 Å²	109.3	18%	0.182	59%	0.586	C	S	.	*			trans	-147.8	121.9	168.4	-100.6	-21.8	0	0	0	112.9	L64 R214	L64-N212 HydrophobicContact CD1-CB 3.99Å; N212-R214 VanDerWaalsContact C-N 3.34Å; N212-R214 HydrophobicContact CB-CG 4.37Å; N212-R214 VanDerWaalsContact CG-NE 3.33Å; N212-R214 PolarHBondContact ND2-NE 3.2Å; N212-R214 PolarHBondContact ND2-NH2 3.22Å; N212-R214 PolarHBondContact O-N 3.48Å; N212-R214 PolarHBondContact OD1-NE 3.16Å; N212-R214 PolarHBondContact OD1-NH2 3.28Å; N212-R214 VanDerWaalsContact OD1-NH2 3.1Å
213	G	48.5	Very low	48.1	Very low	64 Å²	64	108.7 Å²	108.7	66%	0.66	58%	0.579	S	S	*	*			trans	-90.9	40.4	171.6	0	0	0	0	0	114.2
214	R	56.2	Low	48.3	Very low	120 Å²	120	106.7 Å²	106.7	45%	0.453	56%	0.561	S	S	.	*			trans	-108.2	43.6	-168.2	-56.6	-173.1	-147.5	171.2	3.3	114.9	D62 N212 P216	D62-R214 IonicContact OD2-NH1 2.69Å; D62-R214 PolarHBondContact OD2-NH1 3.25Å; N212-R214 VanDerWaalsContact C-N 3.34Å; N212-R214 HydrophobicContact CB-CG 4.37Å; N212-R214 VanDerWaalsContact CG-NE 3.33Å; N212-R214 PolarHBondContact ND2-NE 3.2Å; N212-R214 PolarHBondContact ND2-NH2 3.22Å; N212-R214 PolarHBondContact O-N 3.48Å; N212-R214 PolarHBondContact OD1-NE 3.16Å; N212-R214 PolarHBondContact OD1-NH2 3.28Å; N212-R214 VanDerWaalsContact OD1-NH2 3.1Å; R214-P216 WeakPolarHBondContact O-CD 3.39Å
215	D	61.3	Low	48.9	Very low	18 Å²	18	106.2 Å²	106.2	10%	0.096	55%	0.553	C	S	.	*			trans	-91.5	103.1	161.5	-167.1	-32.3	0	0	0	109.4	Y80 R217 R218	Y80-D215 PolarHBondContact OH-OD2 3.29Å; D215-R217 PolarHBondContact O-N 3.3Å; D215-R217 VanDerWaalsContact O-N 3.14Å; D215-R217 WeakPolarHBondContact OD1-CB 3.27Å; D215-R217 WeakPolarHBondContact OD1-CG 3.49Å; D215-R217 PolarHBondContact OD1-N 3.44Å; D215-R217 IonicContact OD1-NE 3.56Å; D215-R217 PolarHBondContact OD1-NE 3.48Å; D215-R217 VanDerWaalsContact OD1-NE 3.15Å; D215-R217 IonicContact OD1-NH2 3.91Å; D215-R217 IonicContact OD2-CZ 3.45Å; D215-R217 IonicContact OD2-NE 2.83Å; D215-R217 PolarHBondContact OD2-NE 3.41Å; D215-R217 IonicContact OD2-NH2 3.35Å; D215-R217 PolarHBondContact OD2-NH2 3.15Å; D215-R218 PolarHBondContact O-N 3.14Å
216	P	53	Low	49	Very low	47 Å²	47	99.3 Å²	99.3	31%	0.305	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-64.1	-18.8	-177.1	25.4	-33.6	0	0	0	113	W61 R214 R218 A219	W61-P216 HydrophobicContact CH2-CG 3.93Å; W61-P216 HydrophobicContact CZ3-CG 3.76Å; R214-P216 WeakPolarHBondContact O-CD 3.39Å; P216-R218 PolarHBondContact O-N 3.24Å; P216-R218 VanDerWaalsContact O-N 3.15Å; P216-A219 PolarHBondContact O-N 3.18Å
217	R	57.4	Low	49.7	Very low	104 Å²	104	99.3 Å²	99.3	39%	0.392	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-66	-15.3	175.3	-60	176.7	-65.8	172.6	4.9	112.6	Y80 Y91 D215	Y80-R217 PolarHBondContact OH-NH2 3.08Å; Y80-R217 VanDerWaalsContact OH-NH2 3.09Å; Y91-R217 VanDerWaalsContact CZ-NH2 3.35Å; Y91-R217 PolarHBondContact OH-NH1 3.37Å; D215-R217 PolarHBondContact O-N 3.3Å; D215-R217 VanDerWaalsContact O-N 3.14Å; D215-R217 WeakPolarHBondContact OD1-CB 3.27Å; D215-R217 WeakPolarHBondContact OD1-CG 3.49Å; D215-R217 PolarHBondContact OD1-N 3.44Å; D215-R217 IonicContact OD1-NE 3.56Å; D215-R217 PolarHBondContact OD1-NE 3.48Å; D215-R217 VanDerWaalsContact OD1-NE 3.15Å; D215-R217 IonicContact OD1-NH2 3.91Å; D215-R217 IonicContact OD2-CZ 3.45Å; D215-R217 IonicContact OD2-NE 2.83Å; D215-R217 PolarHBondContact OD2-NE 3.41Å; D215-R217 IonicContact OD2-NH2 3.35Å; D215-R217 PolarHBondContact OD2-NH2 3.15Å
218	R	55.7	Low	49.9	Very low	128 Å²	128	100.6 Å²	100.6	48%	0.483	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-104.9	-6.6	178.9	-161	170	179.6	-81	1.7	114.3	R94 D215 P216 K220	R94-R218 VanDerWaalsContact CB-NH1 3.32Å; D215-R218 PolarHBondContact O-N 3.14Å; P216-R218 PolarHBondContact O-N 3.24Å; P216-R218 VanDerWaalsContact O-N 3.15Å; R218-K220 PolarHBondContact O-N 3.46Å
219	A	48.7	Very low	50.3	Low	91 Å²	91	102.3 Å²	102.3	75%	0.752	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-7.7	177	0	0	0	0	0	113.7	P216	P216-A219 PolarHBondContact O-N 3.18Å
220	K	40.5	Very low	50.7	Low	197 Å²	197	103.7 Å²	103.7	86%	0.857	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	25	-173.7	-65.9	-171.1	177.6	-175.7	0	115.4	R218	R218-K220 PolarHBondContact O-N 3.46Å
221	R	36.9	Very low	50.7	Low	302 Å²	302	108.2 Å²	108.2	100%	1.14	54%	0.538	S	S	*	.			trans	-131.2	0	172.9	-79.8	-168.2	174	-150.7	0.8	112

Retrieved 221 of 221 residues in 128.4 ms (Link to these results)

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