G4VE02_SCHMA Loading...

Putative copii-coated vesicle membrane protein P24

AlphaFold DB , UniProt , Accession G4VE02, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 198 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	52.9	Low	61.9	Low	195 Å²	195	145 Å²	145	96%	0.961	71%	0.707	S	S	*	*				0	-49.1	0	-148.2	165.8	86.5	0	0	112	V3 F4	M1-V3 PolarHBondContact O-N 3.03Å; M1-F4 PolarHBondContact O-N 2.86Å
2	W	58.1	Low	62.3	Low	216 Å²	216	140.8 Å²	140.8	82%	0.818	70%	0.696	S	S	*	*	H	α-helix	trans	-66.5	-30.1	179.9	-72.3	13.7	0	0	0	115.4	F4 V5 L6	W2-F4 VanDerWaalsContact C-N 3.28Å; W2-F4 PolarHBondContact O-N 3.02Å; W2-V5 PolarHBondContact O-N 3.44Å; W2-L6 PolarHBondContact O-N 3.11Å; W2-L6 VanDerWaalsContact O-N 3.11Å
3	V	66.5	Low	62.9	Low	115 Å²	115	139.8 Å²	139.8	70%	0.697	70%	0.703	S	S	*	*	H	α-helix	trans	-63.2	-33.7	177.3	-178.3	0	0	0	0	112.3	M1 F7	M1-V3 PolarHBondContact O-N 3.03Å; V3-F7 PolarHBondContact O-N 3.25Å
4	F	60.4	Low	63	Low	175 Å²	175	143.6 Å²	143.6	77%	0.768	71%	0.706	S	S	*	*	H	α-helix	trans	-74.1	-31	177.1	-86	-83.7	0	0	0	112.7	M1 W2 F7	M1-F4 PolarHBondContact O-N 2.86Å; W2-F4 VanDerWaalsContact C-N 3.28Å; W2-F4 PolarHBondContact O-N 3.02Å; F4-F7 PolarHBondContact O-N 3.47Å
5	V	67.3	Low	63.3	Low	99 Å²	99	141.9 Å²	141.9	60%	0.6	71%	0.713	S	S	*	*	H	α-helix	trans	-70.7	-38.1	175.3	-179.8	0	0	0	0	110.7	W2 F7 F8	W2-V5 PolarHBondContact O-N 3.44Å; V5-F7 VanDerWaalsContact C-N 3.32Å; V5-F7 PolarHBondContact O-N 3.03Å; V5-F8 PolarHBondContact O-N 2.87Å
6	L	63.3	Low	62.9	Low	124 Å²	124	144.4 Å²	144.4	65%	0.649	72%	0.721	S	S	*	*	H	α-helix	trans	-67.8	-27.2	175.8	-81.2	161.5	0	0	0	113.8	W2 T9	W2-L6 PolarHBondContact O-N 3.11Å; W2-L6 VanDerWaalsContact O-N 3.11Å; L6-T9 PolarHBondContact O-OG1 2.93Å
7	F	64.9	Low	62.9	Low	165 Å²	165	137.5 Å²	137.5	72%	0.724	70%	0.695	S	S	*	*	H	α-helix	trans	-78.5	-21.8	177.6	-157.8	-96.5	0	0	0	112.6	V3 F4 V5 T10	V3-F7 PolarHBondContact O-N 3.25Å; F4-F7 PolarHBondContact O-N 3.47Å; V5-F7 VanDerWaalsContact C-N 3.32Å; V5-F7 PolarHBondContact O-N 3.03Å; F7-T10 PolarHBondContact O-OG1 3.13Å
8	F	62.3	Low	63.6	Low	129 Å²	129	138.7 Å²	138.7	57%	0.566	69%	0.691	S	S	*	*	H	α-helix	trans	-82.8	-19	-176.3	-154.1	-102.2	0	0	0	113.6	V5 T10 W169	V5-F8 PolarHBondContact O-N 2.87Å; F8-T10 VanDerWaalsContact C-N 3.29Å; F8-T10 PolarHBondContact O-N 3.46Å; F8-W169 AromaticContact CE2-CZ2 3.71Å; F8-W169 HydrophobicContact CE2-CZ2 3.71Å; F8-W169 HydrophobicContact CZ-CZ2 4.03Å; F8-W169 AromaticContact CZ-NE1 4Å
9	T	61.8	Low	64.9	Low	93 Å²	93	137.1 Å²	137.1	57%	0.571	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-80.1	-5.5	-179.7	52.6	0	0	0	0	114	L6 F11	L6-T9 PolarHBondContact O-OG1 2.93Å; T9-F11 VanDerWaalsContact C-N 3.33Å; T9-F11 PolarHBondContact O-N 2.97Å
10	T	61.5	Low	66.2	Low	101 Å²	101	131 Å²	131	62%	0.62	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-83.4	-3.3	-177	57.1	0	0	0	0	114.4	F7 F8 V12	F7-T10 PolarHBondContact O-OG1 3.13Å; F8-T10 VanDerWaalsContact C-N 3.29Å; F8-T10 PolarHBondContact O-N 3.46Å; T10-V12 VanDerWaalsContact C-N 3.31Å; T10-V12 PolarHBondContact O-N 3.1Å
11	F	61.6	Low	67.5	Low	183 Å²	183	128.6 Å²	128.6	80%	0.803	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-91	18.7	-180	-120.1	-85.1	0	0	0	114.5	T9 T13	T9-F11 VanDerWaalsContact C-N 3.33Å; T9-F11 PolarHBondContact O-N 2.97Å; F11-T13 PolarHBondContact O-N 3.07Å; F11-T13 VanDerWaalsContact O-N 3.08Å
12	V	67.4	Low	69.4	Low	95 Å²	95	119.3 Å²	119.3	58%	0.576	59%	0.594	S	S	*	*			trans	-71	105.2	173.2	-179.6	0	0	0	0	108.3	T10	T10-V12 VanDerWaalsContact C-N 3.31Å; T10-V12 PolarHBondContact O-N 3.1Å
13	T	70.2	Confident	71.1	Confident	128 Å²	128	113.6 Å²	113.6	79%	0.785	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-69.7	124.4	169.8	-46.9	0	0	0	0	108.8	F11	F11-T13 PolarHBondContact O-N 3.07Å; F11-T13 VanDerWaalsContact O-N 3.08Å
14	Y	63.8	Low	72.3	Confident	192 Å²	192	109.6 Å²	109.6	75%	0.753	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-81.5	135.6	176.2	-66.1	-85	0	0	0	110.4
15	C	67.4	Low	73.7	Confident	119 Å²	119	107 Å²	107	80%	0.804	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-88.5	131.8	168.9	-166.4	0	0	0	0	108.4	G17	C15-G17 PolarHBondContact O-N 3.46Å
16	H	56.7	Low	74.9	Confident	182 Å²	182	103.8 Å²	103.8	84%	0.843	53%	0.534	S	S	*	.			trans	-90.6	100.9	172.9	-81.6	-82.6	0	0	0	109
17	G	63.6	Low	76.4	Confident	27 Å²	27	101 Å²	101	28%	0.278	52%	0.518	S	S	.	.			trans	-81.4	155.5	154.7	0	0	0	0	0	109.8	C15 Y19	C15-G17 PolarHBondContact O-N 3.46Å; G17-Y19 WeakPolarHBondContact O-CD2 3.16Å; G17-Y19 PolarHBondContact O-N 3.27Å; G17-Y19 VanDerWaalsContact O-N 3.14Å
18	Y	75	Confident	77.9	Confident	158 Å²	158	96.9 Å²	96.9	62%	0.62	50%	0.501	S	S	*	.			trans	-77.2	98.4	167.3	-176.7	-101	0	0	0	108.1	I20 L104 F105	Y18-I20 HydrophobicContact CE1-CG2 3.77Å; Y18-L104 WeakPolarHBondContact O-CD1 3.15Å; Y18-F105 HydrophobicContact CE1-CE1 4.16Å; Y18-F105 HydrophobicContact CE1-CZ 4.35Å
19	Y	87.8	Confident	79.5	Confident	108 Å²	108	92.4 Å²	92.4	42%	0.424	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.4	-179	-66	-71.9	0	0	0	109.4	G17 A47 V102 L104	G17-Y19 WeakPolarHBondContact O-CD2 3.16Å; G17-Y19 PolarHBondContact O-N 3.27Å; G17-Y19 VanDerWaalsContact O-N 3.14Å; Y19-A47 HydrophobicContact CD1-CB 3.87Å; Y19-A47 HydrophobicContact CE1-CB 3.48Å; Y19-A47 VanDerWaalsContact CE1-CB 3.48Å; Y19-V102 VanDerWaalsContact CB-CG1 3.48Å; Y19-V102 HydrophobicContact CD1-CG1 3.71Å; Y19-V102 HydrophobicContact CG-CG1 3.79Å; Y19-L104 HydrophobicContact CD1-CB 4.19Å; Y19-L104 HydrophobicContact CE1-CB 4.14Å
20	I	92.3	Very high	81.1	Confident	15 Å²	15	90.2 Å²	90.2	8%	0.077	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	144.5	166.6	60.3	160.9	0	0	0	109.6	Y18 V22 F30 F91 V102 V103 F105	Y18-I20 HydrophobicContact CE1-CG2 3.77Å; I20-V22 HydrophobicContact CD1-CG2 4.1Å; I20-F30 HydrophobicContact CD1-CE2 3.69Å; I20-F30 HydrophobicContact CD1-CZ 4.06Å; I20-F30 HydrophobicContact CG2-CZ 3.93Å; I20-F91 HydrophobicContact CD1-CD2 3.84Å; I20-F91 HydrophobicContact CD1-CE2 4.35Å; I20-F91 HydrophobicContact CD1-CG 4.32Å; I20-V102 CarbonylContact O-C 3.59Å; I20-V102 WeakPolarHBondContact O-CA 3.3Å; I20-V103 HydrophobicContact CD1-CB 4.25Å; I20-V103 HydrophobicContact CG1-CB 3.87Å; I20-V103 VanDerWaalsContact CG1-O 3.28Å; I20-V103 WeakPolarHBondContact CG1-O 3.43Å; I20-V103 PolarHBondContact N-O 2.99Å; I20-V103 PolarHBondContact O-N 2.64Å; I20-F105 HydrophobicContact CB-CE1 4.44Å; I20-F105 HydrophobicContact CD1-CD1 3.74Å; I20-F105 HydrophobicContact CD1-CE1 3.69Å; I20-F105 HydrophobicContact CG1-CD1 3.95Å; I20-F105 HydrophobicContact CG1-CE1 3.99Å; I20-F105 HydrophobicContact CG2-CD1 4.38Å; I20-F105 HydrophobicContact CG2-CE1 3.67Å
21	V	92.1	Very high	82.7	Confident	81 Å²	81	90.4 Å²	90.4	49%	0.491	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.6	175.1	-176	0	0	0	0	107.4	P100 K101 V102	V21-P100 HydrophobicContact CG1-CB 3.81Å; V21-K101 WeakPolarHBondContact CA-O 3.34Å; V21-V102 HydrophobicContact CG2-CG2 4.44Å
22	V	94.2	Very high	84.2	Confident	0 Å²	0	84 Å²	84	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.6	173.9	-171.1	0	0	0	0	107.8	I20 E28 I54 F91 N93 P100 K101 V103	I20-V22 HydrophobicContact CD1-CG2 4.1Å; V22-E28 HydrophobicContact CG1-CG 4.41Å; V22-E28 HydrophobicContact CG2-CB 4.27Å; V22-E28 HydrophobicContact CG2-CG 4.2Å; V22-I54 HydrophobicContact CG2-CD1 4.31Å; V22-F91 WeakPolarHBondContact CG1-O 3.39Å; V22-F91 HydrophobicContact CG2-CB 4.14Å; V22-N93 HydrophobicContact CB-CB 4.25Å; V22-N93 HydrophobicContact CG1-CB 3.62Å; V22-N93 PolarHBondContact O-ND2 3.08Å; V22-P100 WeakPolarHBondContact O-CA 3.49Å; V22-K101 PolarHBondContact N-O 2.88Å; V22-K101 PolarHBondContact O-N 3.44Å; V22-V103 HydrophobicContact CG2-CG2 4.14Å
23	D	93.4	Very high	85.4	Confident	96 Å²	96	90 Å²	90	51%	0.513	45%	0.447	S	S	.	.			trans	-60.4	163.3	-179.3	-79.5	-32	0	0	0	113.4	S26 N93	D23-S26 WeakPolarHBondContact CA-OG 3.41Å; D23-S26 WeakPolarHBondContact CB-OG 3.49Å; D23-S26 PolarHBondContact N-OG 3.45Å; D23-S26 PolarHBondContact O-N 2.97Å; D23-S26 PolarHBondContact O-OG 3.4Å; D23-N93 WeakPolarHBondContact O-CB 3.48Å; D23-N93 PolarHBondContact O-ND2 2.84Å
24	A	90.8	Very high	86.5	Confident	32 Å²	32	84.1 Å²	84.1	26%	0.264	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	138.7	174.9	0	0	0	0	0	110.5	S26	A24-S26 PolarHBondContact O-N 3.23Å
25	N	90.8	Very high	87.7	Confident	121 Å²	121	76.6 Å²	76.6	65%	0.647	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	17	-178.5	-162.2	51	0	0	0	115.3	N93 S96	N25-N93 PolarHBondContact N-O 3.33Å; N25-N93 VanDerWaalsContact N-O 3.13Å; N25-S96 PolarHBondContact N-O 2.82Å
26	S	92.9	Very high	88.6	Confident	31 Å²	31	74.3 Å²	74.3	22%	0.217	37%	0.373	C	S	.	.			trans	-117.2	172.6	176.5	73.4	0	0	0	0	112.3	D23 A24 N93	D23-S26 WeakPolarHBondContact CA-OG 3.41Å; D23-S26 WeakPolarHBondContact CB-OG 3.49Å; D23-S26 PolarHBondContact N-OG 3.45Å; D23-S26 PolarHBondContact O-N 2.97Å; D23-S26 PolarHBondContact O-OG 3.4Å; A24-S26 PolarHBondContact O-N 3.23Å; S26-N93 PolarHBondContact O-N 3.3Å
27	E	94.8	Very high	90	Very high	65 Å²	65	68.1 Å²	68.1	30%	0.304	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.1	167.4	71.6	-172.9	173.4	0	0	109.1	F91 R94	E27-F91 CarbonylContact C-O 3.54Å; E27-F91 WeakPolarHBondContact CA-O 3.36Å; E27-R94 IonicContact OE1-CZ 2.76Å; E27-R94 IonicContact OE1-NH2 2.73Å; E27-R94 PolarHBondContact OE1-NH2 2.97Å; E27-R94 IonicContact OE2-CZ 3Å; E27-R94 VanDerWaalsContact OE2-CZ 3.24Å; E27-R94 IonicContact OE2-NE 3.96Å; E27-R94 IonicContact OE2-NH1 3.76Å; E27-R94 IonicContact OE2-NH2 3.67Å; E27-R94 PolarHBondContact OE2-NH2 2.91Å
28	E	95.5	Very high	91.2	Very high	79 Å²	79	67 Å²	67	37%	0.369	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.8	174.5	-72.8	-61.9	154.6	0	0	109.1	V22 F30 C90 F91	V22-E28 HydrophobicContact CG1-CG 4.41Å; V22-E28 HydrophobicContact CG2-CB 4.27Å; V22-E28 HydrophobicContact CG2-CG 4.2Å; E28-F30 HydrophobicContact CB-CE2 4.22Å; E28-C90 CarbonylContact O-C 3.55Å; E28-C90 VanDerWaalsContact O-CA 3.32Å; E28-C90 WeakPolarHBondContact O-CA 3.41Å; E28-F91 PolarHBondContact N-O 2.88Å; E28-F91 PolarHBondContact O-N 3Å
29	C	95.7	Very high	91.9	Very high	35 Å²	35	63.3 Å²	63.3	24%	0.236	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.3	-176.4	-63.4	0	0	0	0	111.3	F31 K88 Y89 C90	C29-F31 HydrophobicContact CB-CE2 4.3Å; C29-F31 HydrophobicContact CB-CZ 4.33Å; C29-K88 HydrophobicContact CB-CD 4.33Å; C29-K88 HydrophobicContact CB-CG 4.22Å; C29-Y89 WeakPolarHBondContact CA-O 3.45Å; C29-C90 HydrophobicContact CB-CB 4.12Å; C29-C90 WeakPolarHBondContact CB-SG 3.29Å; C29-C90 WeakPolarHBondContact SG-CB 3.23Å; C29-C90 CovalentContact SG-SG 2.04Å; C29-C90 PolarHBondContact SG-SG 3.45Å
30	F	95.6	Very high	92.1	Very high	47 Å²	47	58.2 Å²	58.2	21%	0.206	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	157.9	177.7	-60.7	-90.9	0	0	0	109.8	I20 E28 K88 Y89 F91 F105	I20-F30 HydrophobicContact CD1-CE2 3.69Å; I20-F30 HydrophobicContact CD1-CZ 4.06Å; I20-F30 HydrophobicContact CG2-CZ 3.93Å; E28-F30 HydrophobicContact CB-CE2 4.22Å; F30-K88 WeakPolarHBondContact O-CA 3.27Å; F30-Y89 HydrophobicContact CB-CD2 3.89Å; F30-Y89 HydrophobicContact CB-CE1 4.11Å; F30-Y89 HydrophobicContact CB-CE2 3.32Å; F30-Y89 VanDerWaalsContact CB-CZ 3.43Å; F30-Y89 HydrophobicContact CD2-CD2 4.48Å; F30-Y89 HydrophobicContact CD2-CE2 4.21Å; F30-Y89 HydrophobicContact CG-CE2 4.01Å; F30-Y89 PolarHBondContact N-O 2.85Å; F30-Y89 PolarHBondContact O-N 3.26Å; F30-F91 HydrophobicContact CD2-CD2 4.11Å; F30-F91 HydrophobicContact CD2-CE2 4.13Å; F30-F91 HydrophobicContact CE2-CD2 4.09Å; F30-F91 HydrophobicContact CE2-CE2 4.35Å; F30-F105 AromaticContact CD1-CZ 3.86Å; F30-F105 HydrophobicContact CD1-CZ 3.86Å; F30-F105 HydrophobicContact CD2-CE1 4.15Å; F30-F105 HydrophobicContact CD2-CE2 4.43Å; F30-F105 AromaticContact CD2-CZ 3.81Å; F30-F105 HydrophobicContact CD2-CZ 3.81Å; F30-F105 HydrophobicContact CE1-CE1 4.23Å; F30-F105 AromaticContact CE1-CZ 3.82Å; F30-F105 HydrophobicContact CE1-CZ 3.82Å; F30-F105 AromaticContact CE2-CE1 3.73Å; F30-F105 HydrophobicContact CE2-CE1 3.73Å; F30-F105 AromaticContact CE2-CZ 3.8Å; F30-F105 HydrophobicContact CE2-CZ 3.8Å; F30-F105 HydrophobicContact CG-CE2 4.39Å; F30-F105 AromaticContact CG-CZ 3.88Å; F30-F105 HydrophobicContact CG-CZ 3.88Å; F30-F105 AromaticContact CZ-CE1 3.78Å; F30-F105 HydrophobicContact CZ-CE1 3.78Å; F30-F105 AromaticContact CZ-CZ 3.81Å; F30-F105 HydrophobicContact CZ-CZ 3.81Å
31	F	95	Very high	92.1	Very high	105 Å²	105	57.9 Å²	57.9	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.1	-168.9	-57.5	-92.2	0	0	0	109.7	C29 E86 Y87 K88	C29-F31 HydrophobicContact CB-CE2 4.3Å; C29-F31 HydrophobicContact CB-CZ 4.33Å; F31-E86 HydrophobicContact CB-CG 3.83Å; F31-E86 HydrophobicContact CD1-CG 4.02Å; F31-E86 WeakPolarHBondContact CD1-OE1 3.38Å; F31-E86 HydrophobicContact CG-CG 4.39Å; F31-Y87 WeakPolarHBondContact CA-O 3.45Å; F31-K88 HydrophobicContact CD1-CB 3.8Å; F31-K88 HydrophobicContact CD1-CD 4.3Å; F31-K88 HydrophobicContact CD1-CG 3.81Å; F31-K88 HydrophobicContact CE1-CB 3.78Å; F31-K88 HydrophobicContact CE1-CD 3.42Å; F31-K88 VanDerWaalsContact CE1-CD 3.42Å; F31-K88 HydrophobicContact CE1-CG 3.41Å; F31-K88 VanDerWaalsContact CE1-CG 3.41Å; F31-K88 HydrophobicContact CZ-CD 3.77Å; F31-K88 HydrophobicContact CZ-CG 3.92Å
32	D	93.7	Very high	92.2	Very high	49 Å²	49	54 Å²	54	26%	0.262	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.6	173.3	-80.7	-54.2	0	0	0	110.3	V34 E86 Y87 Y89 I109	D32-V34 HydrophobicContact CB-CG2 4.42Å; D32-E86 WeakPolarHBondContact O-CA 3.34Å; D32-Y87 PolarHBondContact N-O 2.99Å; D32-Y87 VanDerWaalsContact N-O 3.08Å; D32-Y87 PolarHBondContact O-N 2.74Å; D32-Y89 HydrophobicContact CB-CE1 4.33Å; D32-Y89 VanDerWaalsContact OD2-CE1 3.29Å; D32-Y89 WeakPolarHBondContact OD2-CE1 3.38Å; D32-Y89 PolarHBondContact OD2-OH 3.43Å; D32-I109 HydrophobicContact CB-CD1 4.14Å
33	R	93.2	Very high	92.1	Very high	220 Å²	220	57 Å²	57	83%	0.83	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.3	177.5	-171.2	173.1	-178.7	163.8	0.8	109.7	G85	R33-G85 WeakPolarHBondContact CA-O 3.43Å
34	V	91.5	Very high	92.1	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.03	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.3	-170.7	-167.4	0	0	0	0	109.8	D32 L40 A81 A84 G85 Y87 I109	D32-V34 HydrophobicContact CB-CG2 4.42Å; V34-L40 HydrophobicContact CB-CD1 4.4Å; V34-L40 HydrophobicContact CB-CD2 4.47Å; V34-L40 HydrophobicContact CG1-CD1 4.15Å; V34-L40 HydrophobicContact CG1-CD2 3.93Å; V34-L40 HydrophobicContact CG1-CG 4.23Å; V34-L40 HydrophobicContact CG2-CD1 3.98Å; V34-L40 HydrophobicContact CG2-CD2 3.71Å; V34-L40 HydrophobicContact CG2-CG 4.42Å; V34-A81 HydrophobicContact CB-CB 4.48Å; V34-A81 HydrophobicContact CG1-CB 3.84Å; V34-A84 WeakPolarHBondContact O-CA 3.46Å; V34-G85 PolarHBondContact N-O 2.88Å; V34-G85 PolarHBondContact O-N 2.94Å; V34-Y87 HydrophobicContact CB-CD2 4.05Å; V34-Y87 HydrophobicContact CB-CE2 4.35Å; V34-Y87 HydrophobicContact CG2-CD2 4.01Å; V34-I109 HydrophobicContact CG1-CG2 3.96Å; V34-I109 HydrophobicContact CG2-CD1 4.26Å
35	A	89.3	Confident	92.3	Very high	33 Å²	33	55.8 Å²	55.8	27%	0.273	29%	0.289	S	S	.	.			trans	-73.7	155.1	170.4	0	0	0	0	0	111.5	S38 A81	A35-S38 PolarHBondContact O-N 3.48Å; A35-S38 PolarHBondContact O-OG 2.86Å; A35-A81 WeakPolarHBondContact O-CB 3.29Å
36	S	87.1	Confident	92.4	Very high	71 Å²	71	50.4 Å²	50.4	50%	0.497	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	136.8	172.6	-179.5	0	0	0	0	109.8	A81 N82	S36-A81 CarbonylContact C-O 3.56Å; S36-A81 WeakPolarHBondContact CA-O 3.22Å; S36-N82 PolarHBondContact OG-O 2.79Å
37	G	85.6	Confident	92.2	Very high	53 Å²	53	51.3 Å²	51.3	55%	0.546	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-15.3	-177.6	0	0	0	0	0	115	A81	G37-A81 PolarHBondContact N-O 3.36Å
38	S	88.6	Confident	92	Very high	4 Å²	4	54.7 Å²	54.7	3%	0.028	29%	0.286	C	S	.	.			trans	-70.1	146.9	-178.5	-48.3	0	0	0	0	112.2	A35 A81 E110 E111	A35-S38 PolarHBondContact O-N 3.48Å; A35-S38 PolarHBondContact O-OG 2.86Å; S38-A81 VanDerWaalsContact O-CB 3.24Å; S38-A81 WeakPolarHBondContact O-CB 3.37Å; S38-A81 PolarHBondContact O-N 3.42Å; S38-E110 CarbonylContact C-O 3.54Å; S38-E110 WeakPolarHBondContact CA-O 3.33Å; S38-E110 WeakPolarHBondContact CB-O 3.05Å; S38-E111 WeakPolarHBondContact OG-CG 3.32Å
39	K	90.3	Very high	91.5	Very high	80 Å²	80	51.8 Å²	51.8	35%	0.348	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.8	174.5	-173	-178	177.3	-166.9	0	109.9	E78 E110	K39-E78 WeakPolarHBondContact CE-OE2 3.41Å; K39-E78 IonicContact NZ-OE2 3.65Å; K39-E78 PolarHBondContact NZ-OE2 3.02Å; K39-E110 HydrophobicContact CB-CB 4.25Å; K39-E110 PolarHBondContact N-O 3.16Å; K39-E110 PolarHBondContact O-N 3.49Å
40	L	92	Very high	90.9	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.6	-177.6	-65.5	167.4	0	0	0	109.2	V34 E78 F79 A81 Y87 M107 A108 I109	V34-L40 HydrophobicContact CB-CD1 4.4Å; V34-L40 HydrophobicContact CB-CD2 4.47Å; V34-L40 HydrophobicContact CG1-CD1 4.15Å; V34-L40 HydrophobicContact CG1-CD2 3.93Å; V34-L40 HydrophobicContact CG1-CG 4.23Å; V34-L40 HydrophobicContact CG2-CD1 3.98Å; V34-L40 HydrophobicContact CG2-CD2 3.71Å; V34-L40 HydrophobicContact CG2-CG 4.42Å; L40-E78 CarbonylContact O-C 3.54Å; L40-E78 WeakPolarHBondContact O-CA 3.49Å; L40-F79 HydrophobicContact CB-CD1 4.35Å; L40-F79 HydrophobicContact CB-CD2 3.55Å; L40-F79 HydrophobicContact CB-CE1 4.07Å; L40-F79 HydrophobicContact CB-CE2 3.26Å; L40-F79 HydrophobicContact CB-CG 4.1Å; L40-F79 HydrophobicContact CB-CZ 3.52Å; L40-F79 HydrophobicContact CD1-CD2 3.73Å; L40-F79 HydrophobicContact CD1-CE2 3.28Å; L40-F79 HydrophobicContact CD1-CZ 4.2Å; L40-F79 HydrophobicContact CG-CD2 4.23Å; L40-F79 HydrophobicContact CG-CE2 3.87Å; L40-F79 HydrophobicContact CG-CZ 4.45Å; L40-F79 PolarHBondContact N-O 3Å; L40-F79 PolarHBondContact O-N 2.89Å; L40-A81 HydrophobicContact CD1-CB 4.08Å; L40-Y87 HydrophobicContact CD1-CD1 4.1Å; L40-Y87 HydrophobicContact CD1-CD2 4.1Å; L40-Y87 HydrophobicContact CD1-CE1 4.32Å; L40-Y87 HydrophobicContact CD1-CE2 4.32Å; L40-Y87 HydrophobicContact CD1-CG 4Å; L40-M107 HydrophobicContact CB-SD 4.46Å; L40-M107 HydrophobicContact CD2-SD 4.31Å; L40-A108 WeakPolarHBondContact CA-O 3.47Å; L40-I109 HydrophobicContact CD2-CB 4.03Å; L40-I109 HydrophobicContact CD2-CD1 4.34Å; L40-I109 HydrophobicContact CD2-CG1 3.6Å; L40-I109 HydrophobicContact CD2-CG2 3.83Å
41	T	92.4	Very high	90.5	Very high	8 Å²	8	59.3 Å²	59.3	5%	0.049	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	111.5	177.1	-56.8	0	0	0	0	108.8	R76 E78 A108	T41-R76 HydrophobicContact CG2-CG 3.69Å; T41-E78 HydrophobicContact CG2-CG 3.93Å; T41-A108 PolarHBondContact N-O 3.39Å; T41-A108 PolarHBondContact O-N 3.05Å
42	L	93.3	Very high	90.3	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.8	174.8	174.4	67.7	0	0	0	108.5	Y44 V56 V58 R76 P77 F79 Y89 F91 F105 M107	L42-Y44 HydrophobicContact CG-CD1 4.47Å; L42-V56 HydrophobicContact CD2-CG1 3.84Å; L42-V58 HydrophobicContact CD2-CG2 4.15Å; L42-R76 CarbonylContact O-C 3.54Å; L42-R76 VanDerWaalsContact O-CA 3.27Å; L42-R76 WeakPolarHBondContact O-CA 3.49Å; L42-P77 HydrophobicContact CB-CG 4.15Å; L42-P77 HydrophobicContact CD2-CG 4.48Å; L42-P77 PolarHBondContact N-O 2.96Å; L42-P77 VanDerWaalsContact N-O 3.07Å; L42-P77 WeakPolarHBondContact O-CD 3.5Å; L42-F79 HydrophobicContact CB-CE1 4.21Å; L42-Y89 HydrophobicContact CD1-CD2 4.08Å; L42-Y89 HydrophobicContact CD1-CE2 4.36Å; L42-F91 HydrophobicContact CD1-CZ 4.17Å; L42-F91 HydrophobicContact CD2-CZ 4.47Å; L42-F105 HydrophobicContact CD1-CD2 4.47Å; L42-M107 HydrophobicContact CB-CE 3.99Å; L42-M107 HydrophobicContact CB-SD 4.35Å; L42-M107 HydrophobicContact CD1-CE 3.92Å; L42-M107 HydrophobicContact CG-CE 4.44Å
43	H	92.7	Very high	90.2	Very high	63 Å²	63	56.6 Å²	56.6	29%	0.292	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.7	170.2	-178	-104.1	0	0	0	109.3	R76 F105 E106	H43-R76 HydrophobicContact CB-CG 4.47Å; H43-F105 CarbonylContact O-C 3.59Å; H43-F105 WeakPolarHBondContact O-CA 3.33Å; H43-F105 WeakPolarHBondContact O-CB 3.47Å; H43-E106 HydrophobicContact CB-CB 4.42Å; H43-E106 PolarHBondContact N-O 2.9Å; H43-E106 PolarHBondContact O-N 2.81Å
44	Y	93.7	Very high	90.2	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.6	175.9	69	-87.6	0	0	0	112.4	L42 I54 V56 S69 N74 G75 F91 L104	L42-Y44 HydrophobicContact CG-CD1 4.47Å; Y44-I54 HydrophobicContact CD2-CG2 4.08Å; Y44-I54 HydrophobicContact CE2-CG2 4.04Å; Y44-V56 HydrophobicContact CD1-CG2 4.15Å; Y44-V56 HydrophobicContact CD2-CG2 3.93Å; Y44-V56 HydrophobicContact CE1-CB 4.34Å; Y44-V56 HydrophobicContact CE1-CG1 4.35Å; Y44-V56 HydrophobicContact CE1-CG2 3.89Å; Y44-V56 HydrophobicContact CE2-CG2 3.68Å; Y44-V56 HydrophobicContact CG-CG2 4.17Å; Y44-S69 PolarHBondContact OH-OG 2.78Å; Y44-S69 VanDerWaalsContact OH-OG 3.1Å; Y44-N74 CarbonylContact O-C 3.59Å; Y44-N74 WeakPolarHBondContact O-CA 3.41Å; Y44-N74 WeakPolarHBondContact O-CB 3.36Å; Y44-G75 WeakPolarHBondContact CD1-O 3.44Å; Y44-G75 PolarHBondContact N-O 2.85Å; Y44-G75 PolarHBondContact O-N 3.28Å; Y44-F91 HydrophobicContact CG-CE1 4.08Å; Y44-L104 CarbonylContact C-O 3.54Å; Y44-L104 VanDerWaalsContact CA-O 3.3Å; Y44-L104 WeakPolarHBondContact CA-O 3.37Å
45	E	93.7	Very high	90.4	Very high	98 Å²	98	47.2 Å²	47.2	46%	0.458	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	131.3	177.3	-176	172.3	177.9	0	0	110.5	A47 N74 V103 L104	E45-A47 PolarHBondContact O-N 3.33Å; E45-N74 HydrophobicContact CB-CB 4.33Å; E45-N74 HydrophobicContact CG-CB 4.31Å; E45-V103 WeakPolarHBondContact O-CA 3.27Å; E45-L104 PolarHBondContact N-O 3.46Å; E45-L104 PolarHBondContact O-N 2.85Å
46	V	93.1	Very high	90.7	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.2	174.9	-173.4	0	0	0	0	108.9	L52 I54 S73 K101 V102 V103	V46-L52 HydrophobicContact CB-CB 4.43Å; V46-L52 HydrophobicContact CG1-CB 4.35Å; V46-L52 HydrophobicContact CG1-CD2 4.08Å; V46-I54 HydrophobicContact CG2-CB 3.88Å; V46-I54 HydrophobicContact CG2-CG2 3.6Å; V46-S73 WeakPolarHBondContact CG2-O 3.42Å; V46-S73 PolarHBondContact N-O 3.43Å; V46-K101 HydrophobicContact CG1-CB 4.42Å; V46-V102 CarbonylContact C-O 3.56Å; V46-V103 HydrophobicContact CG2-CG2 4.45Å
47	A	90.4	Very high	91.1	Very high	51 Å²	51	43 Å²	43	42%	0.421	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-37.4	-177.9	0	0	0	0	0	112.7	Y19 E45 V102	Y19-A47 HydrophobicContact CD1-CB 3.87Å; Y19-A47 HydrophobicContact CE1-CB 3.48Å; Y19-A47 VanDerWaalsContact CE1-CB 3.48Å; E45-A47 PolarHBondContact O-N 3.33Å; A47-V102 HydrophobicContact CB-CG1 4.44Å; A47-V102 PolarHBondContact N-O 2.9Å
48	E	89.9	Confident	91.6	Very high	135 Å²	135	40.5 Å²	40.5	63%	0.631	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	149	-177	-166.4	176.2	174.8	0	0	111.8	K101 V102	E48-K101 CarbonylContact O-C 3.57Å; E48-K101 WeakPolarHBondContact O-CA 3.47Å; E48-V102 HydrophobicContact CB-CB 3.91Å; E48-V102 HydrophobicContact CB-CG2 3.92Å; E48-V102 PolarHBondContact N-O 3.42Å; E48-V102 PolarHBondContact O-N 3.36Å
49	G	84.5	Confident	92	Very high	18 Å²	18	42.7 Å²	42.7	19%	0.186	23%	0.227	C	C	.	.	S	Bend	trans	115.5	134.8	168.5	0	0	0	0	0	115	F51 L52	G49-F51 PolarHBondContact O-N 3.3Å; G49-L52 WeakPolarHBondContact O-CA 3.45Å; G49-L52 PolarHBondContact O-N 2.98Å
50	G	83.3	Confident	92.1	Very high	53 Å²	53	40 Å²	40	55%	0.546	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-130.8	169.6	0	0	0	0	0	114.6	L52	G50-L52 VanDerWaalsContact C-N 3.27Å
51	F	87.9	Confident	92.2	Very high	187 Å²	187	42.3 Å²	42.3	82%	0.82	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	14.7	174.5	-64.7	-68.7	0	0	0	113.5	G49 D53	G49-F51 PolarHBondContact O-N 3.3Å; F51-D53 VanDerWaalsContact C-N 3.26Å; F51-D53 PolarHBondContact O-N 2.87Å
52	L	89.7	Confident	92.2	Very high	77 Å²	77	46.1 Å²	46.1	40%	0.403	26%	0.258	S	S	.	.	S	Bend	trans	55	38.4	-175.4	-55.6	171	0	0	0	112.9	V46 G49 G50 S73	V46-L52 HydrophobicContact CB-CB 4.43Å; V46-L52 HydrophobicContact CG1-CB 4.35Å; V46-L52 HydrophobicContact CG1-CD2 4.08Å; G49-L52 WeakPolarHBondContact O-CA 3.45Å; G49-L52 PolarHBondContact O-N 2.98Å; G50-L52 VanDerWaalsContact C-N 3.27Å; L52-S73 WeakPolarHBondContact O-CA 3.39Å; L52-S73 WeakPolarHBondContact O-CB 3.3Å
53	D	92	Very high	92.1	Very high	20 Å²	20	48.5 Å²	48.5	11%	0.107	28%	0.283	C	S	.	.			trans	-116.5	140.7	-177.7	54	-8.7	0	0	0	112.1	F51 R71 M95 K101	F51-D53 VanDerWaalsContact C-N 3.26Å; F51-D53 PolarHBondContact O-N 2.87Å; D53-R71 HydrophobicContact CB-CB 4.22Å; D53-M95 VanDerWaalsContact OD1-CE 3.23Å; D53-M95 WeakPolarHBondContact OD1-CE 3.31Å; D53-M95 WeakPolarHBondContact OD2-CE 3.34Å; D53-K101 WeakPolarHBondContact O-CD 3.31Å; D53-K101 WeakPolarHBondContact O-CE 3.42Å; D53-K101 PolarHBondContact O-NZ 2.77Å; D53-K101 VanDerWaalsContact OD1-CE 3.31Å; D53-K101 WeakPolarHBondContact OD1-CE 3.44Å; D53-K101 IonicContact OD1-NZ 3.9Å; D53-K101 PolarHBondContact OD1-NZ 2.68Å
54	I	94.1	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	149	177.4	-162.2	160	0	0	0	112	V22 Y44 V46 V56 R71 K72 F91 G92 V103	V22-I54 HydrophobicContact CG2-CD1 4.31Å; Y44-I54 HydrophobicContact CD2-CG2 4.08Å; Y44-I54 HydrophobicContact CE2-CG2 4.04Å; V46-I54 HydrophobicContact CG2-CB 3.88Å; V46-I54 HydrophobicContact CG2-CG2 3.6Å; I54-V56 HydrophobicContact CG2-CG2 3.97Å; I54-R71 PolarHBondContact O-N 3.31Å; I54-K72 PolarHBondContact N-O 3.21Å; I54-K72 PolarHBondContact O-N 3.23Å; I54-K72 VanDerWaalsContact O-N 3.16Å; I54-F91 HydrophobicContact CD1-CB 3.74Å; I54-F91 HydrophobicContact CD1-CD1 4.22Å; I54-F91 HydrophobicContact CD1-CG 4.43Å; I54-F91 HydrophobicContact CG1-CB 4.5Å; I54-G92 WeakPolarHBondContact CG1-O 3.41Å; I54-V103 HydrophobicContact CD1-CG2 3.33Å
55	D	95.2	Very high	92.2	Very high	28 Å²	28	52.3 Å²	52.3	15%	0.15	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.3	172.7	-63.3	-24.9	0	0	0	108.8	S69 L70 R71 G92	D55-S69 CarbonylContact C-O 3.56Å; D55-S69 WeakPolarHBondContact CA-O 3.42Å; D55-L70 HydrophobicContact CB-CD2 4.15Å; D55-L70 WeakPolarHBondContact OD1-CA 3.41Å; D55-R71 PolarHBondContact OD1-N 2.59Å; D55-G92 PolarHBondContact N-O 2.68Å; D55-G92 VanDerWaalsContact N-O 3.15Å; D55-G92 PolarHBondContact O-N 2.89Å
56	V	96.1	Very high	92.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.2	179.4	-176.8	0	0	0	0	109	L42 Y44 I54 E68 S69 C90 F91	L42-V56 HydrophobicContact CD2-CG1 3.84Å; Y44-V56 HydrophobicContact CD1-CG2 4.15Å; Y44-V56 HydrophobicContact CD2-CG2 3.93Å; Y44-V56 HydrophobicContact CE1-CB 4.34Å; Y44-V56 HydrophobicContact CE1-CG1 4.35Å; Y44-V56 HydrophobicContact CE1-CG2 3.89Å; Y44-V56 HydrophobicContact CE2-CG2 3.68Å; Y44-V56 HydrophobicContact CG-CG2 4.17Å; I54-V56 HydrophobicContact CG2-CG2 3.97Å; V56-E68 WeakPolarHBondContact O-CA 3.35Å; V56-S69 PolarHBondContact N-O 2.77Å; V56-S69 PolarHBondContact O-N 2.84Å; V56-C90 WeakPolarHBondContact CA-O 3.41Å; V56-F91 HydrophobicContact CG1-CE1 4.33Å; V56-F91 HydrophobicContact CG2-CD1 3.86Å; V56-F91 HydrophobicContact CG2-CE1 4Å
57	N	95.7	Very high	92.1	Very high	16 Å²	16	53.5 Å²	53.5	9%	0.086	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.7	176.2	-67.9	-74.6	0	0	0	110	Y59 K65 E68 Y89 C90	N57-Y59 HydrophobicContact CB-CD2 4.49Å; N57-Y59 HydrophobicContact CB-CE2 3.61Å; N57-K65 WeakPolarHBondContact OD1-CE 3.44Å; N57-K65 PolarHBondContact OD1-NZ 3.08Å; N57-E68 PolarHBondContact OD1-OE1 3.27Å; N57-Y89 CarbonylContact O-C 3.57Å; N57-Y89 WeakPolarHBondContact O-CA 3.45Å; N57-C90 PolarHBondContact N-O 3.45Å; N57-C90 PolarHBondContact O-N 2.84Å
58	V	95.9	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.1	174.3	-173.8	0	0	0	0	109.2	L42 K65 V66 F67 F79 K88	L42-V58 HydrophobicContact CD2-CG2 4.15Å; V58-K65 CarbonylContact O-C 3.49Å; V58-K65 WeakPolarHBondContact O-CA 3.48Å; V58-V66 PolarHBondContact O-N 3.49Å; V58-F67 HydrophobicContact CB-CB 4.06Å; V58-F67 HydrophobicContact CG2-CB 4.13Å; V58-F67 HydrophobicContact CG2-CD1 4.25Å; V58-F67 PolarHBondContact N-O 2.86Å; V58-F67 PolarHBondContact O-N 3.35Å; V58-F79 HydrophobicContact CG1-CE1 4.4Å; V58-F79 HydrophobicContact CG1-CE2 3.85Å; V58-F79 HydrophobicContact CG1-CZ 3.79Å; V58-K88 CarbonylContact C-O 3.58Å; V58-K88 WeakPolarHBondContact CA-O 3.48Å
59	Y	95.6	Very high	92.6	Very high	50 Å²	50	49.9 Å²	49.9	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.7	-179.4	-56.3	-91.9	0	0	0	110.4	N57 A64 K65 Y87 K88	N57-Y59 HydrophobicContact CB-CD2 4.49Å; N57-Y59 HydrophobicContact CB-CE2 3.61Å; Y59-A64 CarbonylContact C-O 3.53Å; Y59-A64 VanDerWaalsContact CA-O 3.3Å; Y59-A64 WeakPolarHBondContact CA-O 3.39Å; Y59-K65 HydrophobicContact CD1-CB 4.19Å; Y59-K65 HydrophobicContact CD1-CG 4.47Å; Y59-K65 HydrophobicContact CE1-CB 4.14Å; Y59-K65 HydrophobicContact CE1-CG 4.24Å; Y59-Y87 WeakPolarHBondContact O-CA 3.42Å; Y59-Y87 WeakPolarHBondContact O-CD1 3.26Å; Y59-K88 HydrophobicContact CD2-CB 4.49Å; Y59-K88 HydrophobicContact CD2-CD 4.49Å; Y59-K88 PolarHBondContact N-O 3.39Å; Y59-K88 PolarHBondContact O-N 3.4Å
60	N	93.7	Very high	93	Very high	24 Å²	24	53.6 Å²	53.6	13%	0.128	31%	0.308	C	S	.	.			trans	-79.5	172.1	171.8	76.7	-8.7	0	0	0	111.1	S62 G63 A64 V66 E83 Y87	N60-S62 PolarHBondContact O-N 2.9Å; N60-S62 PolarHBondContact OD1-N 3.07Å; N60-G63 WeakPolarHBondContact O-CA 3.09Å; N60-G63 PolarHBondContact O-N 3.14Å; N60-G63 PolarHBondContact OD1-N 2.77Å; N60-A64 PolarHBondContact N-O 3.21Å; N60-A64 WeakPolarHBondContact OD1-CA 3.24Å; N60-A64 WeakPolarHBondContact OD1-CB 3.26Å; N60-A64 PolarHBondContact OD1-N 3.42Å; N60-A64 PolarHBondContact OD1-O 2.72Å; N60-V66 HydrophobicContact CB-CG2 3.68Å; N60-E83 PolarHBondContact ND2-OE1 3.47Å; N60-Y87 HydrophobicContact CB-CD1 4.48Å; N60-Y87 HydrophobicContact CB-CE1 3.88Å
61	P	94.1	Very high	93.3	Very high	49 Å²	49	59 Å²	59	32%	0.318	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.4	178.3	-24.8	35.3	0	0	0	113.9	G63 E83 E86 Y87	P61-G63 PolarHBondContact O-N 2.9Å; P61-E83 HydrophobicContact CG-CB 4.33Å; P61-E86 WeakPolarHBondContact CA-O 3.3Å; P61-Y87 HydrophobicContact CG-CD2 4.06Å; P61-Y87 HydrophobicContact CG-CE2 3.84Å
62	S	92.9	Very high	93.6	Very high	88 Å²	88	55.8 Å²	55.8	62%	0.615	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.5	173.2	-67.2	0	0	0	0	114.3	N60 A64 E83	N60-S62 PolarHBondContact O-N 2.9Å; N60-S62 PolarHBondContact OD1-N 3.07Å; S62-A64 VanDerWaalsContact C-N 3.33Å; S62-E83 WeakPolarHBondContact CB-OE2 3.37Å; S62-E83 PolarHBondContact OG-OE2 2.9Å
63	G	90.6	Very high	93.8	Very high	51 Å²	51	54.7 Å²	54.7	53%	0.526	30%	0.296	S	S	.	.	S	Bend	trans	81.9	2.9	-179.3	0	0	0	0	0	115.3	N60 P61	N60-G63 WeakPolarHBondContact O-CA 3.09Å; N60-G63 PolarHBondContact O-N 3.14Å; N60-G63 PolarHBondContact OD1-N 2.77Å; P61-G63 PolarHBondContact O-N 2.9Å
64	A	93.4	Very high	93.9	Very high	52 Å²	52	58.2 Å²	58.2	43%	0.43	32%	0.315	S	S	.	.			trans	-74.1	140.6	172.1	0	0	0	0	0	110.9	Y59 N60 S62 V66	Y59-A64 CarbonylContact C-O 3.53Å; Y59-A64 VanDerWaalsContact CA-O 3.3Å; Y59-A64 WeakPolarHBondContact CA-O 3.39Å; N60-A64 PolarHBondContact N-O 3.21Å; N60-A64 WeakPolarHBondContact OD1-CA 3.24Å; N60-A64 WeakPolarHBondContact OD1-CB 3.26Å; N60-A64 PolarHBondContact OD1-N 3.42Å; N60-A64 PolarHBondContact OD1-O 2.72Å; S62-A64 VanDerWaalsContact C-N 3.33Å; A64-V66 PolarHBondContact O-N 3.05Å
65	K	94	Very high	93.8	Very high	93 Å²	93	59.1 Å²	59.1	40%	0.404	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	120.3	177.9	-164.7	-175.5	-59.4	-178.8	0	109.8	N57 V58 Y59 F67 E68	N57-K65 WeakPolarHBondContact OD1-CE 3.44Å; N57-K65 PolarHBondContact OD1-NZ 3.08Å; V58-K65 CarbonylContact O-C 3.49Å; V58-K65 WeakPolarHBondContact O-CA 3.48Å; Y59-K65 HydrophobicContact CD1-CB 4.19Å; Y59-K65 HydrophobicContact CD1-CG 4.47Å; Y59-K65 HydrophobicContact CE1-CB 4.14Å; Y59-K65 HydrophobicContact CE1-CG 4.24Å; K65-F67 WeakPolarHBondContact CG-O 3.36Å; K65-E68 HydrophobicContact CD-CB 3.78Å; K65-E68 HydrophobicContact CD-CG 4.32Å; K65-E68 VanDerWaalsContact NZ-CD 3.34Å; K65-E68 IonicContact NZ-OE1 3.24Å; K65-E68 PolarHBondContact NZ-OE1 2.82Å; K65-E68 IonicContact NZ-OE2 3.75Å
66	V	92.6	Very high	93.7	Very high	66 Å²	66	65 Å²	65	40%	0.4	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-37.9	179.2	-177.3	0	0	0	0	110.9	V58 N60 A64 F79 Y87	V58-V66 PolarHBondContact O-N 3.49Å; N60-V66 HydrophobicContact CB-CG2 3.68Å; A64-V66 PolarHBondContact O-N 3.05Å; V66-F79 HydrophobicContact CG1-CB 4.13Å; V66-F79 HydrophobicContact CG1-CD2 4.49Å; V66-F79 HydrophobicContact CG1-CG 4.47Å; V66-Y87 HydrophobicContact CG2-CE1 4.42Å
67	F	93.4	Very high	93.6	Very high	65 Å²	65	65.7 Å²	65.7	29%	0.285	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.6	-177.7	179.5	-101.2	0	0	0	110.8	V58 K65 P77	V58-F67 HydrophobicContact CB-CB 4.06Å; V58-F67 HydrophobicContact CG2-CB 4.13Å; V58-F67 HydrophobicContact CG2-CD1 4.25Å; V58-F67 PolarHBondContact N-O 2.86Å; V58-F67 PolarHBondContact O-N 3.35Å; K65-F67 WeakPolarHBondContact CG-O 3.36Å; F67-P77 HydrophobicContact CD1-CB 3.91Å; F67-P77 HydrophobicContact CD1-CG 3.88Å; F67-P77 HydrophobicContact CD2-CB 3.88Å; F67-P77 HydrophobicContact CE1-CB 3.77Å; F67-P77 HydrophobicContact CE1-CG 3.61Å; F67-P77 HydrophobicContact CE2-CB 3.75Å; F67-P77 HydrophobicContact CE2-CG 4.49Å; F67-P77 HydrophobicContact CG-CB 3.96Å; F67-P77 HydrophobicContact CG-CG 4.42Å; F67-P77 HydrophobicContact CZ-CB 3.68Å; F67-P77 HydrophobicContact CZ-CG 3.95Å
68	E	95	Very high	93.4	Very high	98 Å²	98	69.9 Å²	69.9	46%	0.458	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	129.2	173.4	-174.9	167.9	-120.6	0	0	109	V56 N57 K65 L70	V56-E68 WeakPolarHBondContact O-CA 3.35Å; N57-E68 PolarHBondContact OD1-OE1 3.27Å; K65-E68 HydrophobicContact CD-CB 3.78Å; K65-E68 HydrophobicContact CD-CG 4.32Å; K65-E68 VanDerWaalsContact NZ-CD 3.34Å; K65-E68 IonicContact NZ-OE1 3.24Å; K65-E68 PolarHBondContact NZ-OE1 2.82Å; K65-E68 IonicContact NZ-OE2 3.75Å; E68-L70 HydrophobicContact CG-CD2 3.95Å; E68-L70 HydrophobicContact CG-CG 3.99Å
69	S	94.3	Very high	93.2	Very high	13 Å²	13	70.8 Å²	70.8	9%	0.091	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.3	167.9	167.7	0	0	0	0	108.3	Y44 D55 V56 K72	Y44-S69 PolarHBondContact OH-OG 2.78Å; Y44-S69 VanDerWaalsContact OH-OG 3.1Å; D55-S69 CarbonylContact C-O 3.56Å; D55-S69 WeakPolarHBondContact CA-O 3.42Å; V56-S69 PolarHBondContact N-O 2.77Å; V56-S69 PolarHBondContact O-N 2.84Å; S69-K72 WeakPolarHBondContact OG-CB 3.33Å; S69-K72 WeakPolarHBondContact OG-CG 3.08Å
70	L	93.2	Very high	92.9	Very high	95 Å²	95	71.1 Å²	71.1	50%	0.497	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.9	179.8	-57.7	176.4	0	0	0	110.1	D55 E68 K72	D55-L70 HydrophobicContact CB-CD2 4.15Å; D55-L70 WeakPolarHBondContact OD1-CA 3.41Å; E68-L70 HydrophobicContact CG-CD2 3.95Å; E68-L70 HydrophobicContact CG-CG 3.99Å; L70-K72 PolarHBondContact O-N 3.46Å
71	R	91.2	Very high	92.8	Very high	168 Å²	168	70 Å²	70	63%	0.634	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.8	52.4	173.9	-54.9	-171.7	175	179.7	-3.2	114.5	D53 I54 D55 M95	D53-R71 HydrophobicContact CB-CB 4.22Å; I54-R71 PolarHBondContact O-N 3.31Å; D55-R71 PolarHBondContact OD1-N 2.59Å; R71-M95 HydrophobicContact CG-SD 3.78Å
72	K	93.8	Very high	92.5	Very high	118 Å²	118	73.9 Å²	73.9	51%	0.513	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	147.2	174.6	-66.1	-63.2	-174.6	172.7	0	111	I54 S69 L70	I54-K72 PolarHBondContact N-O 3.21Å; I54-K72 PolarHBondContact O-N 3.23Å; I54-K72 VanDerWaalsContact O-N 3.16Å; S69-K72 WeakPolarHBondContact OG-CB 3.33Å; S69-K72 WeakPolarHBondContact OG-CG 3.08Å; L70-K72 PolarHBondContact O-N 3.46Å
73	S	93	Very high	92.3	Very high	54 Å²	54	73.2 Å²	73.2	38%	0.378	38%	0.384	S	S	.	.	S	Bend	trans	-80	-31.6	177.1	49.7	0	0	0	0	114.1	V46 L52	V46-S73 WeakPolarHBondContact CG2-O 3.42Å; V46-S73 PolarHBondContact N-O 3.43Å; L52-S73 WeakPolarHBondContact O-CA 3.39Å; L52-S73 WeakPolarHBondContact O-CB 3.3Å
74	N	93.8	Very high	92.4	Very high	95 Å²	95	74.1 Å²	74.1	51%	0.508	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	160.4	-177.4	61.9	-48.9	0	0	0	109.8	Y44 E45	Y44-N74 CarbonylContact O-C 3.59Å; Y44-N74 WeakPolarHBondContact O-CA 3.41Å; Y44-N74 WeakPolarHBondContact O-CB 3.36Å; E45-N74 HydrophobicContact CB-CB 4.33Å; E45-N74 HydrophobicContact CG-CB 4.31Å
75	G	93	Very high	92.4	Very high	19 Å²	19	72.4 Å²	72.4	20%	0.196	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.4	157.8	176.6	0	0	0	0	0	113	Y44	Y44-G75 WeakPolarHBondContact CD1-O 3.44Å; Y44-G75 PolarHBondContact N-O 2.85Å; Y44-G75 PolarHBondContact O-N 3.28Å
76	R	93.5	Very high	92.4	Very high	151 Å²	151	73.3 Å²	73.3	57%	0.57	38%	0.38	S	S	*	.			trans	-134.3	68.5	175.5	-163.7	-174.4	-154.8	-159.8	9.8	111.6	T41 L42 H43	T41-R76 HydrophobicContact CG2-CG 3.69Å; L42-R76 CarbonylContact O-C 3.54Å; L42-R76 VanDerWaalsContact O-CA 3.27Å; L42-R76 WeakPolarHBondContact O-CA 3.49Å; H43-R76 HydrophobicContact CB-CG 4.47Å
77	P	93	Very high	92.5	Very high	14 Å²	14	70.4 Å²	70.4	9%	0.091	36%	0.362	C	S	.	.			trans	-67.1	133.7	173.7	26.7	-36.2	0	0	0	112	L42 F67	L42-P77 HydrophobicContact CB-CG 4.15Å; L42-P77 HydrophobicContact CD2-CG 4.48Å; L42-P77 PolarHBondContact N-O 2.96Å; L42-P77 VanDerWaalsContact N-O 3.07Å; L42-P77 WeakPolarHBondContact O-CD 3.5Å; F67-P77 HydrophobicContact CD1-CB 3.91Å; F67-P77 HydrophobicContact CD1-CG 3.88Å; F67-P77 HydrophobicContact CD2-CB 3.88Å; F67-P77 HydrophobicContact CE1-CB 3.77Å; F67-P77 HydrophobicContact CE1-CG 3.61Å; F67-P77 HydrophobicContact CE2-CB 3.75Å; F67-P77 HydrophobicContact CE2-CG 4.49Å; F67-P77 HydrophobicContact CG-CB 3.96Å; F67-P77 HydrophobicContact CG-CG 4.42Å; F67-P77 HydrophobicContact CZ-CB 3.68Å; F67-P77 HydrophobicContact CZ-CG 3.95Å
78	E	92.3	Very high	92.6	Very high	105 Å²	105	70.5 Å²	70.5	49%	0.491	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133	172.7	-61.2	-177.2	-166.1	0	0	109.1	K39 L40 T41	K39-E78 WeakPolarHBondContact CE-OE2 3.41Å; K39-E78 IonicContact NZ-OE2 3.65Å; K39-E78 PolarHBondContact NZ-OE2 3.02Å; L40-E78 CarbonylContact O-C 3.54Å; L40-E78 WeakPolarHBondContact O-CA 3.49Å; T41-E78 HydrophobicContact CG2-CG 3.93Å
79	F	90.7	Very high	92.6	Very high	19 Å²	19	66.4 Å²	66.4	8%	0.083	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	148.4	-178.2	48.7	-79.9	0	0	0	111.2	L40 L42 V58 V66 Y87 M107	L40-F79 HydrophobicContact CB-CD1 4.35Å; L40-F79 HydrophobicContact CB-CD2 3.55Å; L40-F79 HydrophobicContact CB-CE1 4.07Å; L40-F79 HydrophobicContact CB-CE2 3.26Å; L40-F79 HydrophobicContact CB-CG 4.1Å; L40-F79 HydrophobicContact CB-CZ 3.52Å; L40-F79 HydrophobicContact CD1-CD2 3.73Å; L40-F79 HydrophobicContact CD1-CE2 3.28Å; L40-F79 HydrophobicContact CD1-CZ 4.2Å; L40-F79 HydrophobicContact CG-CD2 4.23Å; L40-F79 HydrophobicContact CG-CE2 3.87Å; L40-F79 HydrophobicContact CG-CZ 4.45Å; L40-F79 PolarHBondContact N-O 3Å; L40-F79 PolarHBondContact O-N 2.89Å; L42-F79 HydrophobicContact CB-CE1 4.21Å; V58-F79 HydrophobicContact CG1-CE1 4.4Å; V58-F79 HydrophobicContact CG1-CE2 3.85Å; V58-F79 HydrophobicContact CG1-CZ 3.79Å; V66-F79 HydrophobicContact CG1-CB 4.13Å; V66-F79 HydrophobicContact CG1-CD2 4.49Å; V66-F79 HydrophobicContact CG1-CG 4.47Å; F79-Y87 HydrophobicContact CE2-CD1 4.19Å; F79-M107 HydrophobicContact CZ-CE 4.13Å; F79-M107 HydrophobicContact CZ-SD 4.45Å
80	A	90.1	Very high	92.7	Very high	56 Å²	56	65.9 Å²	65.9	46%	0.463	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	137.6	175.4	0	0	0	0	0	110.6	N82	A80-N82 PolarHBondContact O-N 2.85Å; A80-N82 VanDerWaalsContact O-N 3.08Å
81	A	90.4	Very high	92.8	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	32%	0.315	C	S	.	.			trans	-78.2	89.4	178.7	0	0	0	0	0	110.6	V34 A35 S36 G37 S38 L40 E83 Y87	V34-A81 HydrophobicContact CB-CB 4.48Å; V34-A81 HydrophobicContact CG1-CB 3.84Å; A35-A81 WeakPolarHBondContact O-CB 3.29Å; S36-A81 CarbonylContact C-O 3.56Å; S36-A81 WeakPolarHBondContact CA-O 3.22Å; G37-A81 PolarHBondContact N-O 3.36Å; S38-A81 VanDerWaalsContact O-CB 3.24Å; S38-A81 WeakPolarHBondContact O-CB 3.37Å; S38-A81 PolarHBondContact O-N 3.42Å; L40-A81 HydrophobicContact CD1-CB 4.08Å; A81-E83 VanDerWaalsContact C-N 3.29Å; A81-E83 PolarHBondContact O-N 3.2Å; A81-Y87 VanDerWaalsContact CA-OH 3.26Å; A81-Y87 WeakPolarHBondContact CA-OH 3.14Å; A81-Y87 HydrophobicContact CB-CE2 3.91Å
82	N	88.8	Confident	93	Very high	131 Å²	131	53.5 Å²	53.5	70%	0.701	29%	0.286	S	S	*	.			trans	-65.4	-33.5	178.8	-63.2	-33	0	0	0	112.5	S36 A80 Y87	S36-N82 PolarHBondContact OG-O 2.79Å; A80-N82 PolarHBondContact O-N 2.85Å; A80-N82 VanDerWaalsContact O-N 3.08Å; N82-Y87 PolarHBondContact N-OH 2.88Å
83	E	89.4	Confident	93	Very high	73 Å²	73	47.9 Å²	47.9	34%	0.341	26%	0.262	S	S	.	.	S	Bend	trans	-118.4	138.9	-175.7	-69.1	168.4	-154.9	0	0	110	N60 P61 S62 A81 Y87	N60-E83 PolarHBondContact ND2-OE1 3.47Å; P61-E83 HydrophobicContact CG-CB 4.33Å; S62-E83 WeakPolarHBondContact CB-OE2 3.37Å; S62-E83 PolarHBondContact OG-OE2 2.9Å; A81-E83 VanDerWaalsContact C-N 3.29Å; A81-E83 PolarHBondContact O-N 3.2Å; E83-Y87 WeakPolarHBondContact O-CE2 2.97Å; E83-Y87 PolarHBondContact O-OH 3.05Å
84	A	91	Very high	92.8	Very high	71 Å²	71	52.3 Å²	52.3	59%	0.587	27%	0.27	S	S	*	.	S	Bend	trans	-76.7	127.9	172.3	0	0	0	0	0	109.6	V34	V34-A84 WeakPolarHBondContact O-CA 3.46Å
85	G	93.3	Very high	92.3	Very high	15 Å²	15	50.6 Å²	50.6	16%	0.155	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-161.5	179.6	0	0	0	0	0	113.4	R33 V34	R33-G85 WeakPolarHBondContact CA-O 3.43Å; V34-G85 PolarHBondContact N-O 2.88Å; V34-G85 PolarHBondContact O-N 2.94Å
86	E	94.6	Very high	91.8	Very high	112 Å²	112	50.3 Å²	50.3	52%	0.523	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.8	-178.4	-166.6	175.1	109.7	0	0	110.6	F31 D32 P61	F31-E86 HydrophobicContact CB-CG 3.83Å; F31-E86 HydrophobicContact CD1-CG 4.02Å; F31-E86 WeakPolarHBondContact CD1-OE1 3.38Å; F31-E86 HydrophobicContact CG-CG 4.39Å; D32-E86 WeakPolarHBondContact O-CA 3.34Å; P61-E86 WeakPolarHBondContact CA-O 3.3Å
87	Y	95.1	Very high	91.1	Very high	6 Å²	6	48.7 Å²	48.7	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.4	171.2	-81	-99.5	0	0	0	109.1	F31 D32 V34 L40 Y59 N60 P61 V66 F79 A81 N82 E83	F31-Y87 WeakPolarHBondContact CA-O 3.45Å; D32-Y87 PolarHBondContact N-O 2.99Å; D32-Y87 VanDerWaalsContact N-O 3.08Å; D32-Y87 PolarHBondContact O-N 2.74Å; V34-Y87 HydrophobicContact CB-CD2 4.05Å; V34-Y87 HydrophobicContact CB-CE2 4.35Å; V34-Y87 HydrophobicContact CG2-CD2 4.01Å; L40-Y87 HydrophobicContact CD1-CD1 4.1Å; L40-Y87 HydrophobicContact CD1-CD2 4.1Å; L40-Y87 HydrophobicContact CD1-CE1 4.32Å; L40-Y87 HydrophobicContact CD1-CE2 4.32Å; L40-Y87 HydrophobicContact CD1-CG 4Å; Y59-Y87 WeakPolarHBondContact O-CA 3.42Å; Y59-Y87 WeakPolarHBondContact O-CD1 3.26Å; N60-Y87 HydrophobicContact CB-CD1 4.48Å; N60-Y87 HydrophobicContact CB-CE1 3.88Å; P61-Y87 HydrophobicContact CG-CD2 4.06Å; P61-Y87 HydrophobicContact CG-CE2 3.84Å; V66-Y87 HydrophobicContact CG2-CE1 4.42Å; F79-Y87 HydrophobicContact CE2-CD1 4.19Å; A81-Y87 VanDerWaalsContact CA-OH 3.26Å; A81-Y87 WeakPolarHBondContact CA-OH 3.14Å; A81-Y87 HydrophobicContact CB-CE2 3.91Å; N82-Y87 PolarHBondContact N-OH 2.88Å; E83-Y87 WeakPolarHBondContact O-CE2 2.97Å; E83-Y87 PolarHBondContact O-OH 3.05Å
88	K	95.5	Very high	90.6	Very high	67 Å²	67	55.9 Å²	55.9	29%	0.291	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124	179.8	-178.2	-175.7	76.6	174.7	0	110	C29 F30 F31 V58 Y59	C29-K88 HydrophobicContact CB-CD 4.33Å; C29-K88 HydrophobicContact CB-CG 4.22Å; F30-K88 WeakPolarHBondContact O-CA 3.27Å; F31-K88 HydrophobicContact CD1-CB 3.8Å; F31-K88 HydrophobicContact CD1-CD 4.3Å; F31-K88 HydrophobicContact CD1-CG 3.81Å; F31-K88 HydrophobicContact CE1-CB 3.78Å; F31-K88 HydrophobicContact CE1-CD 3.42Å; F31-K88 VanDerWaalsContact CE1-CD 3.42Å; F31-K88 HydrophobicContact CE1-CG 3.41Å; F31-K88 VanDerWaalsContact CE1-CG 3.41Å; F31-K88 HydrophobicContact CZ-CD 3.77Å; F31-K88 HydrophobicContact CZ-CG 3.92Å; V58-K88 CarbonylContact C-O 3.58Å; V58-K88 WeakPolarHBondContact CA-O 3.48Å; Y59-K88 HydrophobicContact CD2-CB 4.49Å; Y59-K88 HydrophobicContact CD2-CD 4.49Å; Y59-K88 PolarHBondContact N-O 3.39Å; Y59-K88 PolarHBondContact O-N 3.4Å
89	Y	95	Very high	90.4	Very high	12 Å²	12	54.1 Å²	54.1	5%	0.047	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	173.7	49.5	-81.9	0	0	0	110	C29 F30 D32 L42 N57 F91 F105 M107	C29-Y89 WeakPolarHBondContact CA-O 3.45Å; F30-Y89 HydrophobicContact CB-CD2 3.89Å; F30-Y89 HydrophobicContact CB-CE1 4.11Å; F30-Y89 HydrophobicContact CB-CE2 3.32Å; F30-Y89 VanDerWaalsContact CB-CZ 3.43Å; F30-Y89 HydrophobicContact CD2-CD2 4.48Å; F30-Y89 HydrophobicContact CD2-CE2 4.21Å; F30-Y89 HydrophobicContact CG-CE2 4.01Å; F30-Y89 PolarHBondContact N-O 2.85Å; F30-Y89 PolarHBondContact O-N 3.26Å; D32-Y89 HydrophobicContact CB-CE1 4.33Å; D32-Y89 VanDerWaalsContact OD2-CE1 3.29Å; D32-Y89 WeakPolarHBondContact OD2-CE1 3.38Å; D32-Y89 PolarHBondContact OD2-OH 3.43Å; L42-Y89 HydrophobicContact CD1-CD2 4.08Å; L42-Y89 HydrophobicContact CD1-CE2 4.36Å; N57-Y89 CarbonylContact O-C 3.57Å; N57-Y89 WeakPolarHBondContact O-CA 3.45Å; Y89-F91 HydrophobicContact CD2-CE2 4.05Å; Y89-F91 HydrophobicContact CD2-CZ 4.48Å; Y89-F91 HydrophobicContact CE2-CE2 4.5Å; Y89-F105 HydrophobicContact CE2-CD2 4.07Å; Y89-F105 AromaticContact CE2-CE2 3.74Å; Y89-F105 HydrophobicContact CE2-CE2 3.74Å; Y89-M107 HydrophobicContact CD1-CE 3.35Å; Y89-M107 HydrophobicContact CD2-CE 4.19Å; Y89-M107 HydrophobicContact CE1-CE 3.41Å; Y89-M107 VanDerWaalsContact CE1-CE 3.41Å; Y89-M107 HydrophobicContact CE1-CG 4.39Å; Y89-M107 HydrophobicContact CE2-CE 4.2Å; Y89-M107 HydrophobicContact CG-CE 3.78Å
90	C	95.9	Very high	90.5	Very high	1 Å²	1	56 Å²	56	1%	0.007	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.2	-171.5	-62	0	0	0	0	111.3	E28 C29 V56 N57	E28-C90 CarbonylContact O-C 3.55Å; E28-C90 VanDerWaalsContact O-CA 3.32Å; E28-C90 WeakPolarHBondContact O-CA 3.41Å; C29-C90 HydrophobicContact CB-CB 4.12Å; C29-C90 WeakPolarHBondContact CB-SG 3.29Å; C29-C90 WeakPolarHBondContact SG-CB 3.23Å; C29-C90 CovalentContact SG-SG 2.04Å; C29-C90 PolarHBondContact SG-SG 3.45Å; V56-C90 WeakPolarHBondContact CA-O 3.41Å; N57-C90 PolarHBondContact N-O 3.45Å; N57-C90 PolarHBondContact O-N 2.84Å
91	F	96.2	Very high	90.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	107.3	175.4	-63.8	-75.3	0	0	0	109	I20 V22 E27 E28 F30 L42 Y44 I54 V56 Y89 V103 F105	I20-F91 HydrophobicContact CD1-CD2 3.84Å; I20-F91 HydrophobicContact CD1-CE2 4.35Å; I20-F91 HydrophobicContact CD1-CG 4.32Å; V22-F91 WeakPolarHBondContact CG1-O 3.39Å; V22-F91 HydrophobicContact CG2-CB 4.14Å; E27-F91 CarbonylContact C-O 3.54Å; E27-F91 WeakPolarHBondContact CA-O 3.36Å; E28-F91 PolarHBondContact N-O 2.88Å; E28-F91 PolarHBondContact O-N 3Å; F30-F91 HydrophobicContact CD2-CD2 4.11Å; F30-F91 HydrophobicContact CD2-CE2 4.13Å; F30-F91 HydrophobicContact CE2-CD2 4.09Å; F30-F91 HydrophobicContact CE2-CE2 4.35Å; L42-F91 HydrophobicContact CD1-CZ 4.17Å; L42-F91 HydrophobicContact CD2-CZ 4.47Å; Y44-F91 HydrophobicContact CG-CE1 4.08Å; I54-F91 HydrophobicContact CD1-CB 3.74Å; I54-F91 HydrophobicContact CD1-CD1 4.22Å; I54-F91 HydrophobicContact CD1-CG 4.43Å; I54-F91 HydrophobicContact CG1-CB 4.5Å; V56-F91 HydrophobicContact CG1-CE1 4.33Å; V56-F91 HydrophobicContact CG2-CD1 3.86Å; V56-F91 HydrophobicContact CG2-CE1 4Å; Y89-F91 HydrophobicContact CD2-CE2 4.05Å; Y89-F91 HydrophobicContact CD2-CZ 4.48Å; Y89-F91 HydrophobicContact CE2-CE2 4.5Å; F91-V103 HydrophobicContact CD1-CG1 4.23Å; F91-V103 HydrophobicContact CE1-CG1 4.29Å; F91-F105 HydrophobicContact CE1-CB 4.32Å; F91-F105 HydrophobicContact CE2-CB 4.06Å; F91-F105 AromaticContact CE2-CD1 3.8Å; F91-F105 HydrophobicContact CE2-CD1 3.8Å; F91-F105 HydrophobicContact CE2-CD2 4.11Å; F91-F105 HydrophobicContact CE2-CE1 4.28Å; F91-F105 AromaticContact CE2-CG 3.71Å; F91-F105 HydrophobicContact CE2-CG 3.71Å; F91-F105 HydrophobicContact CZ-CB 3.53Å; F91-F105 HydrophobicContact CZ-CD1 4.16Å; F91-F105 HydrophobicContact CZ-CD2 4.23Å; F91-F105 AromaticContact CZ-CG 3.71Å; F91-F105 HydrophobicContact CZ-CG 3.71Å
92	G	94.3	Very high	90.7	Very high	3 Å²	3	54.5 Å²	54.5	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.6	-175.1	0	0	0	0	0	113	I54 D55	I54-G92 WeakPolarHBondContact CG1-O 3.41Å; D55-G92 PolarHBondContact N-O 2.68Å; D55-G92 VanDerWaalsContact N-O 3.15Å; D55-G92 PolarHBondContact O-N 2.89Å
93	N	93.6	Very high	91	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.263	C	S	.	.			trans	-115.7	34.9	172.2	-170.9	29.9	0	0	0	111.3	V22 D23 N25 S26 M95 S96 T99 K101	V22-N93 HydrophobicContact CB-CB 4.25Å; V22-N93 HydrophobicContact CG1-CB 3.62Å; V22-N93 PolarHBondContact O-ND2 3.08Å; D23-N93 WeakPolarHBondContact O-CB 3.48Å; D23-N93 PolarHBondContact O-ND2 2.84Å; N25-N93 PolarHBondContact N-O 3.33Å; N25-N93 VanDerWaalsContact N-O 3.13Å; S26-N93 PolarHBondContact O-N 3.3Å; N93-M95 PolarHBondContact O-N 2.95Å; N93-M95 VanDerWaalsContact O-N 3.14Å; N93-S96 PolarHBondContact O-N 3.38Å; N93-S96 WeakPolarHBondContact OD1-CB 3.43Å; N93-S96 PolarHBondContact OD1-OG 3.07Å; N93-T99 PolarHBondContact ND2-O 2.84Å; N93-K101 VanDerWaalsContact OD1-CD 3.26Å; N93-K101 WeakPolarHBondContact OD1-CD 3.36Å; N93-K101 VanDerWaalsContact OD1-CE 3.28Å; N93-K101 WeakPolarHBondContact OD1-CE 3.47Å; N93-K101 PolarHBondContact OD1-NZ 2.82Å
94	R	88.6	Confident	91.1	Very high	148 Å²	148	47.5 Å²	47.5	56%	0.558	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.2	179.3	-70.7	-176.7	178.7	156.7	3.2	114.1	E27	E27-R94 IonicContact OE1-CZ 2.76Å; E27-R94 IonicContact OE1-NH2 2.73Å; E27-R94 PolarHBondContact OE1-NH2 2.97Å; E27-R94 IonicContact OE2-CZ 3Å; E27-R94 VanDerWaalsContact OE2-CZ 3.24Å; E27-R94 IonicContact OE2-NE 3.96Å; E27-R94 IonicContact OE2-NH1 3.76Å; E27-R94 IonicContact OE2-NH2 3.67Å; E27-R94 PolarHBondContact OE2-NH2 2.91Å
95	M	84.3	Confident	91.2	Very high	58 Å²	58	45.4 Å²	45.4	29%	0.286	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-21.5	-177.4	53.3	159.2	-75.9	0	0	114.6	D53 R71 N93	D53-M95 VanDerWaalsContact OD1-CE 3.23Å; D53-M95 WeakPolarHBondContact OD1-CE 3.31Å; D53-M95 WeakPolarHBondContact OD2-CE 3.34Å; R71-M95 HydrophobicContact CG-SD 3.78Å; N93-M95 PolarHBondContact O-N 2.95Å; N93-M95 VanDerWaalsContact O-N 3.14Å
96	S	82.1	Confident	91.1	Very high	14 Å²	14	50.1 Å²	50.1	10%	0.098	26%	0.257	C	S	.	.			trans	-82.9	132.9	177	-74.3	0	0	0	0	110.7	N25 N93 K101	N25-S96 PolarHBondContact N-O 2.82Å; N93-S96 PolarHBondContact O-N 3.38Å; N93-S96 WeakPolarHBondContact OD1-CB 3.43Å; N93-S96 PolarHBondContact OD1-OG 3.07Å; S96-K101 WeakPolarHBondContact OG-CE 3.39Å; S96-K101 PolarHBondContact OG-NZ 3.41Å; S96-K101 VanDerWaalsContact OG-NZ 3.15Å
97	S	79	Confident	90.9	Very high	117 Å²	117	46.5 Å²	46.5	82%	0.818	24%	0.24	S	C	*	.	S	Bend	trans	-85.3	-24.6	-178.6	53.7	0	0	0	0	114.3
98	M	83	Confident	90.6	Very high	164 Å²	164	47.5 Å²	47.5	81%	0.808	25%	0.25	S	S	*	.	S	Bend	trans	-144.2	-33	-174.5	-68.1	-167.1	97.8	0	0	115.4
99	T	88.6	Confident	90.4	Very high	68 Å²	68	47.6 Å²	47.6	42%	0.417	25%	0.253	S	S	.	.			trans	-95.6	130	-171.7	49.1	0	0	0	0	112.4	N93	N93-T99 PolarHBondContact ND2-O 2.84Å
100	P	91.5	Very high	89.9	Confident	59 Å²	59	49.9 Å²	49.9	38%	0.383	26%	0.264	S	S	.	.			trans	-67.5	156.5	168.2	31.2	-34.6	0	0	0	109.8	V21 V22	V21-P100 HydrophobicContact CG1-CB 3.81Å; V22-P100 WeakPolarHBondContact O-CA 3.49Å
101	K	93.5	Very high	89.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.7	175.8	-71.8	179.4	179.5	150.3	0	110.1	V21 V22 V46 E48 D53 N93 S96	V21-K101 WeakPolarHBondContact CA-O 3.34Å; V22-K101 PolarHBondContact N-O 2.88Å; V22-K101 PolarHBondContact O-N 3.44Å; V46-K101 HydrophobicContact CG1-CB 4.42Å; E48-K101 CarbonylContact O-C 3.57Å; E48-K101 WeakPolarHBondContact O-CA 3.47Å; D53-K101 WeakPolarHBondContact O-CD 3.31Å; D53-K101 WeakPolarHBondContact O-CE 3.42Å; D53-K101 PolarHBondContact O-NZ 2.77Å; D53-K101 VanDerWaalsContact OD1-CE 3.31Å; D53-K101 WeakPolarHBondContact OD1-CE 3.44Å; D53-K101 IonicContact OD1-NZ 3.9Å; D53-K101 PolarHBondContact OD1-NZ 2.68Å; N93-K101 VanDerWaalsContact OD1-CD 3.26Å; N93-K101 WeakPolarHBondContact OD1-CD 3.36Å; N93-K101 VanDerWaalsContact OD1-CE 3.28Å; N93-K101 WeakPolarHBondContact OD1-CE 3.47Å; N93-K101 PolarHBondContact OD1-NZ 2.82Å; S96-K101 WeakPolarHBondContact OG-CE 3.39Å; S96-K101 PolarHBondContact OG-NZ 3.41Å; S96-K101 VanDerWaalsContact OG-NZ 3.15Å
102	V	92.5	Very high	88.3	Confident	26 Å²	26	58.2 Å²	58.2	16%	0.158	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.9	-179.7	-174.4	0	0	0	0	108.2	Y19 I20 V21 V46 A47 E48	Y19-V102 VanDerWaalsContact CB-CG1 3.48Å; Y19-V102 HydrophobicContact CD1-CG1 3.71Å; Y19-V102 HydrophobicContact CG-CG1 3.79Å; I20-V102 CarbonylContact O-C 3.59Å; I20-V102 WeakPolarHBondContact O-CA 3.3Å; V21-V102 HydrophobicContact CG2-CG2 4.44Å; V46-V102 CarbonylContact C-O 3.56Å; A47-V102 HydrophobicContact CB-CG1 4.44Å; A47-V102 PolarHBondContact N-O 2.9Å; E48-V102 HydrophobicContact CB-CB 3.91Å; E48-V102 HydrophobicContact CB-CG2 3.92Å; E48-V102 PolarHBondContact N-O 3.42Å; E48-V102 PolarHBondContact O-N 3.36Å
103	V	93.6	Very high	87.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.4	-173.7	-170.8	0	0	0	0	109.3	I20 V22 E45 V46 I54 F91	I20-V103 HydrophobicContact CD1-CB 4.25Å; I20-V103 HydrophobicContact CG1-CB 3.87Å; I20-V103 VanDerWaalsContact CG1-O 3.28Å; I20-V103 WeakPolarHBondContact CG1-O 3.43Å; I20-V103 PolarHBondContact N-O 2.99Å; I20-V103 PolarHBondContact O-N 2.64Å; V22-V103 HydrophobicContact CG2-CG2 4.14Å; E45-V103 WeakPolarHBondContact O-CA 3.27Å; V46-V103 HydrophobicContact CG2-CG2 4.45Å; I54-V103 HydrophobicContact CD1-CG2 3.33Å; F91-V103 HydrophobicContact CD1-CG1 4.23Å; F91-V103 HydrophobicContact CE1-CG1 4.29Å
104	L	92.3	Very high	86.1	Confident	56 Å²	56	68.3 Å²	68.3	29%	0.293	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.6	165.1	175.8	65.2	0	0	0	107.4	Y18 Y19 Y44 E45	Y18-L104 WeakPolarHBondContact O-CD1 3.15Å; Y19-L104 HydrophobicContact CD1-CB 4.19Å; Y19-L104 HydrophobicContact CE1-CB 4.14Å; Y44-L104 CarbonylContact C-O 3.54Å; Y44-L104 VanDerWaalsContact CA-O 3.3Å; Y44-L104 WeakPolarHBondContact CA-O 3.37Å; E45-L104 PolarHBondContact N-O 3.46Å; E45-L104 PolarHBondContact O-N 2.85Å
105	F	92.6	Very high	85.3	Confident	27 Å²	27	69.5 Å²	69.5	12%	0.118	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	157.2	173.7	76.7	-88.1	0	0	0	112.1	Y18 I20 F30 L42 H43 Y89 F91	Y18-F105 HydrophobicContact CE1-CE1 4.16Å; Y18-F105 HydrophobicContact CE1-CZ 4.35Å; I20-F105 HydrophobicContact CB-CE1 4.44Å; I20-F105 HydrophobicContact CD1-CD1 3.74Å; I20-F105 HydrophobicContact CD1-CE1 3.69Å; I20-F105 HydrophobicContact CG1-CD1 3.95Å; I20-F105 HydrophobicContact CG1-CE1 3.99Å; I20-F105 HydrophobicContact CG2-CD1 4.38Å; I20-F105 HydrophobicContact CG2-CE1 3.67Å; F30-F105 AromaticContact CD1-CZ 3.86Å; F30-F105 HydrophobicContact CD1-CZ 3.86Å; F30-F105 HydrophobicContact CD2-CE1 4.15Å; F30-F105 HydrophobicContact CD2-CE2 4.43Å; F30-F105 AromaticContact CD2-CZ 3.81Å; F30-F105 HydrophobicContact CD2-CZ 3.81Å; F30-F105 HydrophobicContact CE1-CE1 4.23Å; F30-F105 AromaticContact CE1-CZ 3.82Å; F30-F105 HydrophobicContact CE1-CZ 3.82Å; F30-F105 AromaticContact CE2-CE1 3.73Å; F30-F105 HydrophobicContact CE2-CE1 3.73Å; F30-F105 AromaticContact CE2-CZ 3.8Å; F30-F105 HydrophobicContact CE2-CZ 3.8Å; F30-F105 HydrophobicContact CG-CE2 4.39Å; F30-F105 AromaticContact CG-CZ 3.88Å; F30-F105 HydrophobicContact CG-CZ 3.88Å; F30-F105 AromaticContact CZ-CE1 3.78Å; F30-F105 HydrophobicContact CZ-CE1 3.78Å; F30-F105 AromaticContact CZ-CZ 3.81Å; F30-F105 HydrophobicContact CZ-CZ 3.81Å; L42-F105 HydrophobicContact CD1-CD2 4.47Å; H43-F105 CarbonylContact O-C 3.59Å; H43-F105 WeakPolarHBondContact O-CA 3.33Å; H43-F105 WeakPolarHBondContact O-CB 3.47Å; Y89-F105 HydrophobicContact CE2-CD2 4.07Å; Y89-F105 AromaticContact CE2-CE2 3.74Å; Y89-F105 HydrophobicContact CE2-CE2 3.74Å; F91-F105 HydrophobicContact CE1-CB 4.32Å; F91-F105 HydrophobicContact CE2-CB 4.06Å; F91-F105 AromaticContact CE2-CD1 3.8Å; F91-F105 HydrophobicContact CE2-CD1 3.8Å; F91-F105 HydrophobicContact CE2-CD2 4.11Å; F91-F105 HydrophobicContact CE2-CE1 4.28Å; F91-F105 AromaticContact CE2-CG 3.71Å; F91-F105 HydrophobicContact CE2-CG 3.71Å; F91-F105 HydrophobicContact CZ-CB 3.53Å; F91-F105 HydrophobicContact CZ-CD1 4.16Å; F91-F105 HydrophobicContact CZ-CD2 4.23Å; F91-F105 AromaticContact CZ-CG 3.71Å; F91-F105 HydrophobicContact CZ-CG 3.71Å
106	E	90.8	Very high	84.7	Confident	115 Å²	115	69.9 Å²	69.9	54%	0.537	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	131.4	176.3	-178.1	177.1	-169.4	0	0	108.9	H43	H43-E106 HydrophobicContact CB-CB 4.42Å; H43-E106 PolarHBondContact N-O 2.9Å; H43-E106 PolarHBondContact O-N 2.81Å
107	M	90.9	Very high	84.3	Confident	35 Å²	35	74 Å²	74	17%	0.172	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118	173.3	178.9	61.4	77.4	0	0	109	L40 L42 F79 Y89 I109	L40-M107 HydrophobicContact CB-SD 4.46Å; L40-M107 HydrophobicContact CD2-SD 4.31Å; L42-M107 HydrophobicContact CB-CE 3.99Å; L42-M107 HydrophobicContact CB-SD 4.35Å; L42-M107 HydrophobicContact CD1-CE 3.92Å; L42-M107 HydrophobicContact CG-CE 4.44Å; F79-M107 HydrophobicContact CZ-CE 4.13Å; F79-M107 HydrophobicContact CZ-SD 4.45Å; Y89-M107 HydrophobicContact CD1-CE 3.35Å; Y89-M107 HydrophobicContact CD2-CE 4.19Å; Y89-M107 HydrophobicContact CE1-CE 3.41Å; Y89-M107 VanDerWaalsContact CE1-CE 3.41Å; Y89-M107 HydrophobicContact CE1-CG 4.39Å; Y89-M107 HydrophobicContact CE2-CE 4.2Å; Y89-M107 HydrophobicContact CG-CE 3.78Å; M107-I109 HydrophobicContact CG-CG1 4.2Å
108	A	90	Very high	83.9	Confident	28 Å²	28	77.4 Å²	77.4	23%	0.231	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.2	174.4	0	0	0	0	0	110.2	L40 T41	L40-A108 WeakPolarHBondContact CA-O 3.47Å; T41-A108 PolarHBondContact N-O 3.39Å; T41-A108 PolarHBondContact O-N 3.05Å
109	I	90.3	Very high	83.7	Confident	69 Å²	69	75.6 Å²	75.6	35%	0.354	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	114.2	179.4	-48.5	176.6	0	0	0	107.8	D32 V34 L40 M107 E111	D32-I109 HydrophobicContact CB-CD1 4.14Å; V34-I109 HydrophobicContact CG1-CG2 3.96Å; V34-I109 HydrophobicContact CG2-CD1 4.26Å; L40-I109 HydrophobicContact CD2-CB 4.03Å; L40-I109 HydrophobicContact CD2-CD1 4.34Å; L40-I109 HydrophobicContact CD2-CG1 3.6Å; L40-I109 HydrophobicContact CD2-CG2 3.83Å; M107-I109 HydrophobicContact CG-CG1 4.2Å; I109-E111 HydrophobicContact CG2-CG 4.4Å
110	E	85.2	Confident	83.2	Confident	59 Å²	59	74.2 Å²	74.2	28%	0.276	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.8	177.6	-64.5	177.7	166.5	0	0	109.1	S38 K39	S38-E110 CarbonylContact C-O 3.54Å; S38-E110 WeakPolarHBondContact CA-O 3.33Å; S38-E110 WeakPolarHBondContact CB-O 3.05Å; K39-E110 HydrophobicContact CB-CB 4.25Å; K39-E110 PolarHBondContact N-O 3.16Å; K39-E110 PolarHBondContact O-N 3.49Å
111	E	81.5	Confident	82.9	Confident	100 Å²	100	77.6 Å²	77.6	47%	0.467	40%	0.396	S	S	.	.			trans	-102.2	134.8	174.5	-54.3	-160.4	148.5	0	0	110.8	S38 I109 Q113 H136	S38-E111 WeakPolarHBondContact OG-CG 3.32Å; I109-E111 HydrophobicContact CG2-CG 4.4Å; E111-Q113 PolarHBondContact O-N 2.98Å; E111-H136 PolarHBondContact O-CE1 3Å
112	D	77.3	Confident	82.5	Confident	77 Å²	77	84.1 Å²	84.1	41%	0.412	43%	0.426	S	S	.	.			trans	-59.6	124.6	170.6	-85.1	19.5	0	0	0	110.3	L114 N132 H136	D112-L114 VanDerWaalsContact C-N 3.32Å; D112-L114 PolarHBondContact O-N 3.23Å; D112-N132 WeakPolarHBondContact CB-ND2 3.45Å; D112-N132 VanDerWaalsContact CG-ND2 3.32Å; D112-N132 PolarHBondContact OD2-ND2 3.01Å; D112-H136 IonicContact OD1-CD2 3.62Å; D112-H136 IonicContact OD1-CE1 2.68Å; D112-H136 IonicContact OD1-NE2 3.57Å; D112-H136 PolarHBondContact OD1-NE2 2.76Å
113	Q	71.5	Confident	82.2	Confident	138 Å²	138	91 Å²	91	65%	0.645	46%	0.457	S	S	*	.	S	Bend	trans	-68.9	-31.6	-178.7	-63.9	-62.8	-55.2	0	0	112.4	E111 S135	E111-Q113 PolarHBondContact O-N 2.98Å; Q113-S135 VanDerWaalsContact CG-OG 3.31Å; Q113-S135 WeakPolarHBondContact CG-OG 3.43Å
114	L	70.3	Confident	81.8	Confident	77 Å²	77	95.6 Å²	95.6	40%	0.403	48%	0.478	S	S	.	.	S	Bend	trans	-117.6	127.7	179.9	-63.9	173.7	0	0	0	110.1	D112 V128 V131 N132	D112-L114 VanDerWaalsContact C-N 3.32Å; D112-L114 PolarHBondContact O-N 3.23Å; L114-V128 HydrophobicContact CB-CG1 3.7Å; L114-V131 HydrophobicContact CD1-CB 4.04Å; L114-V131 HydrophobicContact CD1-CG1 3.52Å; L114-N132 WeakPolarHBondContact CB-OD1 3.16Å; L114-N132 PolarHBondContact N-OD1 2.86Å; L114-N132 PolarHBondContact O-ND2 3.39Å
115	K	71.7	Confident	81.5	Confident	172 Å²	172	95.5 Å²	95.5	75%	0.748	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-93.5	133.5	172.7	-62.3	-174	-179.3	-175.5	0	109.2
116	V	70.4	Confident	81.3	Confident	66 Å²	66	101.2 Å²	101.2	40%	0.4	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-78.3	131.1	172	176.7	0	0	0	0	108.7	K125 V128	V116-K125 HydrophobicContact CG1-CB 4.17Å; V116-K125 HydrophobicContact CG1-CD 3.97Å; V116-K125 HydrophobicContact CG1-CG 3.58Å; V116-V128 HydrophobicContact CG2-CB 3.86Å; V116-V128 HydrophobicContact CG2-CG1 3.45Å; V116-V128 VanDerWaalsContact CG2-CG1 3.45Å
117	N	73.8	Confident	81.2	Confident	100 Å²	100	100.4 Å²	100.4	54%	0.535	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-85.7	141.2	166	-74.7	-24.3	0	0	0	109.3	T119 D120	N117-T119 PolarHBondContact O-N 3.45Å; N117-T119 VanDerWaalsContact O-N 3.1Å; N117-D120 PolarHBondContact N-OD2 3.26Å; N117-D120 VanDerWaalsContact N-OD2 3.13Å; N117-D120 WeakPolarHBondContact O-CB 3.5Å; N117-D120 PolarHBondContact O-N 3.4Å
118	E	71	Confident	81	Confident	190 Å²	190	99.3 Å²	99.3	89%	0.888	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.2	179.5	-65.8	-172.9	160.5	0	0	113	D120	E118-D120 VanDerWaalsContact C-N 3.32Å
119	T	78	Confident	80.8	Confident	126 Å²	126	100.6 Å²	100.6	77%	0.773	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.8	178.1	53.5	0	0	0	0	114.5	N117	N117-T119 PolarHBondContact O-N 3.45Å; N117-T119 VanDerWaalsContact O-N 3.1Å
120	D	78.1	Confident	80.8	Confident	38 Å²	38	101.9 Å²	101.9	20%	0.203	51%	0.511	C	S	.	.	S	Bend	trans	-74.5	145	-177.7	-65.4	-15.6	0	0	0	111	N117 E118 H124 K125	N117-D120 PolarHBondContact N-OD2 3.26Å; N117-D120 VanDerWaalsContact N-OD2 3.13Å; N117-D120 WeakPolarHBondContact O-CB 3.5Å; N117-D120 PolarHBondContact O-N 3.4Å; E118-D120 VanDerWaalsContact C-N 3.32Å; D120-H124 HydrophobicContact CB-CB 4.17Å; D120-H124 IonicContact OD2-CE1 2.86Å; D120-H124 IonicContact OD2-ND1 3.88Å; D120-K125 HydrophobicContact CB-CG 4.27Å; D120-K125 WeakPolarHBondContact O-CE 3.16Å
121	D	85.6	Confident	81	Confident	131 Å²	131	102.1 Å²	102.1	70%	0.701	52%	0.516	S	S	*	.			trans	-60.9	149.9	174.9	-67.1	-33.3	0	0	0	111.1	E123 H124 K125	D121-E123 PolarHBondContact O-N 2.99Å; D121-E123 VanDerWaalsContact O-N 3.11Å; D121-H124 WeakPolarHBondContact O-CA 3.41Å; D121-H124 WeakPolarHBondContact O-CB 3.42Å; D121-H124 PolarHBondContact O-N 2.88Å; D121-K125 PolarHBondContact O-N 3.43Å
122	E	85.8	Confident	81.3	Confident	137 Å²	137	97.7 Å²	97.7	64%	0.64	50%	0.495	S	S	*	.	H	α-helix	trans	-56.2	-32.7	-178.5	-70.8	-58.9	129.4	0	0	113.3	K125 K126	E122-K125 PolarHBondContact O-N 3Å; E122-K125 IonicContact OE1-NZ 2.59Å; E122-K125 PolarHBondContact OE1-NZ 3.43Å; E122-K126 WeakPolarHBondContact O-CB 3.36Å; E122-K126 PolarHBondContact O-N 3.1Å
123	E	86.6	Confident	81.9	Confident	170 Å²	170	100.5 Å²	100.5	79%	0.794	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-40.5	173.7	-64.9	-172.3	171.7	0	0	112.1	D121 K126 L127	D121-E123 PolarHBondContact O-N 2.99Å; D121-E123 VanDerWaalsContact O-N 3.11Å; E123-K126 PolarHBondContact O-N 2.8Å; E123-L127 WeakPolarHBondContact O-CB 3.1Å; E123-L127 PolarHBondContact O-N 3.27Å
124	H	84.6	Confident	82.8	Confident	97 Å²	97	99 Å²	99	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-68.5	-41.7	177	-166.9	-67.6	0	0	0	110.8	D120 D121 K126 L127 V128	D120-H124 HydrophobicContact CB-CB 4.17Å; D120-H124 IonicContact OD2-CE1 2.86Å; D120-H124 IonicContact OD2-ND1 3.88Å; D121-H124 WeakPolarHBondContact O-CA 3.41Å; D121-H124 WeakPolarHBondContact O-CB 3.42Å; D121-H124 PolarHBondContact O-N 2.88Å; H124-K126 VanDerWaalsContact C-N 3.35Å; H124-K126 PolarHBondContact O-N 2.88Å; H124-L127 PolarHBondContact O-N 2.86Å; H124-V128 WeakPolarHBondContact O-CG2 3.17Å; H124-V128 PolarHBondContact O-N 2.59Å
125	K	85.6	Confident	83.7	Confident	54 Å²	54	96.8 Å²	96.8	24%	0.235	49%	0.493	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174.6	-59.7	-169.1	-179.6	147.5	0	111.8	V116 D120 D121 E122 V128 A129	V116-K125 HydrophobicContact CG1-CB 4.17Å; V116-K125 HydrophobicContact CG1-CD 3.97Å; V116-K125 HydrophobicContact CG1-CG 3.58Å; D120-K125 HydrophobicContact CB-CG 4.27Å; D120-K125 WeakPolarHBondContact O-CE 3.16Å; D121-K125 PolarHBondContact O-N 3.43Å; E122-K125 PolarHBondContact O-N 3Å; E122-K125 IonicContact OE1-NZ 2.59Å; E122-K125 PolarHBondContact OE1-NZ 3.43Å; K125-V128 PolarHBondContact O-N 3.02Å; K125-A129 WeakPolarHBondContact O-CB 3.41Å; K125-A129 PolarHBondContact O-N 3.02Å
126	K	88.9	Confident	84.4	Confident	147 Å²	147	90.5 Å²	90.5	64%	0.639	47%	0.466	S	S	*	.	H	α-helix	trans	-63.6	-40.8	177.6	-174.1	178.8	178.7	-179.5	0	112	E122 E123 H124 A129 M130	E122-K126 WeakPolarHBondContact O-CB 3.36Å; E122-K126 PolarHBondContact O-N 3.1Å; E123-K126 PolarHBondContact O-N 2.8Å; H124-K126 VanDerWaalsContact C-N 3.35Å; H124-K126 PolarHBondContact O-N 2.88Å; K126-A129 PolarHBondContact O-N 2.84Å; K126-M130 HydrophobicContact CG-CE 4.34Å; K126-M130 WeakPolarHBondContact O-CG 3.47Å; K126-M130 PolarHBondContact O-N 3.24Å
127	L	88.2	Confident	85.3	Confident	98 Å²	98	90.5 Å²	90.5	51%	0.513	47%	0.469	S	S	.	.	H	α-helix	trans	-63.7	-46.4	176.9	-176.3	63	0	0	0	111.5	E123 H124 A129 M130 V131	E123-L127 WeakPolarHBondContact O-CB 3.1Å; E123-L127 PolarHBondContact O-N 3.27Å; H124-L127 PolarHBondContact O-N 2.86Å; L127-A129 VanDerWaalsContact C-N 3.33Å; L127-A129 PolarHBondContact O-N 2.9Å; L127-M130 HydrophobicContact CD1-CE 4.08Å; L127-M130 PolarHBondContact O-N 3.44Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.37Å
128	V	87	Confident	86.2	Confident	11 Å²	11	90.8 Å²	90.8	7%	0.067	47%	0.469	C	S	.	.	H	α-helix	trans	-59.7	-43.8	176.5	171.9	0	0	0	0	111.1	L114 V116 H124 K125 M130 V131 N132	L114-V128 HydrophobicContact CB-CG1 3.7Å; V116-V128 HydrophobicContact CG2-CB 3.86Å; V116-V128 HydrophobicContact CG2-CG1 3.45Å; V116-V128 VanDerWaalsContact CG2-CG1 3.45Å; H124-V128 WeakPolarHBondContact O-CG2 3.17Å; H124-V128 PolarHBondContact O-N 2.59Å; K125-V128 PolarHBondContact O-N 3.02Å; V128-M130 PolarHBondContact O-N 2.82Å; V128-V131 PolarHBondContact O-N 2.86Å; V128-N132 PolarHBondContact O-N 2.79Å
129	A	86.4	Confident	86.9	Confident	56 Å²	56	84.5 Å²	84.5	46%	0.463	45%	0.446	S	S	.	.	H	α-helix	trans	-59.5	-45.2	176.5	0	0	0	0	0	112.5	K125 K126 L127 V131 N132 E133	K125-A129 WeakPolarHBondContact O-CB 3.41Å; K125-A129 PolarHBondContact O-N 3.02Å; K126-A129 PolarHBondContact O-N 2.84Å; L127-A129 VanDerWaalsContact C-N 3.33Å; L127-A129 PolarHBondContact O-N 2.9Å; A129-V131 VanDerWaalsContact C-N 3.35Å; A129-V131 PolarHBondContact O-N 2.04Å; A129-N132 PolarHBondContact O-N 3.46Å; A129-E133 WeakPolarHBondContact O-CB 3.48Å; A129-E133 PolarHBondContact O-N 2.99Å
130	M	89.6	Confident	87.4	Confident	96 Å²	96	79.7 Å²	79.7	47%	0.473	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-37.1	176.6	-70.1	-175.4	-61	0	0	112.5	K126 L127 V128 L134	K126-M130 HydrophobicContact CG-CE 4.34Å; K126-M130 WeakPolarHBondContact O-CG 3.47Å; K126-M130 PolarHBondContact O-N 3.24Å; L127-M130 HydrophobicContact CD1-CE 4.08Å; L127-M130 PolarHBondContact O-N 3.44Å; V128-M130 PolarHBondContact O-N 2.82Å; M130-L134 WeakPolarHBondContact O-CB 2.99Å; M130-L134 PolarHBondContact O-N 3.31Å
131	V	90.1	Very high	88	Confident	64 Å²	64	82.5 Å²	82.5	39%	0.388	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176.7	174	0	0	0	0	110.9	L114 L127 V128 A129 L134 S135	L114-V131 HydrophobicContact CD1-CB 4.04Å; L114-V131 HydrophobicContact CD1-CG1 3.52Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.37Å; V128-V131 PolarHBondContact O-N 2.86Å; A129-V131 VanDerWaalsContact C-N 3.35Å; A129-V131 PolarHBondContact O-N 2.04Å; V131-L134 PolarHBondContact O-N 2.87Å; V131-S135 VanDerWaalsContact O-CB 3.27Å; V131-S135 WeakPolarHBondContact O-CB 3.1Å; V131-S135 PolarHBondContact O-N 3.16Å
132	N	87.8	Confident	88.3	Confident	7 Å²	7	82.2 Å²	82.2	4%	0.037	43%	0.433	C	S	.	.	H	α-helix	trans	-64.9	-45.5	175.1	-77.2	-12.8	0	0	0	111.7	D112 L114 V128 A129 L134 S135 H136	D112-N132 WeakPolarHBondContact CB-ND2 3.45Å; D112-N132 VanDerWaalsContact CG-ND2 3.32Å; D112-N132 PolarHBondContact OD2-ND2 3.01Å; L114-N132 WeakPolarHBondContact CB-OD1 3.16Å; L114-N132 PolarHBondContact N-OD1 2.86Å; L114-N132 PolarHBondContact O-ND2 3.39Å; V128-N132 PolarHBondContact O-N 2.79Å; A129-N132 PolarHBondContact O-N 3.46Å; N132-L134 VanDerWaalsContact C-N 3.32Å; N132-L134 PolarHBondContact O-N 2.88Å; N132-S135 WeakPolarHBondContact O-CB 3.33Å; N132-S135 PolarHBondContact O-N 3.15Å; N132-S135 VanDerWaalsContact O-N 3.16Å; N132-H136 PolarHBondContact O-CD2 2.9Å; N132-H136 PolarHBondContact O-N 2.83Å
133	E	88	Confident	88.4	Confident	135 Å²	135	80.1 Å²	80.1	63%	0.631	43%	0.426	S	S	*	.	H	α-helix	trans	-58.6	-43.9	176.9	-175.7	-179.5	177.5	0	0	111.9	A129 S137	A129-E133 WeakPolarHBondContact O-CB 3.48Å; A129-E133 PolarHBondContact O-N 2.99Å; E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 3.17Å; E133-S137 PolarHBondContact O-OG 2.9Å
134	L	91.4	Very high	88.4	Confident	107 Å²	107	77.1 Å²	77.1	56%	0.56	41%	0.411	S	S	*	.	H	α-helix	trans	-66.2	-41.8	175.6	-179.3	60	0	0	0	111.7	M130 V131 N132 S137 I138	M130-L134 WeakPolarHBondContact O-CB 2.99Å; M130-L134 PolarHBondContact O-N 3.31Å; V131-L134 PolarHBondContact O-N 2.87Å; N132-L134 VanDerWaalsContact C-N 3.32Å; N132-L134 PolarHBondContact O-N 2.88Å; L134-S137 PolarHBondContact O-N 2.9Å; L134-I138 HydrophobicContact CD1-CD1 3.98Å; L134-I138 HydrophobicContact CD1-CG1 4.19Å; L134-I138 HydrophobicContact CG-CD1 3.88Å; L134-I138 HydrophobicContact CG-CG1 4.48Å; L134-I138 VanDerWaalsContact O-CG1 3.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.48Å; L134-I138 PolarHBondContact O-N 3.36Å
135	S	89.1	Confident	88.8	Confident	31 Å²	31	79.1 Å²	79.1	22%	0.217	42%	0.423	C	S	.	.	H	α-helix	trans	-59.4	-46.6	176.8	-177.5	0	0	0	0	111.4	Q113 V131 N132 I138 S139	Q113-S135 VanDerWaalsContact CG-OG 3.31Å; Q113-S135 WeakPolarHBondContact CG-OG 3.43Å; V131-S135 VanDerWaalsContact O-CB 3.27Å; V131-S135 WeakPolarHBondContact O-CB 3.1Å; V131-S135 PolarHBondContact O-N 3.16Å; N132-S135 WeakPolarHBondContact O-CB 3.33Å; N132-S135 PolarHBondContact O-N 3.15Å; N132-S135 VanDerWaalsContact O-N 3.16Å; S135-I138 PolarHBondContact O-N 3.25Å; S135-S139 WeakPolarHBondContact O-CB 3.37Å; S135-S139 PolarHBondContact O-N 3.47Å; S135-S139 PolarHBondContact O-OG 3.5Å; S135-S139 VanDerWaalsContact O-OG 3.07Å
136	H	86.6	Confident	89	Confident	39 Å²	39	81.5 Å²	81.5	18%	0.181	44%	0.435	C	S	.	.	H	α-helix	trans	-63	-43.2	176	-72.4	-49.2	0	0	0	112.1	E111 D112 N132 I138 S139 G140	E111-H136 PolarHBondContact O-CE1 3Å; D112-H136 IonicContact OD1-CD2 3.62Å; D112-H136 IonicContact OD1-CE1 2.68Å; D112-H136 IonicContact OD1-NE2 3.57Å; D112-H136 PolarHBondContact OD1-NE2 2.76Å; N132-H136 PolarHBondContact O-CD2 2.9Å; N132-H136 PolarHBondContact O-N 2.83Å; H136-I138 VanDerWaalsContact C-N 3.34Å; H136-I138 PolarHBondContact O-N 3.37Å; H136-S139 PolarHBondContact O-N 2.85Å; H136-G140 PolarHBondContact O-N 2.78Å
137	S	89.4	Confident	88.9	Confident	67 Å²	67	80.3 Å²	80.3	47%	0.469	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-43.1	176.5	-61	0	0	0	0	112.1	E133 L134 V141	E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 3.17Å; E133-S137 PolarHBondContact O-OG 2.9Å; L134-S137 PolarHBondContact O-N 2.9Å; S137-V141 VanDerWaalsContact O-CG2 3.3Å; S137-V141 WeakPolarHBondContact O-CG2 3.22Å; S137-V141 PolarHBondContact O-N 2.99Å
138	I	91.7	Very high	88.9	Confident	105 Å²	105	79.2 Å²	79.2	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-67.5	-42.6	177	-69.3	169.2	0	0	0	111	L134 S135 H136 V141 K142	L134-I138 HydrophobicContact CD1-CD1 3.98Å; L134-I138 HydrophobicContact CD1-CG1 4.19Å; L134-I138 HydrophobicContact CG-CD1 3.88Å; L134-I138 HydrophobicContact CG-CG1 4.48Å; L134-I138 VanDerWaalsContact O-CG1 3.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.48Å; L134-I138 PolarHBondContact O-N 3.36Å; S135-I138 PolarHBondContact O-N 3.25Å; H136-I138 VanDerWaalsContact C-N 3.34Å; H136-I138 PolarHBondContact O-N 3.37Å; I138-V141 PolarHBondContact O-N 3.25Å; I138-K142 WeakPolarHBondContact O-CB 3.15Å; I138-K142 PolarHBondContact O-N 3.14Å
139	S	87.4	Confident	89.3	Confident	58 Å²	58	81.3 Å²	81.3	41%	0.406	44%	0.44	S	S	.	.	H	α-helix	trans	-61	-44.3	176.6	-69	0	0	0	0	111.8	S135 H136 K142 L143	S135-S139 WeakPolarHBondContact O-CB 3.37Å; S135-S139 PolarHBondContact O-N 3.47Å; S135-S139 PolarHBondContact O-OG 3.5Å; S135-S139 VanDerWaalsContact O-OG 3.07Å; H136-S139 PolarHBondContact O-N 2.85Å; S139-K142 PolarHBondContact O-N 3.49Å; S139-L143 PolarHBondContact O-N 2.88Å
140	G	86.6	Confident	89.3	Confident	25 Å²	25	82.9 Å²	82.9	26%	0.258	44%	0.443	S	S	.	.	H	α-helix	trans	-60.9	-46.5	175.1	0	0	0	0	0	112.3	H136 K142 L143 E144	H136-G140 PolarHBondContact O-N 2.78Å; G140-K142 VanDerWaalsContact C-N 3.33Å; G140-K142 PolarHBondContact O-N 2.73Å; G140-L143 PolarHBondContact O-N 3.15Å; G140-E144 WeakPolarHBondContact O-CG 3.08Å; G140-E144 PolarHBondContact O-N 3.14Å
141	V	92.3	Very high	89.3	Confident	97 Å²	97	84.5 Å²	84.5	59%	0.588	44%	0.444	S	S	*	.	H	α-helix	trans	-63.5	-38.5	176.2	171.6	0	0	0	0	111.9	S137 I138 E144 M145	S137-V141 VanDerWaalsContact O-CG2 3.3Å; S137-V141 WeakPolarHBondContact O-CG2 3.22Å; S137-V141 PolarHBondContact O-N 2.99Å; I138-V141 PolarHBondContact O-N 3.25Å; V141-E144 PolarHBondContact O-N 3.4Å; V141-M145 VanDerWaalsContact O-CB 3.29Å; V141-M145 WeakPolarHBondContact O-CB 3.12Å; V141-M145 PolarHBondContact O-N 3.18Å
142	K	91.1	Very high	89.4	Confident	125 Å²	125	85.3 Å²	85.3	54%	0.543	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.3	-176.8	-176.7	172.5	-170.6	0	111.2	I138 S139 G140 M145 E146	I138-K142 WeakPolarHBondContact O-CB 3.15Å; I138-K142 PolarHBondContact O-N 3.14Å; S139-K142 PolarHBondContact O-N 3.49Å; G140-K142 VanDerWaalsContact C-N 3.33Å; G140-K142 PolarHBondContact O-N 2.73Å; K142-M145 PolarHBondContact O-N 3.18Å; K142-E146 WeakPolarHBondContact CE-OE1 3.25Å; K142-E146 IonicContact NZ-OE1 2.72Å; K142-E146 WeakPolarHBondContact O-CG 3.28Å; K142-E146 PolarHBondContact O-N 2.62Å
143	L	87.1	Confident	89.6	Confident	94 Å²	94	90.5 Å²	90.5	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-47	176.7	-178	66.1	0	0	0	111.1	S139 G140 M145 E146 Y147	S139-L143 PolarHBondContact O-N 2.88Å; G140-L143 PolarHBondContact O-N 3.15Å; L143-M145 VanDerWaalsContact C-N 3.32Å; L143-M145 PolarHBondContact O-N 3.26Å; L143-E146 PolarHBondContact O-N 2.95Å; L143-Y147 WeakPolarHBondContact O-CB 3.48Å; L143-Y147 PolarHBondContact O-N 3.34Å
144	E	86.6	Confident	89.6	Confident	106 Å²	106	87.5 Å²	87.5	50%	0.495	46%	0.464	S	S	.	.	H	α-helix	trans	-61.4	-40.1	175.9	-71.4	-68.1	168.3	0	0	111.9	G140 V141 Y147 V148	G140-E144 WeakPolarHBondContact O-CG 3.08Å; G140-E144 PolarHBondContact O-N 3.14Å; V141-E144 PolarHBondContact O-N 3.4Å; E144-Y147 PolarHBondContact O-N 2.79Å; E144-V148 WeakPolarHBondContact O-CB 3.49Å; E144-V148 WeakPolarHBondContact O-CG2 3.34Å; E144-V148 PolarHBondContact O-N 2.84Å
145	M	93.3	Very high	89.5	Confident	139 Å²	139	87.4 Å²	87.4	69%	0.685	46%	0.46	S	S	*	.	H	α-helix	trans	-65.9	-43	176.6	-175	178.6	-179.5	0	0	112.1	V141 K142 L143 V148 S149	V141-M145 VanDerWaalsContact O-CB 3.29Å; V141-M145 WeakPolarHBondContact O-CB 3.12Å; V141-M145 PolarHBondContact O-N 3.18Å; K142-M145 PolarHBondContact O-N 3.18Å; L143-M145 VanDerWaalsContact C-N 3.32Å; L143-M145 PolarHBondContact O-N 3.26Å; M145-V148 PolarHBondContact O-N 2.87Å; M145-S149 VanDerWaalsContact O-CB 3.26Å; M145-S149 WeakPolarHBondContact O-CB 3.46Å; M145-S149 PolarHBondContact O-N 3.13Å
146	E	89.8	Confident	89.8	Confident	104 Å²	104	94 Å²	94	49%	0.486	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175	-76.2	178.8	-174	0	0	110.8	K142 L143 S149 V150	K142-E146 WeakPolarHBondContact CE-OE1 3.25Å; K142-E146 IonicContact NZ-OE1 2.72Å; K142-E146 WeakPolarHBondContact O-CG 3.28Å; K142-E146 PolarHBondContact O-N 2.62Å; L143-E146 PolarHBondContact O-N 2.95Å; E146-S149 WeakPolarHBondContact O-CB 3.31Å; E146-S149 PolarHBondContact O-N 3.01Å; E146-V150 WeakPolarHBondContact O-CG2 3.1Å; E146-V150 PolarHBondContact O-N 3.49Å
147	Y	87.5	Confident	89.9	Confident	123 Å²	123	98.6 Å²	98.6	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-56.7	-50.9	173.3	173.4	-99.2	0	0	0	111.8	L143 E144 S149 V150 R151	L143-Y147 WeakPolarHBondContact O-CB 3.48Å; L143-Y147 PolarHBondContact O-N 3.34Å; E144-Y147 PolarHBondContact O-N 2.79Å; Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.45Å; Y147-V150 PolarHBondContact O-N 2.76Å; Y147-R151 WeakPolarHBondContact O-CB 3.1Å; Y147-R151 PolarHBondContact O-N 2.86Å
148	V	88.9	Confident	90	Very high	74 Å²	74	99.7 Å²	99.7	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-36.9	179	170	0	0	0	0	111.5	E144 M145 T152	E144-V148 WeakPolarHBondContact O-CB 3.49Å; E144-V148 WeakPolarHBondContact O-CG2 3.34Å; E144-V148 PolarHBondContact O-N 2.84Å; M145-V148 PolarHBondContact O-N 2.87Å; V148-T152 VanDerWaalsContact O-CB 3.23Å; V148-T152 WeakPolarHBondContact O-CB 2.86Å; V148-T152 PolarHBondContact O-N 2.8Å; V148-T152 PolarHBondContact O-OG1 3.4Å
149	S	94.1	Very high	90	Very high	56 Å²	56	99.7 Å²	99.7	39%	0.392	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-52.6	177.5	-178.4	0	0	0	0	111.3	M145 E146 Y147 R151 T152 Q153	M145-S149 VanDerWaalsContact O-CB 3.26Å; M145-S149 WeakPolarHBondContact O-CB 3.46Å; M145-S149 PolarHBondContact O-N 3.13Å; E146-S149 WeakPolarHBondContact O-CB 3.31Å; E146-S149 PolarHBondContact O-N 3.01Å; Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.45Å; S149-R151 VanDerWaalsContact C-N 3.34Å; S149-R151 PolarHBondContact O-N 3.26Å; S149-T152 PolarHBondContact O-N 2.89Å; S149-Q153 WeakPolarHBondContact O-CG 3.23Å; S149-Q153 PolarHBondContact O-N 3.19Å
150	V	87.2	Confident	90.2	Very high	88 Å²	88	103 Å²	103	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-46.6	176.9	173.8	0	0	0	0	110.3	E146 Y147 T152 Q153 V154	E146-V150 WeakPolarHBondContact O-CG2 3.1Å; E146-V150 PolarHBondContact O-N 3.49Å; Y147-V150 PolarHBondContact O-N 2.76Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 3.22Å; V150-Q153 PolarHBondContact O-N 3.46Å; V150-V154 WeakPolarHBondContact O-CG2 3.33Å; V150-V154 PolarHBondContact O-N 3Å
151	R	89.9	Confident	90.3	Very high	131 Å²	131	106.4 Å²	106.4	49%	0.494	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-42.2	177.9	-169.3	-175.7	-152	178.5	14.6	112.1	Y147 S149 V154 H155	Y147-R151 WeakPolarHBondContact O-CB 3.1Å; Y147-R151 PolarHBondContact O-N 2.86Å; S149-R151 VanDerWaalsContact C-N 3.34Å; S149-R151 PolarHBondContact O-N 3.26Å; R151-V154 PolarHBondContact O-N 2.97Å; R151-H155 VanDerWaalsContact CG-CD2 3.5Å; R151-H155 WeakPolarHBondContact CG-CD2 3.28Å; R151-H155 WeakPolarHBondContact CG-NE2 3.26Å; R151-H155 WeakPolarHBondContact O-CB 3.32Å; R151-H155 PolarHBondContact O-CD2 2.83Å; R151-H155 PolarHBondContact O-N 2.74Å
152	T	91.5	Very high	90.2	Very high	80 Å²	80	104.2 Å²	104.2	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-41.1	178.9	-59.9	0	0	0	0	111.3	V148 S149 V150 H155 W156	V148-T152 VanDerWaalsContact O-CB 3.23Å; V148-T152 WeakPolarHBondContact O-CB 2.86Å; V148-T152 PolarHBondContact O-N 2.8Å; V148-T152 PolarHBondContact O-OG1 3.4Å; S149-T152 PolarHBondContact O-N 2.89Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 3.22Å; T152-H155 PolarHBondContact O-N 2.88Å; T152-W156 WeakPolarHBondContact O-CB 3.49Å; T152-W156 PolarHBondContact O-N 3.4Å
153	Q	91.5	Very high	90.2	Very high	117 Å²	117	102.8 Å²	102.8	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-48.2	175.4	-69.9	175.4	12.8	0	0	111.2	S149 V150 W156 E157	S149-Q153 WeakPolarHBondContact O-CG 3.23Å; S149-Q153 PolarHBondContact O-N 3.19Å; V150-Q153 PolarHBondContact O-N 3.46Å; Q153-W156 WeakPolarHBondContact O-CB 3.38Å; Q153-W156 PolarHBondContact O-N 3.48Å; Q153-E157 WeakPolarHBondContact O-CG 3.12Å; Q153-E157 PolarHBondContact O-N 3.49Å
154	V	88.8	Confident	90.5	Very high	71 Å²	71	105 Å²	105	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-47	176.9	173.3	0	0	0	0	111.3	V150 R151 W156 E157 I158	V150-V154 WeakPolarHBondContact O-CG2 3.33Å; V150-V154 PolarHBondContact O-N 3Å; R151-V154 PolarHBondContact O-N 2.97Å; V154-W156 VanDerWaalsContact C-N 3.28Å; V154-W156 PolarHBondContact O-N 2.94Å; V154-E157 PolarHBondContact O-N 2.93Å; V154-I158 HydrophobicContact CG1-CD1 3.83Å; V154-I158 WeakPolarHBondContact O-CG1 3.43Å; V154-I158 PolarHBondContact O-N 3.29Å
155	H	89.9	Confident	90.7	Very high	106 Å²	106	105.1 Å²	105.1	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-35.9	177.1	-76.4	-43.1	0	0	0	112.6	R151 T152 I158 N159	R151-H155 VanDerWaalsContact CG-CD2 3.5Å; R151-H155 WeakPolarHBondContact CG-CD2 3.28Å; R151-H155 WeakPolarHBondContact CG-NE2 3.26Å; R151-H155 WeakPolarHBondContact O-CB 3.32Å; R151-H155 PolarHBondContact O-CD2 2.83Å; R151-H155 PolarHBondContact O-N 2.74Å; T152-H155 PolarHBondContact O-N 2.88Å; H155-I158 PolarHBondContact O-N 3.43Å; H155-N159 VanDerWaalsContact O-CB 3.25Å; H155-N159 WeakPolarHBondContact O-CB 3.24Å; H155-N159 PolarHBondContact O-N 3.29Å
156	W	93.8	Very high	90.7	Very high	170 Å²	170	102.6 Å²	102.6	64%	0.644	50%	0.502	S	S	*	.	H	α-helix	trans	-63.6	-44.4	175.4	179.8	-95.4	0	0	0	111.8	T152 Q153 V154 N159 K160	T152-W156 WeakPolarHBondContact O-CB 3.49Å; T152-W156 PolarHBondContact O-N 3.4Å; Q153-W156 WeakPolarHBondContact O-CB 3.38Å; Q153-W156 PolarHBondContact O-N 3.48Å; V154-W156 VanDerWaalsContact C-N 3.28Å; V154-W156 PolarHBondContact O-N 2.94Å; W156-N159 PolarHBondContact O-N 3.48Å; W156-K160 VanDerWaalsContact NE1-CD 3.28Å; W156-K160 WeakPolarHBondContact O-CB 3.45Å; W156-K160 WeakPolarHBondContact O-CG 3.35Å; W156-K160 PolarHBondContact O-N 3.3Å
157	E	90.4	Very high	91	Very high	134 Å²	134	101.5 Å²	101.5	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-45.2	176.2	-71.4	-177.7	177.2	0	0	112.3	Q153 V154 N159 K160 N161	Q153-E157 WeakPolarHBondContact O-CG 3.12Å; Q153-E157 PolarHBondContact O-N 3.49Å; V154-E157 PolarHBondContact O-N 2.93Å; E157-N159 VanDerWaalsContact C-N 3.33Å; E157-N159 PolarHBondContact O-N 3.47Å; E157-K160 PolarHBondContact O-N 3.37Å; E157-N161 WeakPolarHBondContact O-CB 3.19Å; E157-N161 PolarHBondContact O-N 3.05Å
158	I	89.9	Confident	91.3	Very high	90 Å²	90	99.1 Å²	99.1	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-44.6	175.9	-67.1	168	0	0	0	110.4	V154 H155 N161 T162	V154-I158 HydrophobicContact CG1-CD1 3.83Å; V154-I158 WeakPolarHBondContact O-CG1 3.43Å; V154-I158 PolarHBondContact O-N 3.29Å; H155-I158 PolarHBondContact O-N 3.43Å; I158-N161 PolarHBondContact O-N 2.92Å; I158-T162 WeakPolarHBondContact O-CB 3.44Å; I158-T162 PolarHBondContact O-N 2.98Å; I158-T162 PolarHBondContact O-OG1 2.95Å
159	N	91.6	Very high	91.6	Very high	105 Å²	105	101.8 Å²	101.8	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-49.1	179.1	-169.7	-51.7	0	0	0	111.1	H155 W156 E157 N161 T162 N163	H155-N159 VanDerWaalsContact O-CB 3.25Å; H155-N159 WeakPolarHBondContact O-CB 3.24Å; H155-N159 PolarHBondContact O-N 3.29Å; W156-N159 PolarHBondContact O-N 3.48Å; E157-N159 VanDerWaalsContact C-N 3.33Å; E157-N159 PolarHBondContact O-N 3.47Å; N159-N161 PolarHBondContact O-N 3.43Å; N159-T162 PolarHBondContact O-N 3.08Å; N159-N163 VanDerWaalsContact O-CB 3.24Å; N159-N163 WeakPolarHBondContact O-CB 3.4Å; N159-N163 PolarHBondContact O-N 3.37Å
160	K	91.5	Very high	91.6	Very high	127 Å²	127	101.6 Å²	101.6	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-56	-48.9	176.6	-82.3	-178.2	53.4	178.4	0	112.4	W156 E157 T162 N163 F164	W156-K160 VanDerWaalsContact NE1-CD 3.28Å; W156-K160 WeakPolarHBondContact O-CB 3.45Å; W156-K160 WeakPolarHBondContact O-CG 3.35Å; W156-K160 PolarHBondContact O-N 3.3Å; E157-K160 PolarHBondContact O-N 3.37Å; K160-T162 VanDerWaalsContact C-N 3.34Å; K160-N163 PolarHBondContact O-N 2.91Å; K160-F164 WeakPolarHBondContact O-CB 3.39Å; K160-F164 PolarHBondContact O-N 3.45Å
161	N	88.7	Confident	92	Very high	97 Å²	97	100.3 Å²	100.3	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-42.4	179.8	-173.8	40.1	0	0	0	111.4	E157 I158 N159 R165	E157-N161 WeakPolarHBondContact O-CB 3.19Å; E157-N161 PolarHBondContact O-N 3.05Å; I158-N161 PolarHBondContact O-N 2.92Å; N159-N161 PolarHBondContact O-N 3.43Å; N161-R165 WeakPolarHBondContact O-CB 3.28Å; N161-R165 PolarHBondContact O-N 2.92Å
162	T	90	Very high	92.3	Very high	51 Å²	51	99.1 Å²	99.1	31%	0.313	50%	0.501	S	S	.	.	H	α-helix	trans	-65.5	-46.7	178.5	-60.9	0	0	0	0	111.3	I158 N159 K160 R165 V166	I158-T162 WeakPolarHBondContact O-CB 3.44Å; I158-T162 PolarHBondContact O-N 2.98Å; I158-T162 PolarHBondContact O-OG1 2.95Å; N159-T162 PolarHBondContact O-N 3.08Å; K160-T162 VanDerWaalsContact C-N 3.34Å; T162-R165 PolarHBondContact O-N 3.41Å; T162-V166 HydrophobicContact CG2-CG2 4.32Å; T162-V166 WeakPolarHBondContact O-CB 3.23Å; T162-V166 VanDerWaalsContact O-CG2 3.23Å; T162-V166 WeakPolarHBondContact O-CG2 3.45Å; T162-V166 PolarHBondContact O-N 3.01Å
163	N	92.3	Very high	92.5	Very high	96 Å²	96	101.1 Å²	101.1	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-59.4	-49.5	178.1	179.4	-94.8	0	0	0	111.3	N159 K160 R165 V166 V167	N159-N163 VanDerWaalsContact O-CB 3.24Å; N159-N163 WeakPolarHBondContact O-CB 3.4Å; N159-N163 PolarHBondContact O-N 3.37Å; K160-N163 PolarHBondContact O-N 2.91Å; N163-R165 PolarHBondContact O-N 3.37Å; N163-V166 PolarHBondContact O-N 3.49Å; N163-V167 VanDerWaalsContact O-CG2 3.28Å; N163-V167 WeakPolarHBondContact O-CG2 3.38Å; N163-V167 PolarHBondContact O-N 3.42Å
164	F	92.5	Very high	92.8	Very high	141 Å²	141	97.8 Å²	97.8	62%	0.618	50%	0.497	S	S	*	.	H	α-helix	trans	-59	-47.2	178.1	178.3	-103.2	0	0	0	111.9	K160 V166 V167 V168	K160-F164 WeakPolarHBondContact O-CB 3.39Å; K160-F164 PolarHBondContact O-N 3.45Å; F164-V166 PolarHBondContact O-N 3.04Å; F164-V167 PolarHBondContact O-N 3.05Å; F164-V168 HydrophobicContact CD1-CG2 4.37Å; F164-V168 HydrophobicContact CD2-CG2 4.42Å; F164-V168 HydrophobicContact CE1-CG2 3.93Å; F164-V168 HydrophobicContact CE2-CG2 4Å; F164-V168 HydrophobicContact CZ-CG2 3.73Å; F164-V168 WeakPolarHBondContact O-CG2 3.42Å; F164-V168 PolarHBondContact O-N 3.42Å
165	R	91.5	Very high	93.2	Very high	107 Å²	107	100.7 Å²	100.7	40%	0.404	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-46.1	178	-177.8	175.3	65.3	-133.2	-4.4	111.8	N161 T162 N163 V167 V168 W169	N161-R165 WeakPolarHBondContact O-CB 3.28Å; N161-R165 PolarHBondContact O-N 2.92Å; T162-R165 PolarHBondContact O-N 3.41Å; N163-R165 PolarHBondContact O-N 3.37Å; R165-V167 VanDerWaalsContact C-N 3.34Å; R165-V167 PolarHBondContact O-N 3.36Å; R165-V168 PolarHBondContact O-N 3.5Å; R165-W169 PolarHBondContact O-N 3.16Å
166	V	94.2	Very high	93.5	Very high	87 Å²	87	99.1 Å²	99.1	53%	0.527	50%	0.499	S	S	.	.	H	α-helix	trans	-61.2	-43.2	178.3	170	0	0	0	0	111	T162 N163 F164 W169 A170	T162-V166 HydrophobicContact CG2-CG2 4.32Å; T162-V166 WeakPolarHBondContact O-CB 3.23Å; T162-V166 VanDerWaalsContact O-CG2 3.23Å; T162-V166 WeakPolarHBondContact O-CG2 3.45Å; T162-V166 PolarHBondContact O-N 3.01Å; N163-V166 PolarHBondContact O-N 3.49Å; F164-V166 PolarHBondContact O-N 3.04Å; V166-W169 PolarHBondContact O-N 3.38Å; V166-A170 WeakPolarHBondContact O-CB 3.39Å; V166-A170 PolarHBondContact O-N 3.48Å
167	V	94.9	Very high	93.7	Very high	81 Å²	81	95.4 Å²	95.4	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-44.1	178.4	170.6	0	0	0	0	111.7	N163 F164 R165 W169 A170 A171	N163-V167 VanDerWaalsContact O-CG2 3.28Å; N163-V167 WeakPolarHBondContact O-CG2 3.38Å; N163-V167 PolarHBondContact O-N 3.42Å; F164-V167 PolarHBondContact O-N 3.05Å; R165-V167 VanDerWaalsContact C-N 3.34Å; R165-V167 PolarHBondContact O-N 3.36Å; V167-W169 PolarHBondContact O-N 3.49Å; V167-A170 PolarHBondContact O-N 3.16Å; V167-A171 WeakPolarHBondContact O-CB 3.48Å; V167-A171 PolarHBondContact O-N 3.03Å
168	V	94.3	Very high	94	Very high	72 Å²	72	93.7 Å²	93.7	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-43.2	177	171.6	0	0	0	0	111.3	F164 R165 A171 F172	F164-V168 HydrophobicContact CD1-CG2 4.37Å; F164-V168 HydrophobicContact CD2-CG2 4.42Å; F164-V168 HydrophobicContact CE1-CG2 3.93Å; F164-V168 HydrophobicContact CE2-CG2 4Å; F164-V168 HydrophobicContact CZ-CG2 3.73Å; F164-V168 WeakPolarHBondContact O-CG2 3.42Å; F164-V168 PolarHBondContact O-N 3.42Å; R165-V168 PolarHBondContact O-N 3.5Å; V168-A171 PolarHBondContact O-N 3.43Å; V168-F172 WeakPolarHBondContact O-CB 3.37Å; V168-F172 PolarHBondContact O-N 3Å
169	W	93.9	Very high	94.3	Very high	131 Å²	131	91.7 Å²	91.7	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-43.6	176.3	-82.3	113	0	0	0	112.8	F8 R165 V166 V167 A171 F172 E173	F8-W169 AromaticContact CE2-CZ2 3.71Å; F8-W169 HydrophobicContact CE2-CZ2 3.71Å; F8-W169 HydrophobicContact CZ-CZ2 4.03Å; F8-W169 AromaticContact CZ-NE1 4Å; R165-W169 PolarHBondContact O-N 3.16Å; V166-W169 PolarHBondContact O-N 3.38Å; V167-W169 PolarHBondContact O-N 3.49Å; W169-A171 VanDerWaalsContact C-N 3.35Å; W169-A171 PolarHBondContact O-N 3.37Å; W169-F172 HydrophobicContact CE3-CD1 4.21Å; W169-F172 HydrophobicContact CZ3-CD1 4.1Å; W169-F172 HydrophobicContact CZ3-CE1 4.4Å; W169-F172 PolarHBondContact O-N 2.92Å; W169-E173 WeakPolarHBondContact O-CB 3.42Å; W169-E173 PolarHBondContact O-N 3.3Å
170	A	95.3	Very high	94.6	Very high	51 Å²	51	92.1 Å²	92.1	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.9	0	0	0	0	0	112.2	V166 V167 E173 A174	V166-A170 WeakPolarHBondContact O-CB 3.39Å; V166-A170 PolarHBondContact O-N 3.48Å; V167-A170 PolarHBondContact O-N 3.16Å; A170-E173 PolarHBondContact O-N 3.32Å; A170-A174 WeakPolarHBondContact O-CB 3.38Å; A170-A174 PolarHBondContact O-N 3.05Å
171	A	96.3	Very high	94.8	Very high	62 Å²	62	88.5 Å²	88.5	51%	0.512	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-41.2	175.5	0	0	0	0	0	112	V167 V168 W169 A174 F175	V167-A171 WeakPolarHBondContact O-CB 3.48Å; V167-A171 PolarHBondContact O-N 3.03Å; V168-A171 PolarHBondContact O-N 3.43Å; W169-A171 VanDerWaalsContact C-N 3.35Å; W169-A171 PolarHBondContact O-N 3.37Å; A171-A174 PolarHBondContact O-N 3.34Å; A171-F175 PolarHBondContact O-N 3.45Å
172	F	95.8	Very high	95.1	Very high	105 Å²	105	89 Å²	89	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-43.5	175	179.5	-106.6	0	0	0	112	V168 W169 F175 L176	V168-F172 WeakPolarHBondContact O-CB 3.37Å; V168-F172 PolarHBondContact O-N 3Å; W169-F172 HydrophobicContact CE3-CD1 4.21Å; W169-F172 HydrophobicContact CZ3-CD1 4.1Å; W169-F172 HydrophobicContact CZ3-CE1 4.4Å; W169-F172 PolarHBondContact O-N 2.92Å; F172-F175 PolarHBondContact O-N 3.2Å; F172-L176 HydrophobicContact CD1-CD1 4.02Å; F172-L176 HydrophobicContact CE1-CD1 3.45Å; F172-L176 VanDerWaalsContact CE1-CD1 3.45Å; F172-L176 HydrophobicContact CE1-CG 4.16Å; F172-L176 HydrophobicContact CE2-CG 4.46Å; F172-L176 HydrophobicContact CZ-CD1 3.76Å; F172-L176 HydrophobicContact CZ-CD2 4.26Å; F172-L176 HydrophobicContact CZ-CG 4.12Å; F172-L176 WeakPolarHBondContact O-CG 3.3Å; F172-L176 PolarHBondContact O-N 3.02Å
173	E	95.8	Very high	95.4	Very high	122 Å²	122	88.5 Å²	88.5	57%	0.57	48%	0.479	S	S	*	.	H	α-helix	trans	-60.6	-47.5	175.7	-174.8	-177.8	175.8	0	0	111.8	W169 A170 F175 L176 I177	W169-E173 WeakPolarHBondContact O-CB 3.42Å; W169-E173 PolarHBondContact O-N 3.3Å; A170-E173 PolarHBondContact O-N 3.32Å; E173-F175 VanDerWaalsContact C-N 3.3Å; E173-F175 PolarHBondContact O-N 2.73Å; E173-L176 PolarHBondContact O-N 3.45Å; E173-L176 VanDerWaalsContact O-N 3.16Å; E173-I177 HydrophobicContact CG-CD1 4.17Å; E173-I177 WeakPolarHBondContact O-CG1 3.49Å; E173-I177 PolarHBondContact O-N 3.49Å
174	A	96.7	Very high	95.5	Very high	47 Å²	47	90.2 Å²	90.2	39%	0.388	48%	0.484	S	S	.	.	H	α-helix	trans	-58.7	-42.8	177.2	0	0	0	0	0	111.8	A170 A171 L176 I177 I178	A170-A174 WeakPolarHBondContact O-CB 3.38Å; A170-A174 PolarHBondContact O-N 3.05Å; A171-A174 PolarHBondContact O-N 3.34Å; A174-L176 PolarHBondContact O-N 3.38Å; A174-I177 PolarHBondContact O-N 2.93Å; A174-I178 VanDerWaalsContact O-CG1 3.3Å; A174-I178 WeakPolarHBondContact O-CG1 3.38Å; A174-I178 PolarHBondContact O-N 3.34Å
175	F	97.4	Very high	95.5	Very high	133 Å²	133	87.2 Å²	87.2	58%	0.583	48%	0.477	S	S	*	.	H	α-helix	trans	-60.1	-44.6	175.4	173.9	-96.7	0	0	0	112.3	A171 F172 E173 I178 A179	A171-F175 PolarHBondContact O-N 3.45Å; F172-F175 PolarHBondContact O-N 3.2Å; E173-F175 VanDerWaalsContact C-N 3.3Å; E173-F175 PolarHBondContact O-N 2.73Å; F175-I178 PolarHBondContact O-N 3.34Å; F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3.27Å
176	L	97	Very high	95.6	Very high	73 Å²	73	88.6 Å²	88.6	38%	0.382	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-41.8	177.6	-71.2	-179.2	0	0	0	112.3	F172 E173 A174 I178 A179 M180	F172-L176 HydrophobicContact CD1-CD1 4.02Å; F172-L176 HydrophobicContact CE1-CD1 3.45Å; F172-L176 VanDerWaalsContact CE1-CD1 3.45Å; F172-L176 HydrophobicContact CE1-CG 4.16Å; F172-L176 HydrophobicContact CE2-CG 4.46Å; F172-L176 HydrophobicContact CZ-CD1 3.76Å; F172-L176 HydrophobicContact CZ-CD2 4.26Å; F172-L176 HydrophobicContact CZ-CG 4.12Å; F172-L176 WeakPolarHBondContact O-CG 3.3Å; F172-L176 PolarHBondContact O-N 3.02Å; E173-L176 PolarHBondContact O-N 3.45Å; E173-L176 VanDerWaalsContact O-N 3.16Å; A174-L176 PolarHBondContact O-N 3.38Å; L176-I178 VanDerWaalsContact C-N 3.35Å; L176-I178 PolarHBondContact O-N 2.93Å; L176-A179 PolarHBondContact O-N 3Å; L176-M180 WeakPolarHBondContact O-CB 3.35Å; L176-M180 VanDerWaalsContact O-CG 3.3Å; L176-M180 WeakPolarHBondContact O-CG 3.3Å; L176-M180 PolarHBondContact O-N 3.11Å
177	I	96.9	Very high	95.5	Very high	91 Å²	91	92.2 Å²	92.2	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-45.9	176.7	-67.6	169.5	0	0	0	110.5	E173 A174 M180 S181	E173-I177 HydrophobicContact CG-CD1 4.17Å; E173-I177 WeakPolarHBondContact O-CG1 3.49Å; E173-I177 PolarHBondContact O-N 3.49Å; A174-I177 PolarHBondContact O-N 2.93Å; I177-M180 HydrophobicContact CG1-CE 4.34Å; I177-M180 PolarHBondContact O-N 3.01Å; I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.41Å; I177-S181 PolarHBondContact O-OG 3.37Å
178	I	97.3	Very high	95.3	Very high	99 Å²	99	92.8 Å²	92.8	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-48.9	177.3	-67	165.8	0	0	0	110.2	A174 F175 L176 M180 S181 I182	A174-I178 VanDerWaalsContact O-CG1 3.3Å; A174-I178 WeakPolarHBondContact O-CG1 3.38Å; A174-I178 PolarHBondContact O-N 3.34Å; F175-I178 PolarHBondContact O-N 3.34Å; L176-I178 VanDerWaalsContact C-N 3.35Å; L176-I178 PolarHBondContact O-N 2.93Å; I178-M180 PolarHBondContact O-N 2.88Å; I178-S181 PolarHBondContact O-N 3.22Å; I178-S181 PolarHBondContact O-OG 3.42Å; I178-I182 HydrophobicContact CG2-CD1 3.86Å; I178-I182 WeakPolarHBondContact O-CG1 3.45Å; I178-I182 PolarHBondContact O-N 3.49Å
179	A	96.7	Very high	95.1	Very high	47 Å²	47	96.3 Å²	96.3	39%	0.388	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-43.2	178.9	0	0	0	0	0	112.6	F175 L176 I182 G183	F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3.27Å; L176-A179 PolarHBondContact O-N 3Å; A179-I182 PolarHBondContact O-N 2.96Å; A179-G183 PolarHBondContact O-N 3.46Å
180	M	96.6	Very high	94.8	Very high	114 Å²	114	97.7 Å²	97.7	56%	0.562	51%	0.506	S	S	*	.	H	α-helix	trans	-63.1	-43.3	175.9	-73.9	-170.7	-63.4	0	0	112	L176 I177 I178 G183 Q184	L176-M180 WeakPolarHBondContact O-CB 3.35Å; L176-M180 VanDerWaalsContact O-CG 3.3Å; L176-M180 WeakPolarHBondContact O-CG 3.3Å; L176-M180 PolarHBondContact O-N 3.11Å; I177-M180 HydrophobicContact CG1-CE 4.34Å; I177-M180 PolarHBondContact O-N 3.01Å; I178-M180 PolarHBondContact O-N 2.88Å; M180-G183 PolarHBondContact O-N 3.32Å; M180-Q184 WeakPolarHBondContact O-CG 3.36Å; M180-Q184 PolarHBondContact O-N 3.5Å
181	S	96	Very high	94.4	Very high	52 Å²	52	100.2 Å²	100.2	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-42	178.8	73.1	0	0	0	0	112.2	I177 I178 G183 Q184 V185	I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.41Å; I177-S181 PolarHBondContact O-OG 3.37Å; I178-S181 PolarHBondContact O-N 3.22Å; I178-S181 PolarHBondContact O-OG 3.42Å; S181-G183 VanDerWaalsContact C-N 3.34Å; S181-G183 PolarHBondContact O-N 2.87Å; S181-Q184 PolarHBondContact O-N 3.24Å; S181-V185 WeakPolarHBondContact O-CG2 3.4Å; S181-V185 PolarHBondContact O-N 3.35Å
182	I	96	Very high	93.8	Very high	108 Å²	108	104.4 Å²	104.4	55%	0.554	51%	0.514	S	S	*	.	H	α-helix	trans	-63.1	-43.5	174.5	-66.2	169.2	0	0	0	110.1	I178 A179 Q184 V185 F186	I178-I182 HydrophobicContact CG2-CD1 3.86Å; I178-I182 WeakPolarHBondContact O-CG1 3.45Å; I178-I182 PolarHBondContact O-N 3.49Å; A179-I182 PolarHBondContact O-N 2.96Å; I182-Q184 PolarHBondContact O-N 2.96Å; I182-V185 PolarHBondContact O-N 3.39Å; I182-F186 WeakPolarHBondContact O-CB 3.43Å; I182-F186 PolarHBondContact O-N 2.9Å
183	G	95.1	Very high	93.1	Very high	40 Å²	40	105.6 Å²	105.6	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-58.7	-44.5	175.6	0	0	0	0	0	112.8	A179 M180 S181 F186 Y187	A179-G183 PolarHBondContact O-N 3.46Å; M180-G183 PolarHBondContact O-N 3.32Å; S181-G183 VanDerWaalsContact C-N 3.34Å; S181-G183 PolarHBondContact O-N 2.87Å; G183-F186 PolarHBondContact O-N 3.39Å; G183-Y187 WeakPolarHBondContact O-CB 3.48Å; G183-Y187 PolarHBondContact O-N 2.89Å
184	Q	94.7	Very high	91.8	Very high	131 Å²	131	104.7 Å²	104.7	61%	0.612	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-44.9	175.5	-73.3	174.7	-6.5	0	0	111.8	M180 S181 I182 Y187 L188	M180-Q184 WeakPolarHBondContact O-CG 3.36Å; M180-Q184 PolarHBondContact O-N 3.5Å; S181-Q184 PolarHBondContact O-N 3.24Å; I182-Q184 PolarHBondContact O-N 2.96Å; Q184-Y187 PolarHBondContact O-N 3.44Å; Q184-L188 WeakPolarHBondContact O-CG 3.34Å; Q184-L188 PolarHBondContact O-N 3.29Å
185	V	94	Very high	90.2	Very high	78 Å²	78	111.9 Å²	111.9	47%	0.473	54%	0.541	S	S	.	.	H	α-helix	trans	-63.4	-43.7	177.4	173.2	0	0	0	0	111.2	S181 I182 L188 K189	S181-V185 WeakPolarHBondContact O-CG2 3.4Å; S181-V185 PolarHBondContact O-N 3.35Å; I182-V185 PolarHBondContact O-N 3.39Å; V185-L188 PolarHBondContact O-N 2.97Å; V185-K189 HydrophobicContact CG1-CD 4.36Å; V185-K189 WeakPolarHBondContact O-CG 3.35Å; V185-K189 PolarHBondContact O-N 3.48Å
186	F	93.3	Very high	88.3	Confident	136 Å²	136	115.6 Å²	115.6	60%	0.596	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-42.9	177.4	-177.3	-98.7	0	0	0	111.9	I182 G183 K189 R190	I182-F186 WeakPolarHBondContact O-CB 3.43Å; I182-F186 PolarHBondContact O-N 2.9Å; G183-F186 PolarHBondContact O-N 3.39Å; F186-K189 PolarHBondContact O-N 3.47Å; F186-R190 WeakPolarHBondContact O-CB 3.17Å; F186-R190 PolarHBondContact O-N 2.89Å
187	Y	90.8	Very high	86.4	Confident	163 Å²	163	119.7 Å²	119.7	64%	0.639	57%	0.573	S	S	*	*	H	α-helix	trans	-59.4	-47.5	175.9	179.9	-94.6	0	0	0	111.7	G183 Q184 R190 F191	G183-Y187 WeakPolarHBondContact O-CB 3.48Å; G183-Y187 PolarHBondContact O-N 2.89Å; Q184-Y187 PolarHBondContact O-N 3.44Å; Y187-R190 PolarHBondContact O-N 3.34Å; Y187-F191 WeakPolarHBondContact O-CB 3.39Å; Y187-F191 PolarHBondContact O-N 2.92Å
188	L	90.8	Very high	84.3	Confident	94 Å²	94	125.8 Å²	125.8	49%	0.492	61%	0.614	S	S	.	*	H	α-helix	trans	-63	-43.5	177.4	-72.2	173.5	0	0	0	112	Q184 V185 R190 F191 F192	Q184-L188 WeakPolarHBondContact O-CG 3.34Å; Q184-L188 PolarHBondContact O-N 3.29Å; V185-L188 PolarHBondContact O-N 2.97Å; L188-R190 PolarHBondContact O-N 3.36Å; L188-F191 PolarHBondContact O-N 3.15Å; L188-F192 WeakPolarHBondContact O-CD2 3.47Å; L188-F192 PolarHBondContact O-N 3.27Å; L188-F192 VanDerWaalsContact O-N 3.15Å
189	K	90.2	Very high	83.7	Confident	146 Å²	146	127.2 Å²	127.2	64%	0.635	62%	0.619	S	S	*	*	H	α-helix	trans	-59.6	-46	175.6	-77	-175.5	177.5	-175.2	0	111.7	V185 F186 F191 F192 E193	V185-K189 HydrophobicContact CG1-CD 4.36Å; V185-K189 WeakPolarHBondContact O-CG 3.35Å; V185-K189 PolarHBondContact O-N 3.48Å; F186-K189 PolarHBondContact O-N 3.47Å; K189-F191 VanDerWaalsContact C-N 3.34Å; K189-F191 PolarHBondContact O-N 3.04Å; K189-F192 PolarHBondContact O-N 3.5Å; K189-E193 PolarHBondContact O-N 3.47Å
190	R	88.4	Confident	83	Confident	160 Å²	160	131.4 Å²	131.4	60%	0.604	63%	0.631	S	S	*	*	H	α-helix	trans	-63.9	-38.2	177.5	-174.6	175.4	176.4	174.7	-0.3	112	F186 Y187 L188 F192 E193 V194	F186-R190 WeakPolarHBondContact O-CB 3.17Å; F186-R190 PolarHBondContact O-N 2.89Å; Y187-R190 PolarHBondContact O-N 3.34Å; L188-R190 PolarHBondContact O-N 3.36Å; R190-F192 VanDerWaalsContact C-N 3.35Å; R190-F192 PolarHBondContact O-N 3.48Å; R190-E193 PolarHBondContact O-N 3.29Å; R190-V194 HydrophobicContact CG-CG2 4.47Å; R190-V194 WeakPolarHBondContact O-CG2 3.33Å; R190-V194 PolarHBondContact O-N 3.37Å
191	F	86	Confident	82.2	Confident	104 Å²	104	132.3 Å²	132.3	46%	0.456	64%	0.635	S	S	.	*	H	α-helix	trans	-60.5	-42.7	176	179.6	-96.5	0	0	0	112.3	Y187 L188 K189	Y187-F191 WeakPolarHBondContact O-CB 3.39Å; Y187-F191 PolarHBondContact O-N 2.92Å; L188-F191 PolarHBondContact O-N 3.15Å; K189-F191 VanDerWaalsContact C-N 3.34Å; K189-F191 PolarHBondContact O-N 3.04Å
192	F	85.1	Confident	81.4	Confident	150 Å²	150	137.1 Å²	137.1	66%	0.658	65%	0.651	S	S	*	*	H	α-helix	trans	-73	-33	177.3	-72.7	-63.1	0	0	0	113.4	L188 K189 R190 R195	L188-F192 WeakPolarHBondContact O-CD2 3.47Å; L188-F192 PolarHBondContact O-N 3.27Å; L188-F192 VanDerWaalsContact O-N 3.15Å; K189-F192 PolarHBondContact O-N 3.5Å; R190-F192 VanDerWaalsContact C-N 3.35Å; R190-F192 PolarHBondContact O-N 3.48Å; F192-R195 PolarHBondContact O-N 3.31Å
193	E	81	Confident	80.5	Confident	129 Å²	129	138.9 Å²	138.9	60%	0.603	66%	0.657	S	S	*	*	H	α-helix	trans	-66.9	-37.2	-179.4	-171.7	171.1	-165.3	0	0	112.9	K189 R190 R195	K189-E193 PolarHBondContact O-N 3.47Å; R190-E193 PolarHBondContact O-N 3.29Å; E193-R195 PolarHBondContact O-N 3.23Å
194	V	67.5	Low	79.5	Confident	104 Å²	104	145.5 Å²	145.5	63%	0.63	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-5.7	-175.7	-179.5	0	0	0	0	113.1	R190	R190-V194 HydrophobicContact CG-CG2 4.47Å; R190-V194 WeakPolarHBondContact O-CG2 3.33Å; R190-V194 PolarHBondContact O-N 3.37Å
195	R	62.8	Low	78.5	Confident	198 Å²	198	146.5 Å²	146.5	75%	0.747	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	17.9	178.7	-82.1	-168.5	173.1	-137.7	0.3	115.9	F192 E193 L197	F192-R195 PolarHBondContact O-N 3.31Å; E193-R195 PolarHBondContact O-N 3.23Å; R195-L197 PolarHBondContact O-N 3.07Å; R195-L197 VanDerWaalsContact O-N 3.07Å
196	R	59.2	Low	77.3	Confident	211 Å²	211	151.8 Å²	151.8	80%	0.796	69%	0.694	S	S	*	*			trans	-82.7	65	161.3	-65.2	-166.2	-78.8	-159.7	-3	110.6
197	L	55.8	Low	75.9	Confident	159 Å²	159	153.1 Å²	153.1	83%	0.832	70%	0.702	S	S	*	*			trans	-105.6	107.1	154.6	-68.5	174	0	0	0	105.3	R195	R195-L197 PolarHBondContact O-N 3.07Å; R195-L197 VanDerWaalsContact O-N 3.07Å
198	V	53.6	Low	74.6	Confident	219 Å²	219	152.2 Å²	152.2	100%	1.327	71%	0.707	S	S	*	*			trans	-51.9	0	163.8	168.9	0	0	0	0	109.3

Retrieved 198 of 198 residues in 453.4 ms (Link to these results)

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