A0A087YLE0_POEFO Loading...

Prefoldin subunit 1

Binds specifically to cytosolic chaperonin (c-CPN) and transfers target proteins to it. Binds to nascent polypeptide chain and promotes folding in an environment in which there are many competing pathways for nonnative proteins.

AlphaFold DB , UniProt , Accession A0A087YLE0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 137 aa.

						>A0A087YLE0_POEFO|A0A087YLE0
MSSTPLLAEKKKRRMMAAPVDLELKKAFSELQVKMIDTQQKVKLADLQIEQLGRVQKHTKLTQAEISTLPANTRLYEGVGRMFVLQSKEEIDDLLTDKQKTVDDKIKELEQKKVYLERSVKEAEDNIREMLLSRRAH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	49	Very low	56.6	Low	241 Å²	241	133 Å²	133	100%	1.187	73%	0.732	S	S	*	*				0	111.8	0	-68.6	-161	175.1	0	0	108.1
2	S	50	Low	56.7	Low	113 Å²	113	133.9 Å²	133.9	79%	0.79	72%	0.723	S	S	*	*			trans	169.3	35.6	159.3	54.1	0	0	0	0	115.5
3	S	53.7	Low	57	Low	122 Å²	122	136.7 Å²	136.7	85%	0.853	72%	0.717	S	S	*	*			trans	-116.1	29.5	-178.2	44.9	0	0	0	0	115.2
4	T	60.6	Low	57.2	Low	118 Å²	118	141.1 Å²	141.1	72%	0.724	72%	0.719	S	S	*	*			trans	-110	-10.4	-179	37.6	0	0	0	0	118.9
5	P	57.1	Low	57.2	Low	84 Å²	84	140.9 Å²	140.9	55%	0.545	72%	0.716	S	S	.	*	H	α-helix	trans	-73.3	-40.8	-177.9	-16.2	28.9	0	0	0	114.7	L7 A8 E9	P5-L7 PolarHBondContact O-N 3.05Å; P5-A8 PolarHBondContact O-N 3.13Å; P5-E9 PolarHBondContact O-N 2.85Å
6	L	57.1	Low	57.4	Low	142 Å²	142	140 Å²	140	74%	0.743	71%	0.711	S	S	*	*	H	α-helix	trans	-66	-33.4	-169.3	-99.8	123.9	0	0	0	114.5	K10	L6-K10 WeakPolarHBondContact O-CB 3.42Å; L6-K10 PolarHBondContact O-N 3.5Å; L6-K10 VanDerWaalsContact O-N 3.14Å
7	L	56.6	Low	57.6	Low	145 Å²	145	134 Å²	134	76%	0.759	69%	0.687	S	S	*	*	H	α-helix	trans	-75.5	-35.2	-178.4	-132.4	76.9	0	0	0	111.9	P5 K11	P5-L7 PolarHBondContact O-N 3.05Å; L7-K11 WeakPolarHBondContact O-CB 3.48Å; L7-K11 PolarHBondContact O-N 3.12Å; L7-K11 VanDerWaalsContact O-N 3.1Å
8	A	58.8	Low	57.8	Low	62 Å²	62	130.1 Å²	130.1	51%	0.512	68%	0.678	S	S	.	*	H	α-helix	trans	-67.7	-39.2	176.2	0	0	0	0	0	111.2	P5 K11 K12	P5-A8 PolarHBondContact O-N 3.13Å; A8-K11 PolarHBondContact O-N 2.83Å; A8-K12 VanDerWaalsContact O-CB 3.29Å; A8-K12 WeakPolarHBondContact O-CB 3.33Å; A8-K12 PolarHBondContact O-N 2.87Å
9	E	57.3	Low	58	Low	126 Å²	126	127 Å²	127	59%	0.589	67%	0.667	S	S	*	*	H	α-helix	trans	-71.8	-39.5	-179.7	-157.8	158.2	-156.2	0	0	112.6	P5 K12 R13	P5-E9 PolarHBondContact O-N 2.85Å; E9-K12 PolarHBondContact O-N 2.86Å; E9-R13 WeakPolarHBondContact O-CB 3.29Å; E9-R13 PolarHBondContact O-N 3.49Å
10	K	60.8	Low	58.3	Low	168 Å²	168	124.3 Å²	124.3	73%	0.73	66%	0.655	S	S	*	*	H	α-helix	trans	-64.9	-39.4	172.9	-132.8	175.6	-173.8	178	0	112.1	L6 R14	L6-K10 WeakPolarHBondContact O-CB 3.42Å; L6-K10 PolarHBondContact O-N 3.5Å; L6-K10 VanDerWaalsContact O-N 3.14Å; K10-R14 WeakPolarHBondContact O-CB 3.45Å; K10-R14 PolarHBondContact O-N 3.08Å; K10-R14 VanDerWaalsContact O-N 3.11Å
11	K	61.1	Low	59.1	Low	142 Å²	142	121.3 Å²	121.3	62%	0.617	64%	0.64	S	S	*	*	H	α-helix	trans	-68.7	-40.3	176.2	-167	175.3	-179.5	-177.8	0	111.4	L7 A8 R14 M15	L7-K11 WeakPolarHBondContact O-CB 3.48Å; L7-K11 PolarHBondContact O-N 3.12Å; L7-K11 VanDerWaalsContact O-N 3.1Å; A8-K11 PolarHBondContact O-N 2.83Å; K11-R14 PolarHBondContact O-N 2.7Å; K11-M15 WeakPolarHBondContact O-CG 3.46Å; K11-M15 PolarHBondContact O-N 3.5Å
12	K	58.4	Low	60.5	Low	144 Å²	144	114.7 Å²	114.7	63%	0.626	61%	0.609	S	S	*	*	H	α-helix	trans	-65.1	-43.6	175.9	-165.7	173.6	-176.9	-177.7	0	112.3	A8 E9 R14 M15 M16	A8-K12 VanDerWaalsContact O-CB 3.29Å; A8-K12 WeakPolarHBondContact O-CB 3.33Å; A8-K12 PolarHBondContact O-N 2.87Å; E9-K12 PolarHBondContact O-N 2.86Å; K12-R14 VanDerWaalsContact C-N 3.34Å; K12-R14 PolarHBondContact O-N 3.07Å; K12-M15 PolarHBondContact O-N 3.24Å; K12-M16 WeakPolarHBondContact O-CG 3.18Å; K12-M16 PolarHBondContact O-N 2.74Å
13	R	60.3	Low	62	Low	170 Å²	170	115 Å²	115	64%	0.642	60%	0.598	S	S	*	*	H	α-helix	trans	-58.4	-42.8	171.7	-87.4	-177.1	152.9	-153.9	-12.7	112.2	E9 M16 A17 H137	E9-R13 WeakPolarHBondContact O-CB 3.29Å; E9-R13 PolarHBondContact O-N 3.49Å; R13-M16 PolarHBondContact O-N 3.26Å; R13-A17 WeakPolarHBondContact O-CB 3.41Å; R13-A17 PolarHBondContact O-N 2.94Å; R13-H137 PolarHBondContact NH2-OXT 2.87Å; R13-H137 VanDerWaalsContact NH2-OXT 3.16Å
14	R	60.1	Low	63.4	Low	199 Å²	199	110 Å²	110	75%	0.751	56%	0.562	S	S	*	*	H	α-helix	trans	-70.2	-34.2	180	-152.3	170.3	78.4	-174.8	6.7	113.2	K10 K11 K12 A18	K10-R14 WeakPolarHBondContact O-CB 3.45Å; K10-R14 PolarHBondContact O-N 3.08Å; K10-R14 VanDerWaalsContact O-N 3.11Å; K11-R14 PolarHBondContact O-N 2.7Å; K12-R14 VanDerWaalsContact C-N 3.34Å; K12-R14 PolarHBondContact O-N 3.07Å; R14-A18 PolarHBondContact O-N 3.06Å
15	M	56.7	Low	64.6	Low	137 Å²	137	111.8 Å²	111.8	68%	0.675	56%	0.559	S	S	*	*	H	α-helix	trans	-76.2	-28.9	175.7	-68	-163.3	89.2	0	0	113.4	K11 K12 P19	K11-M15 WeakPolarHBondContact O-CG 3.46Å; K11-M15 PolarHBondContact O-N 3.5Å; K12-M15 PolarHBondContact O-N 3.24Å; M15-P19 WeakPolarHBondContact O-CD 3.43Å
16	M	60.2	Low	66	Low	127 Å²	127	113.5 Å²	113.5	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-75	-32.6	171.6	-72.4	-80.5	-177.9	0	0	112.4	K12 R13 V20	K12-M16 WeakPolarHBondContact O-CG 3.18Å; K12-M16 PolarHBondContact O-N 2.74Å; R13-M16 PolarHBondContact O-N 3.26Å; M16-V20 VanDerWaalsContact O-CG2 3.32Å; M16-V20 WeakPolarHBondContact O-CG2 3.26Å
17	A	60.7	Low	67.5	Low	38 Å²	38	107.9 Å²	107.9	31%	0.314	53%	0.532	S	S	.	.	H	α-helix	trans	-75.8	-31.1	-179.8	0	0	0	0	0	114.1	R13 D21	R13-A17 WeakPolarHBondContact O-CB 3.41Å; R13-A17 PolarHBondContact O-N 2.94Å; A17-D21 PolarHBondContact O-N 3.38Å
18	A	61.8	Low	69	Low	63 Å²	63	105.3 Å²	105.3	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-46.8	-176.1	0	0	0	0	0	115.7	R14 V20	R14-A18 PolarHBondContact O-N 3.06Å; A18-V20 VanDerWaalsContact C-N 3.35Å
19	P	62.3	Low	70.5	Confident	72 Å²	72	105.5 Å²	105.5	47%	0.468	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-34.9	176.2	23.7	-30.3	0	0	0	112	M15 L22 E23	M15-P19 WeakPolarHBondContact O-CD 3.43Å; P19-L22 WeakPolarHBondContact O-CB 3.35Å; P19-L22 PolarHBondContact O-N 3.27Å; P19-E23 PolarHBondContact O-N 3.33Å
20	V	62.8	Low	72.1	Confident	72 Å²	72	106 Å²	106	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-71.1	-35.5	-180	179.5	0	0	0	0	112.3	M16 A18 L22 E23 L24	M16-V20 VanDerWaalsContact O-CG2 3.32Å; M16-V20 WeakPolarHBondContact O-CG2 3.26Å; A18-V20 VanDerWaalsContact C-N 3.35Å; V20-L22 PolarHBondContact O-N 3.17Å; V20-E23 PolarHBondContact O-N 3.23Å; V20-L24 PolarHBondContact O-N 3.2Å
21	D	74.9	Confident	73.7	Confident	62 Å²	62	99 Å²	99	33%	0.332	49%	0.486	S	S	.	.	H	α-helix	trans	-65.4	-27.7	172.5	-103.8	-30.1	0	0	0	112.6	A17 K25 R134	A17-D21 PolarHBondContact O-N 3.38Å; D21-K25 WeakPolarHBondContact O-CG 3.47Å; D21-K25 PolarHBondContact O-N 3.01Å; D21-K25 VanDerWaalsContact O-N 3.14Å; D21-R134 IonicContact OD1-CZ 3.88Å; D21-R134 IonicContact OD1-NH1 2.94Å; D21-R134 PolarHBondContact OD1-NH1 2.91Å; D21-R134 IonicContact OD1-NH2 2.74Å; D21-R134 PolarHBondContact OD1-NH2 3.2Å; D21-R134 IonicContact OD2-CZ 3.84Å; D21-R134 IonicContact OD2-NH1 3.78Å; D21-R134 IonicContact OD2-NH2 3.69Å; D21-R134 PolarHBondContact OD2-NH2 3.39Å
22	L	79.8	Confident	75.1	Confident	102 Å²	102	98 Å²	98	53%	0.534	48%	0.483	S	S	.	.	H	α-helix	trans	-74.2	-41	176.2	-155.7	81.4	0	0	0	111.3	P19 V20 K25 K26	P19-L22 WeakPolarHBondContact O-CB 3.35Å; P19-L22 PolarHBondContact O-N 3.27Å; V20-L22 PolarHBondContact O-N 3.17Å; L22-K25 PolarHBondContact O-N 2.82Å; L22-K26 WeakPolarHBondContact O-CG 3.36Å; L22-K26 PolarHBondContact O-N 2.99Å
23	E	80.4	Confident	76.8	Confident	119 Å²	119	95.8 Å²	95.8	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-62.8	-43.3	173.9	-71.9	177.8	173.1	0	0	111.6	P19 V20 K25 K26 A27	P19-E23 PolarHBondContact O-N 3.33Å; V20-E23 PolarHBondContact O-N 3.23Å; E23-K25 PolarHBondContact O-N 3.4Å; E23-K26 PolarHBondContact O-N 3.01Å; E23-A27 WeakPolarHBondContact O-CB 3.16Å; E23-A27 PolarHBondContact O-N 3.36Å
24	L	83.1	Confident	78.4	Confident	18 Å²	18	91.1 Å²	91.1	9%	0.094	47%	0.466	C	S	.	.	H	α-helix	trans	-62.5	-44.9	177	-174.7	64	0	0	0	111.8	V20 K26 A27 F28 I127 M130 L131	V20-L24 PolarHBondContact O-N 3.2Å; L24-K26 VanDerWaalsContact C-N 3.3Å; L24-K26 PolarHBondContact O-N 3.37Å; L24-A27 PolarHBondContact O-N 3.14Å; L24-F28 HydrophobicContact CD1-CD2 4.08Å; L24-F28 HydrophobicContact CD1-CE2 3.74Å; L24-F28 HydrophobicContact CD2-CE2 4.37Å; L24-F28 HydrophobicContact CG-CD2 3.96Å; L24-F28 HydrophobicContact CG-CE2 3.84Å; L24-F28 VanDerWaalsContact O-CD2 3.26Å; L24-F28 WeakPolarHBondContact O-CD2 3.38Å; L24-F28 PolarHBondContact O-N 2.98Å; L24-I127 HydrophobicContact CD1-CG2 4.37Å; L24-M130 HydrophobicContact CD1-CB 4.46Å; L24-L131 HydrophobicContact CD1-CD2 4.46Å; L24-L131 HydrophobicContact CD2-CD2 3.8Å
25	K	85.4	Confident	80	Confident	156 Å²	156	84.8 Å²	84.8	68%	0.678	45%	0.446	S	S	*	.	H	α-helix	trans	-60	-39.7	174.9	-83.4	-175.1	177.1	-176.4	0	112.5	D21 L22 E23 S29	D21-K25 WeakPolarHBondContact O-CG 3.47Å; D21-K25 PolarHBondContact O-N 3.01Å; D21-K25 VanDerWaalsContact O-N 3.14Å; L22-K25 PolarHBondContact O-N 2.82Å; E23-K25 PolarHBondContact O-N 3.4Å; K25-S29 PolarHBondContact O-N 3.36Å; K25-S29 VanDerWaalsContact O-N 3.12Å
26	K	88.3	Confident	81.8	Confident	120 Å²	120	82 Å²	82	52%	0.522	43%	0.432	S	S	.	.	H	α-helix	trans	-64.8	-47.7	175.6	-73.4	175.9	179.8	-176.1	0	111.2	L22 E23 L24 F28 S29 E30	L22-K26 WeakPolarHBondContact O-CG 3.36Å; L22-K26 PolarHBondContact O-N 2.99Å; E23-K26 PolarHBondContact O-N 3.01Å; L24-K26 VanDerWaalsContact C-N 3.3Å; L24-K26 PolarHBondContact O-N 3.37Å; K26-F28 VanDerWaalsContact C-N 3.3Å; K26-F28 PolarHBondContact O-N 2.93Å; K26-S29 WeakPolarHBondContact O-CB 3.27Å; K26-S29 PolarHBondContact O-N 3.42Å; K26-E30 WeakPolarHBondContact O-CG 3.5Å; K26-E30 PolarHBondContact O-N 3.43Å
27	A	87.9	Confident	83.5	Confident	23 Å²	23	78.9 Å²	78.9	19%	0.19	42%	0.418	C	S	.	.	H	α-helix	trans	-57.9	-40.5	177.3	0	0	0	0	0	112.3	E23 L24 E30 L31 I127	E23-A27 WeakPolarHBondContact O-CB 3.16Å; E23-A27 PolarHBondContact O-N 3.36Å; L24-A27 PolarHBondContact O-N 3.14Å; A27-E30 PolarHBondContact O-N 3.02Å; A27-L31 WeakPolarHBondContact O-CB 3.37Å; A27-L31 PolarHBondContact O-N 2.67Å; A27-I127 HydrophobicContact CB-CD1 4.16Å; A27-I127 HydrophobicContact CB-CG1 4.23Å
28	F	88.2	Confident	85.1	Confident	91 Å²	91	77.6 Å²	77.6	40%	0.399	41%	0.406	S	S	.	.	H	α-helix	trans	-63.1	-43.1	173.6	-90.2	-69.7	0	0	0	113.1	L24 K26 E30 L31 Q32 I127 L131	L24-F28 HydrophobicContact CD1-CD2 4.08Å; L24-F28 HydrophobicContact CD1-CE2 3.74Å; L24-F28 HydrophobicContact CD2-CE2 4.37Å; L24-F28 HydrophobicContact CG-CD2 3.96Å; L24-F28 HydrophobicContact CG-CE2 3.84Å; L24-F28 VanDerWaalsContact O-CD2 3.26Å; L24-F28 WeakPolarHBondContact O-CD2 3.38Å; L24-F28 PolarHBondContact O-N 2.98Å; K26-F28 VanDerWaalsContact C-N 3.3Å; K26-F28 PolarHBondContact O-N 2.93Å; F28-E30 VanDerWaalsContact C-N 3.34Å; F28-L31 PolarHBondContact O-N 2.95Å; F28-Q32 WeakPolarHBondContact O-CB 3.23Å; F28-Q32 PolarHBondContact O-N 3.45Å; F28-I127 HydrophobicContact CD1-CG2 4.28Å; F28-I127 HydrophobicContact CD2-CG2 4.29Å; F28-I127 HydrophobicContact CE1-CG2 3.68Å; F28-I127 HydrophobicContact CE2-CG2 3.68Å; F28-I127 HydrophobicContact CZ-CG2 3.33Å; F28-L131 HydrophobicContact CZ-CD1 4.08Å
29	S	91.2	Very high	86.6	Confident	67 Å²	67	79.4 Å²	79.4	47%	0.469	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-42.6	177.3	-170.4	0	0	0	0	111.3	K25 K26 Q32 V33	K25-S29 PolarHBondContact O-N 3.36Å; K25-S29 VanDerWaalsContact O-N 3.12Å; K26-S29 WeakPolarHBondContact O-CB 3.27Å; K26-S29 PolarHBondContact O-N 3.42Å; S29-Q32 PolarHBondContact O-N 3.39Å; S29-V33 WeakPolarHBondContact O-CG2 3.43Å; S29-V33 PolarHBondContact O-N 2.94Å; S29-V33 VanDerWaalsContact O-N 3.11Å
30	E	90.9	Very high	88.3	Confident	135 Å²	135	81.4 Å²	81.4	63%	0.631	41%	0.407	S	S	*	.	H	α-helix	trans	-65.7	-42	177.2	-71.7	172.8	-166.2	0	0	111.7	K26 A27 F28 Q32 V33 K34	K26-E30 WeakPolarHBondContact O-CG 3.5Å; K26-E30 PolarHBondContact O-N 3.43Å; A27-E30 PolarHBondContact O-N 3.02Å; F28-E30 VanDerWaalsContact C-N 3.34Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.24Å; E30-V33 PolarHBondContact O-N 3.16Å; E30-K34 WeakPolarHBondContact O-CB 3.33Å; E30-K34 PolarHBondContact O-N 2.96Å
31	L	92.9	Very high	89.8	Confident	23 Å²	23	82.2 Å²	82.2	12%	0.12	41%	0.405	C	S	.	.	H	α-helix	trans	-60	-44.1	174.2	176.3	65.7	0	0	0	111.3	A27 F28 V33 K34 M35 A123 E124 I127	A27-L31 WeakPolarHBondContact O-CB 3.37Å; A27-L31 PolarHBondContact O-N 2.67Å; F28-L31 PolarHBondContact O-N 2.95Å; L31-V33 VanDerWaalsContact C-N 3.35Å; L31-V33 PolarHBondContact O-N 3.33Å; L31-K34 PolarHBondContact O-N 3.23Å; L31-M35 WeakPolarHBondContact O-CB 3.32Å; L31-M35 PolarHBondContact O-N 3.38Å; L31-A123 HydrophobicContact CD1-CB 3.69Å; L31-E124 HydrophobicContact CD1-CG 3.9Å; L31-E124 HydrophobicContact CD2-CG 3.92Å; L31-E124 HydrophobicContact CG-CG 4.48Å; L31-I127 HydrophobicContact CB-CD1 3.66Å; L31-I127 HydrophobicContact CD2-CD1 3.59Å; L31-I127 HydrophobicContact CG-CD1 4.14Å
32	Q	90.9	Very high	90.8	Very high	119 Å²	119	80 Å²	80	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-61.9	-43.8	179.6	-171.3	176	7.8	0	0	111.5	F28 S29 E30 M35 I36	F28-Q32 WeakPolarHBondContact O-CB 3.23Å; F28-Q32 PolarHBondContact O-N 3.45Å; S29-Q32 PolarHBondContact O-N 3.39Å; E30-Q32 VanDerWaalsContact C-N 3.33Å; E30-Q32 PolarHBondContact O-N 3.24Å; Q32-M35 PolarHBondContact O-N 2.88Å; Q32-I36 HydrophobicContact CG-CD1 4.25Å; Q32-I36 WeakPolarHBondContact O-CG1 3.5Å; Q32-I36 PolarHBondContact O-N 2.87Å; Q32-I36 VanDerWaalsContact O-N 3.1Å
33	V	94.5	Very high	91.6	Very high	98 Å²	98	81.7 Å²	81.7	59%	0.594	40%	0.397	S	S	*	.	H	α-helix	trans	-61.6	-47.3	174.8	172.5	0	0	0	0	110.7	S29 E30 L31 M35 I36 D37	S29-V33 WeakPolarHBondContact O-CG2 3.43Å; S29-V33 PolarHBondContact O-N 2.94Å; S29-V33 VanDerWaalsContact O-N 3.11Å; E30-V33 PolarHBondContact O-N 3.16Å; L31-V33 VanDerWaalsContact C-N 3.35Å; L31-V33 PolarHBondContact O-N 3.33Å; V33-M35 VanDerWaalsContact C-N 3.31Å; V33-M35 PolarHBondContact O-N 2.88Å; V33-I36 PolarHBondContact O-N 2.73Å; V33-D37 WeakPolarHBondContact O-CB 3.38Å; V33-D37 PolarHBondContact O-N 3.5Å
34	K	93.6	Very high	92.3	Very high	73 Å²	73	81.1 Å²	81.1	32%	0.317	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-38.5	179.1	-170.3	-178	-176.1	-174	0	112.5	E30 L31 T38 S119 V120 A123	E30-K34 WeakPolarHBondContact O-CB 3.33Å; E30-K34 PolarHBondContact O-N 2.96Å; L31-K34 PolarHBondContact O-N 3.23Å; K34-T38 WeakPolarHBondContact O-CB 3.5Å; K34-T38 PolarHBondContact O-N 2.93Å; K34-T38 PolarHBondContact O-OG1 3.45Å; K34-S119 VanDerWaalsContact CE-OG 3.31Å; K34-S119 WeakPolarHBondContact CE-OG 3.42Å; K34-S119 PolarHBondContact NZ-O 2.94Å; K34-S119 PolarHBondContact NZ-OG 3.35Å; K34-V120 HydrophobicContact CG-CG2 4.44Å; K34-A123 HydrophobicContact CD-CB 4.35Å
35	M	93.9	Very high	92.9	Very high	66 Å²	66	80.6 Å²	80.6	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-66.1	-46.2	177.9	-173.1	-178.3	73.6	0	0	111	L31 Q32 V33 T38 Q39 V120	L31-M35 WeakPolarHBondContact O-CB 3.32Å; L31-M35 PolarHBondContact O-N 3.38Å; Q32-M35 PolarHBondContact O-N 2.88Å; V33-M35 VanDerWaalsContact C-N 3.31Å; V33-M35 PolarHBondContact O-N 2.88Å; M35-T38 PolarHBondContact O-N 3.35Å; M35-Q39 WeakPolarHBondContact O-CB 3.48Å; M35-Q39 VanDerWaalsContact O-CG 3.3Å; M35-Q39 WeakPolarHBondContact O-CG 3.45Å; M35-Q39 PolarHBondContact O-N 3.02Å; M35-V120 HydrophobicContact CB-CG1 4.49Å; M35-V120 HydrophobicContact CG-CG1 4.41Å
36	I	95.3	Very high	93.4	Very high	77 Å²	77	76.1 Å²	76.1	40%	0.395	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-48.2	178.6	-67.6	167	0	0	0	110.7	Q32 V33 T38 Q39 Q40	Q32-I36 HydrophobicContact CG-CD1 4.25Å; Q32-I36 WeakPolarHBondContact O-CG1 3.5Å; Q32-I36 PolarHBondContact O-N 2.87Å; Q32-I36 VanDerWaalsContact O-N 3.1Å; V33-I36 PolarHBondContact O-N 2.73Å; I36-T38 PolarHBondContact O-N 3.15Å; I36-Q39 PolarHBondContact O-N 2.83Å; I36-Q40 WeakPolarHBondContact O-CG 3.43Å; I36-Q40 PolarHBondContact O-N 3.47Å
37	D	94.3	Very high	93.9	Very high	63 Å²	63	75.4 Å²	75.4	34%	0.337	38%	0.38	S	S	.	.	H	α-helix	trans	-61.8	-43.6	179	179.2	44.7	0	0	0	111.5	V33 Q39 Q40 K41	V33-D37 WeakPolarHBondContact O-CB 3.38Å; V33-D37 PolarHBondContact O-N 3.5Å; D37-Q39 PolarHBondContact O-N 2.91Å; D37-Q40 PolarHBondContact O-N 3.42Å; D37-K41 WeakPolarHBondContact O-CB 3.46Å; D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 2.74Å; D37-K41 WeakPolarHBondContact OD1-CE 3.34Å; D37-K41 IonicContact OD1-NZ 3.58Å; D37-K41 PolarHBondContact OD1-NZ 3.1Å; D37-K41 WeakPolarHBondContact OD2-CE 3.4Å; D37-K41 IonicContact OD2-NZ 2.74Å; D37-K41 PolarHBondContact OD2-NZ 3.39Å
38	T	94.9	Very high	94.3	Very high	10 Å²	10	79 Å²	79	6%	0.061	39%	0.393	C	S	.	.	H	α-helix	trans	-59.7	-48.5	174.5	-64.3	0	0	0	0	111.7	K34 M35 I36 Q40 K41 V42 L116 V120	K34-T38 WeakPolarHBondContact O-CB 3.5Å; K34-T38 PolarHBondContact O-N 2.93Å; K34-T38 PolarHBondContact O-OG1 3.45Å; M35-T38 PolarHBondContact O-N 3.35Å; I36-T38 PolarHBondContact O-N 3.15Å; T38-Q40 VanDerWaalsContact C-N 3.28Å; T38-Q40 PolarHBondContact O-N 3.22Å; T38-K41 PolarHBondContact O-N 3.46Å; T38-V42 HydrophobicContact CG2-CG2 4.11Å; T38-V42 WeakPolarHBondContact O-CB 3.5Å; T38-V42 VanDerWaalsContact O-CG2 3.29Å; T38-V42 WeakPolarHBondContact O-CG2 3.34Å; T38-V42 PolarHBondContact O-N 3.38Å; T38-L116 HydrophobicContact CG2-CB 3.83Å; T38-V120 HydrophobicContact CG2-CG2 3.61Å; T38-V120 WeakPolarHBondContact OG1-CG2 3.32Å
39	Q	94.4	Very high	94.7	Very high	101 Å²	101	76.3 Å²	76.3	47%	0.472	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-39.1	178.9	-76.9	177.4	0.8	0	0	112.2	M35 I36 D37 K43	M35-Q39 WeakPolarHBondContact O-CB 3.48Å; M35-Q39 VanDerWaalsContact O-CG 3.3Å; M35-Q39 WeakPolarHBondContact O-CG 3.45Å; M35-Q39 PolarHBondContact O-N 3.02Å; I36-Q39 PolarHBondContact O-N 2.83Å; D37-Q39 PolarHBondContact O-N 2.91Å; Q39-K43 VanDerWaalsContact O-CG 3.28Å; Q39-K43 WeakPolarHBondContact O-CG 3.42Å; Q39-K43 PolarHBondContact O-N 3.36Å; Q39-K43 VanDerWaalsContact O-N 3.11Å
40	Q	96	Very high	95	Very high	115 Å²	115	78.1 Å²	78.1	54%	0.537	38%	0.384	S	S	.	.	H	α-helix	trans	-65.4	-46.7	175.4	-71.2	177.4	-6	0	0	111.4	I36 D37 T38 V42 K43 L44	I36-Q40 WeakPolarHBondContact O-CG 3.43Å; I36-Q40 PolarHBondContact O-N 3.47Å; D37-Q40 PolarHBondContact O-N 3.42Å; T38-Q40 VanDerWaalsContact C-N 3.28Å; T38-Q40 PolarHBondContact O-N 3.22Å; Q40-V42 PolarHBondContact O-N 3.09Å; Q40-K43 PolarHBondContact O-N 3.46Å; Q40-L44 WeakPolarHBondContact O-CG 3.38Å; Q40-L44 PolarHBondContact O-N 3.17Å
41	K	95.3	Very high	95.3	Very high	88 Å²	88	77.5 Å²	77.5	38%	0.383	38%	0.38	S	S	.	.	H	α-helix	trans	-62.7	-40.3	178.5	-74.6	171.1	176.5	166.1	0	112.7	D37 T38 L44 A45 L116	D37-K41 WeakPolarHBondContact O-CB 3.46Å; D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 2.74Å; D37-K41 WeakPolarHBondContact OD1-CE 3.34Å; D37-K41 IonicContact OD1-NZ 3.58Å; D37-K41 PolarHBondContact OD1-NZ 3.1Å; D37-K41 WeakPolarHBondContact OD2-CE 3.4Å; D37-K41 IonicContact OD2-NZ 2.74Å; D37-K41 PolarHBondContact OD2-NZ 3.39Å; T38-K41 PolarHBondContact O-N 3.46Å; K41-L44 PolarHBondContact O-N 3.08Å; K41-A45 WeakPolarHBondContact O-CB 3.28Å; K41-A45 PolarHBondContact O-N 2.95Å; K41-L116 HydrophobicContact CB-CD1 3.79Å; K41-L116 HydrophobicContact CD-CD1 4.36Å; K41-L116 HydrophobicContact CD-CD2 4.45Å
42	V	95.6	Very high	95.5	Very high	17 Å²	17	77.9 Å²	77.9	10%	0.103	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-47	176.2	170.4	0	0	0	0	110.6	T38 Q40 L44 A45 D46 K113 E117	T38-V42 HydrophobicContact CG2-CG2 4.11Å; T38-V42 WeakPolarHBondContact O-CB 3.5Å; T38-V42 VanDerWaalsContact O-CG2 3.29Å; T38-V42 WeakPolarHBondContact O-CG2 3.34Å; T38-V42 PolarHBondContact O-N 3.38Å; Q40-V42 PolarHBondContact O-N 3.09Å; V42-L44 VanDerWaalsContact C-N 3.31Å; V42-L44 PolarHBondContact O-N 2.96Å; V42-A45 WeakPolarHBondContact O-CB 3.49Å; V42-A45 PolarHBondContact O-N 3.46Å; V42-A45 VanDerWaalsContact O-N 3.13Å; V42-D46 PolarHBondContact O-N 3.26Å; V42-K113 HydrophobicContact CG1-CD 4.02Å; V42-K113 HydrophobicContact CG1-CG 4.04Å; V42-K113 HydrophobicContact CG2-CG 4.19Å; V42-E117 HydrophobicContact CG2-CG 4.44Å
43	K	95.9	Very high	95.7	Very high	137 Å²	137	73 Å²	73	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-58.5	-42.2	176.1	-74.3	173.8	-178.1	-179.5	0	112.5	Q39 Q40 D46 L47	Q39-K43 VanDerWaalsContact O-CG 3.28Å; Q39-K43 WeakPolarHBondContact O-CG 3.42Å; Q39-K43 PolarHBondContact O-N 3.36Å; Q39-K43 VanDerWaalsContact O-N 3.11Å; Q40-K43 PolarHBondContact O-N 3.46Å; K43-D46 PolarHBondContact O-N 3.48Å; K43-L47 WeakPolarHBondContact O-CG 3.42Å; K43-L47 PolarHBondContact O-N 2.98Å; K43-L47 VanDerWaalsContact O-N 3.11Å
44	L	96.2	Very high	95.8	Very high	106 Å²	106	74.8 Å²	74.8	56%	0.555	36%	0.361	S	S	*	.	H	α-helix	trans	-64.6	-41.6	176.3	-71.4	174	0	0	0	111.8	Q40 K41 V42 L47 Q48	Q40-L44 WeakPolarHBondContact O-CG 3.38Å; Q40-L44 PolarHBondContact O-N 3.17Å; K41-L44 PolarHBondContact O-N 3.08Å; V42-L44 VanDerWaalsContact C-N 3.31Å; V42-L44 PolarHBondContact O-N 2.96Å; L44-L47 PolarHBondContact O-N 3.43Å; L44-Q48 WeakPolarHBondContact O-CG 3.31Å; L44-Q48 PolarHBondContact O-N 3.36Å
45	A	96.1	Very high	95.9	Very high	7 Å²	7	73.9 Å²	73.9	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-62.7	-42.4	175.5	0	0	0	0	0	111.6	K41 V42 L47 Q48 I49 L109	K41-A45 WeakPolarHBondContact O-CB 3.28Å; K41-A45 PolarHBondContact O-N 2.95Å; V42-A45 WeakPolarHBondContact O-CB 3.49Å; V42-A45 PolarHBondContact O-N 3.46Å; V42-A45 VanDerWaalsContact O-N 3.13Å; A45-L47 PolarHBondContact O-N 3.29Å; A45-Q48 PolarHBondContact O-N 3.39Å; A45-I49 VanDerWaalsContact O-CG1 3.29Å; A45-I49 WeakPolarHBondContact O-CG1 3.4Å; A45-I49 PolarHBondContact O-N 2.9Å; A45-L109 HydrophobicContact CB-CD2 4.37Å
46	D	96.1	Very high	95.9	Very high	63 Å²	63	72.6 Å²	72.6	34%	0.337	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-44.6	177.1	-71	-33.1	0	0	0	111.6	V42 K43 Q48 I49 E50 K113	V42-D46 PolarHBondContact O-N 3.26Å; K43-D46 PolarHBondContact O-N 3.48Å; D46-Q48 VanDerWaalsContact C-N 3.33Å; D46-Q48 PolarHBondContact O-N 3.44Å; D46-I49 PolarHBondContact O-N 3.42Å; D46-E50 PolarHBondContact O-N 2.67Å; D46-K113 IonicContact OD1-NZ 3.36Å; D46-K113 PolarHBondContact OD1-NZ 2.79Å; D46-K113 IonicContact OD2-NZ 2.66Å
47	L	97.3	Very high	95.9	Very high	105 Å²	105	75.9 Å²	75.9	55%	0.55	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-40	175.9	-69.3	172.5	0	0	0	112.3	K43 L44 A45 E50 Q51	K43-L47 WeakPolarHBondContact O-CG 3.42Å; K43-L47 PolarHBondContact O-N 2.98Å; K43-L47 VanDerWaalsContact O-N 3.11Å; L44-L47 PolarHBondContact O-N 3.43Å; A45-L47 PolarHBondContact O-N 3.29Å; L47-E50 PolarHBondContact O-N 3.19Å; L47-Q51 WeakPolarHBondContact O-CB 3.38Å; L47-Q51 PolarHBondContact O-N 2.97Å
48	Q	96.4	Very high	95.9	Very high	97 Å²	97	78.9 Å²	78.9	45%	0.453	38%	0.377	S	S	.	.	H	α-helix	trans	-66.5	-42.6	176.6	-74.5	179	-19	0	0	111.7	L44 A45 D46 E50 Q51 L52 L109	L44-Q48 WeakPolarHBondContact O-CG 3.31Å; L44-Q48 PolarHBondContact O-N 3.36Å; A45-Q48 PolarHBondContact O-N 3.39Å; D46-Q48 VanDerWaalsContact C-N 3.33Å; D46-Q48 PolarHBondContact O-N 3.44Å; Q48-E50 VanDerWaalsContact C-N 3.33Å; Q48-E50 PolarHBondContact O-N 2.76Å; Q48-Q51 PolarHBondContact O-N 3.33Å; Q48-L52 WeakPolarHBondContact O-CB 3.35Å; Q48-L52 VanDerWaalsContact O-CG 3.29Å; Q48-L52 WeakPolarHBondContact O-CG 3.29Å; Q48-L52 PolarHBondContact O-N 3.2Å; Q48-L109 HydrophobicContact CB-CD1 3.69Å
49	I	96.9	Very high	95.9	Very high	35 Å²	35	78.4 Å²	78.4	18%	0.179	37%	0.374	C	S	.	.	H	α-helix	trans	-61	-43.9	175.3	-70.7	166	0	0	0	110.2	A45 D46 Q51 L52 G53 I106 L109 E110	A45-I49 VanDerWaalsContact O-CG1 3.29Å; A45-I49 WeakPolarHBondContact O-CG1 3.4Å; A45-I49 PolarHBondContact O-N 2.9Å; D46-I49 PolarHBondContact O-N 3.42Å; I49-Q51 PolarHBondContact O-N 3.36Å; I49-L52 PolarHBondContact O-N 3.41Å; I49-G53 PolarHBondContact O-N 3.4Å; I49-I106 HydrophobicContact CG2-CG2 4.4Å; I49-L109 HydrophobicContact CD1-CB 3.95Å; I49-L109 HydrophobicContact CG1-CB 3.81Å; I49-L109 HydrophobicContact CG1-CD1 3.99Å; I49-E110 HydrophobicContact CD1-CG 3.92Å
50	E	97.1	Very high	95.9	Very high	106 Å²	106	78.1 Å²	78.1	50%	0.495	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-43.2	177.9	-165.3	-163.9	144.9	0	0	111.8	D46 L47 Q48 G53 R54	D46-E50 PolarHBondContact O-N 2.67Å; L47-E50 PolarHBondContact O-N 3.19Å; Q48-E50 VanDerWaalsContact C-N 3.33Å; Q48-E50 PolarHBondContact O-N 2.76Å; E50-G53 PolarHBondContact O-N 2.82Å; E50-R54 PolarHBondContact O-N 2.95Å; E50-R54 VanDerWaalsContact O-N 3.09Å; E50-R54 IonicContact OE1-CZ 3.66Å; E50-R54 IonicContact OE1-NH1 2.67Å; E50-R54 PolarHBondContact OE1-NH1 3.12Å; E50-R54 IonicContact OE1-NH2 3.88Å
51	Q	96.9	Very high	95.9	Very high	121 Å²	121	78.2 Å²	78.2	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-62.5	-47.6	175.7	-176.8	178.3	5.5	0	0	111.8	L47 Q48 I49 G53 R54 V55	L47-Q51 WeakPolarHBondContact O-CB 3.38Å; L47-Q51 PolarHBondContact O-N 2.97Å; Q48-Q51 PolarHBondContact O-N 3.33Å; I49-Q51 PolarHBondContact O-N 3.36Å; Q51-G53 VanDerWaalsContact C-N 3.31Å; Q51-G53 PolarHBondContact O-N 3.17Å; Q51-R54 WeakPolarHBondContact O-CB 3.34Å; Q51-R54 PolarHBondContact O-N 2.88Å; Q51-V55 PolarHBondContact O-N 3.06Å; Q51-V55 VanDerWaalsContact O-N 3.17Å
52	L	97.1	Very high	95.9	Very high	32 Å²	32	76.3 Å²	76.3	17%	0.168	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-38.6	177.1	-73.8	171.4	0	0	0	111.4	Q48 I49 R54 V55 Q56 V102 K105 I106 L109	Q48-L52 WeakPolarHBondContact O-CB 3.35Å; Q48-L52 VanDerWaalsContact O-CG 3.29Å; Q48-L52 WeakPolarHBondContact O-CG 3.29Å; Q48-L52 PolarHBondContact O-N 3.2Å; I49-L52 PolarHBondContact O-N 3.41Å; L52-R54 VanDerWaalsContact C-N 3.31Å; L52-R54 PolarHBondContact O-N 3.49Å; L52-V55 WeakPolarHBondContact O-CB 3.39Å; L52-V55 PolarHBondContact O-N 2.9Å; L52-V55 VanDerWaalsContact O-N 3.1Å; L52-Q56 WeakPolarHBondContact O-CB 3.29Å; L52-Q56 PolarHBondContact O-N 2.96Å; L52-V102 HydrophobicContact CB-CG1 4.1Å; L52-V102 HydrophobicContact CD2-CG1 4.28Å; L52-V102 HydrophobicContact CD2-CG2 4.41Å; L52-V102 WeakPolarHBondContact O-CG1 3.36Å; L52-K105 HydrophobicContact CD1-CB 3.87Å; L52-I106 HydrophobicContact CB-CD1 3.98Å; L52-I106 HydrophobicContact CB-CG1 3.75Å; L52-I106 HydrophobicContact CD1-CG1 4.06Å; L52-L109 HydrophobicContact CD1-CD1 3.8Å
53	G	96	Very high	95.8	Very high	17 Å²	17	77.5 Å²	77.5	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-37	175.1	0	0	0	0	0	112.9	I49 E50 Q51 K57	I49-G53 PolarHBondContact O-N 3.4Å; E50-G53 PolarHBondContact O-N 2.82Å; Q51-G53 VanDerWaalsContact C-N 3.31Å; Q51-G53 PolarHBondContact O-N 3.17Å; G53-K57 WeakPolarHBondContact O-CG 3.28Å; G53-K57 PolarHBondContact O-N 3.41Å; G53-K57 VanDerWaalsContact O-N 3.08Å
54	R	96.4	Very high	95.7	Very high	135 Å²	135	73.6 Å²	73.6	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-64	-44.9	171	-73.4	-173.6	-78.2	-99.2	-3.9	111.9	E50 Q51 L52 Q56 K57 H58	E50-R54 PolarHBondContact O-N 2.95Å; E50-R54 VanDerWaalsContact O-N 3.09Å; E50-R54 IonicContact OE1-CZ 3.66Å; E50-R54 IonicContact OE1-NH1 2.67Å; E50-R54 PolarHBondContact OE1-NH1 3.12Å; E50-R54 IonicContact OE1-NH2 3.88Å; Q51-R54 WeakPolarHBondContact O-CB 3.34Å; Q51-R54 PolarHBondContact O-N 2.88Å; L52-R54 VanDerWaalsContact C-N 3.31Å; L52-R54 PolarHBondContact O-N 3.49Å; R54-Q56 VanDerWaalsContact C-N 3.32Å; R54-Q56 PolarHBondContact O-N 3.13Å; R54-K57 PolarHBondContact O-N 3.04Å; R54-H58 PolarHBondContact O-N 3.2Å
55	V	94.9	Very high	95.5	Very high	53 Å²	53	74.7 Å²	74.7	32%	0.321	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-40.7	178.3	176.6	0	0	0	0	111.2	Q51 L52 H58 T59 V102	Q51-V55 PolarHBondContact O-N 3.06Å; Q51-V55 VanDerWaalsContact O-N 3.17Å; L52-V55 WeakPolarHBondContact O-CB 3.39Å; L52-V55 PolarHBondContact O-N 2.9Å; L52-V55 VanDerWaalsContact O-N 3.1Å; V55-H58 PolarHBondContact O-N 3.47Å; V55-T59 WeakPolarHBondContact O-CB 3.37Å; V55-T59 PolarHBondContact O-N 3.33Å; V55-T59 PolarHBondContact O-OG1 3.02Å; V55-V102 HydrophobicContact CG1-CG2 4.05Å
56	Q	94.4	Very high	95.3	Very high	39 Å²	39	75.3 Å²	75.3	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-61	-49.1	176.8	-163.1	-158.8	25.4	0	0	111	L52 R54 H58 T59 K60 V102 D103	L52-Q56 WeakPolarHBondContact O-CB 3.29Å; L52-Q56 PolarHBondContact O-N 2.96Å; R54-Q56 VanDerWaalsContact C-N 3.32Å; R54-Q56 PolarHBondContact O-N 3.13Å; Q56-H58 PolarHBondContact O-N 3.35Å; Q56-T59 PolarHBondContact O-N 3.32Å; Q56-K60 HydrophobicContact CG-CD 4.42Å; Q56-K60 WeakPolarHBondContact O-CB 3.16Å; Q56-K60 WeakPolarHBondContact O-CG 3.46Å; Q56-K60 PolarHBondContact O-N 3.45Å; Q56-V102 HydrophobicContact CB-CG1 3.84Å; Q56-V102 HydrophobicContact CG-CG1 4.27Å; Q56-D103 PolarHBondContact NE2-OD1 2.77Å
57	K	95.6	Very high	95.1	Very high	147 Å²	147	75.5 Å²	75.5	64%	0.639	38%	0.38	S	S	*	.	H	α-helix	trans	-59.4	-46.8	177	-73.1	174.9	-176.9	-179.5	0	111.8	G53 R54 T59 K60 L61	G53-K57 WeakPolarHBondContact O-CG 3.28Å; G53-K57 PolarHBondContact O-N 3.41Å; G53-K57 VanDerWaalsContact O-N 3.08Å; R54-K57 PolarHBondContact O-N 3.04Å; K57-T59 VanDerWaalsContact C-N 3.35Å; K57-T59 PolarHBondContact O-N 3.49Å; K57-K60 PolarHBondContact O-N 3.45Å; K57-L61 WeakPolarHBondContact O-CG 3.37Å; K57-L61 PolarHBondContact O-N 3.39Å
58	H	95.1	Very high	94.9	Very high	125 Å²	125	75.5 Å²	75.5	58%	0.579	38%	0.384	S	S	*	.	H	α-helix	trans	-59.4	-47	177.2	-176.6	-67.2	0	0	0	111.3	R54 V55 Q56 K60 L61 T62	R54-H58 PolarHBondContact O-N 3.2Å; V55-H58 PolarHBondContact O-N 3.47Å; Q56-H58 PolarHBondContact O-N 3.35Å; H58-K60 VanDerWaalsContact C-N 3.33Å; H58-K60 PolarHBondContact O-N 2.97Å; H58-L61 PolarHBondContact O-N 2.85Å; H58-T62 PolarHBondContact CE1-OG1 2.66Å; H58-T62 PolarHBondContact ND1-OG1 2.78Å; H58-T62 PolarHBondContact O-N 3.11Å; H58-T62 PolarHBondContact O-OG1 2.93Å
59	T	94.7	Very high	94.6	Very high	1 Å²	1	73.9 Å²	73.9	1%	0.006	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-41.3	-178.8	-51.4	0	0	0	0	111.3	V55 Q56 K57 T62 Q63 L95 K98 Q99	V55-T59 WeakPolarHBondContact O-CB 3.37Å; V55-T59 PolarHBondContact O-N 3.33Å; V55-T59 PolarHBondContact O-OG1 3.02Å; Q56-T59 PolarHBondContact O-N 3.32Å; K57-T59 VanDerWaalsContact C-N 3.35Å; K57-T59 PolarHBondContact O-N 3.49Å; T59-T62 PolarHBondContact O-N 3.32Å; T59-Q63 PolarHBondContact O-N 3.2Å; T59-L95 HydrophobicContact CG2-CB 4.25Å; T59-L95 HydrophobicContact CG2-CD2 3.73Å; T59-K98 HydrophobicContact CG2-CB 4.32Å; T59-K98 HydrophobicContact CG2-CD 4.07Å; T59-K98 HydrophobicContact CG2-CG 4.26Å; T59-Q99 HydrophobicContact CG2-CG 3.68Å
60	K	94.2	Very high	94.4	Very high	94 Å²	94	76.6 Å²	76.6	41%	0.409	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-42.7	174.9	-76.3	176	175.9	174.7	0	112.8	Q56 K57 H58 Q63 A64 Q99	Q56-K60 HydrophobicContact CG-CD 4.42Å; Q56-K60 WeakPolarHBondContact O-CB 3.16Å; Q56-K60 WeakPolarHBondContact O-CG 3.46Å; Q56-K60 PolarHBondContact O-N 3.45Å; K57-K60 PolarHBondContact O-N 3.45Å; H58-K60 VanDerWaalsContact C-N 3.33Å; H58-K60 PolarHBondContact O-N 2.97Å; K60-Q63 PolarHBondContact O-N 3.36Å; K60-A64 WeakPolarHBondContact O-CB 3.33Å; K60-A64 PolarHBondContact O-N 3.05Å; K60-Q99 VanDerWaalsContact CG-OE1 3.27Å
61	L	96.1	Very high	93.8	Very high	117 Å²	117	74.9 Å²	74.9	61%	0.613	40%	0.402	S	S	*	.	H	α-helix	trans	-62.7	-47.4	175.1	-71.3	170.5	0	0	0	110.9	K57 H58 Q63 A64 E65	K57-L61 WeakPolarHBondContact O-CG 3.37Å; K57-L61 PolarHBondContact O-N 3.39Å; H58-L61 PolarHBondContact O-N 2.85Å; L61-Q63 VanDerWaalsContact C-N 3.33Å; L61-Q63 PolarHBondContact O-N 3.19Å; L61-A64 PolarHBondContact O-N 2.93Å; L61-E65 WeakPolarHBondContact O-CG 3.49Å; L61-E65 PolarHBondContact O-N 3.43Å
62	T	94	Very high	93.4	Very high	48 Å²	48	76.8 Å²	76.8	29%	0.294	42%	0.416	S	S	.	.	H	α-helix	trans	-58.7	-43.7	177.3	-53.8	0	0	0	0	112.1	H58 T59 E65 I66 L95	H58-T62 PolarHBondContact CE1-OG1 2.66Å; H58-T62 PolarHBondContact ND1-OG1 2.78Å; H58-T62 PolarHBondContact O-N 3.11Å; H58-T62 PolarHBondContact O-OG1 2.93Å; T59-T62 PolarHBondContact O-N 3.32Å; T62-E65 PolarHBondContact O-N 3.4Å; T62-I66 HydrophobicContact CG2-CD1 3.78Å; T62-I66 WeakPolarHBondContact O-CD1 3.49Å; T62-I66 WeakPolarHBondContact O-CG1 3.34Å; T62-I66 PolarHBondContact O-N 2.88Å; T62-L95 HydrophobicContact CG2-CD1 4.26Å; T62-L95 HydrophobicContact CG2-CD2 4.33Å
63	Q	93.4	Very high	93.1	Very high	42 Å²	42	77.3 Å²	77.3	20%	0.196	42%	0.421	C	S	.	.	H	α-helix	trans	-65	-39.8	177.4	-170.1	175.1	38.7	0	0	112.1	T59 K60 L61 I66 S67 L95 T96	T59-Q63 PolarHBondContact O-N 3.2Å; K60-Q63 PolarHBondContact O-N 3.36Å; L61-Q63 VanDerWaalsContact C-N 3.33Å; L61-Q63 PolarHBondContact O-N 3.19Å; Q63-I66 PolarHBondContact O-N 3.38Å; Q63-S67 WeakPolarHBondContact O-CB 3.29Å; Q63-S67 PolarHBondContact O-N 2.99Å; Q63-S67 PolarHBondContact O-OG 3.48Å; Q63-L95 HydrophobicContact CB-CB 4.47Å; Q63-L95 HydrophobicContact CB-CD1 4.05Å; Q63-L95 HydrophobicContact CG-CD1 4.43Å; Q63-T96 PolarHBondContact NE2-OG1 2.76Å; Q63-T96 VanDerWaalsContact NE2-OG1 3.12Å
64	A	94.4	Very high	92.9	Very high	55 Å²	55	85.3 Å²	85.3	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-61.7	-44.9	176	0	0	0	0	0	111.5	K60 L61 S67 T68	K60-A64 WeakPolarHBondContact O-CB 3.33Å; K60-A64 PolarHBondContact O-N 3.05Å; L61-A64 PolarHBondContact O-N 2.93Å; A64-S67 WeakPolarHBondContact O-CB 3.49Å; A64-S67 PolarHBondContact O-N 3.31Å; A64-T68 WeakPolarHBondContact O-CG2 3.34Å; A64-T68 PolarHBondContact O-N 3.44Å
65	E	93.3	Very high	92.7	Very high	129 Å²	129	80 Å²	80	60%	0.603	43%	0.427	S	S	*	.	H	α-helix	trans	-61.4	-47.8	176.5	-67.5	-62.6	156	0	0	111.6	L61 T62 S67 T68	L61-E65 WeakPolarHBondContact O-CG 3.49Å; L61-E65 PolarHBondContact O-N 3.43Å; T62-E65 PolarHBondContact O-N 3.4Å; E65-S67 VanDerWaalsContact C-N 3.28Å; E65-S67 PolarHBondContact O-N 2.96Å; E65-T68 PolarHBondContact O-N 3.37Å; E65-T68 VanDerWaalsContact O-N 3.14Å; E65-T68 PolarHBondContact O-OG1 3.34Å
66	I	91.6	Very high	92.7	Very high	20 Å²	20	84.9 Å²	84.9	10%	0.103	44%	0.441	C	S	.	.	H	α-helix	trans	-62.7	-37.2	178.6	-70.6	162.1	0	0	0	111.6	T62 Q63 T68 L69 L75 K88 I91 L95	T62-I66 HydrophobicContact CG2-CD1 3.78Å; T62-I66 WeakPolarHBondContact O-CD1 3.49Å; T62-I66 WeakPolarHBondContact O-CG1 3.34Å; T62-I66 PolarHBondContact O-N 2.88Å; Q63-I66 PolarHBondContact O-N 3.38Å; I66-T68 PolarHBondContact O-N 2.9Å; I66-L69 WeakPolarHBondContact O-CB 3.47Å; I66-L69 PolarHBondContact O-N 3.23Å; I66-L75 HydrophobicContact CG1-CD1 4.29Å; I66-L75 HydrophobicContact CG2-CD1 3.74Å; I66-K88 HydrophobicContact CG2-CD 4.49Å; I66-K88 HydrophobicContact CG2-CG 3.95Å; I66-K88 WeakPolarHBondContact O-CE 3.44Å; I66-K88 PolarHBondContact O-NZ 3.39Å; I66-I91 HydrophobicContact CD1-CG2 3.65Å; I66-L95 HydrophobicContact CD1-CD1 3.52Å
67	S	90.8	Very high	92.5	Very high	68 Å²	68	85.5 Å²	85.5	48%	0.476	44%	0.444	S	S	.	.	H	α-helix	trans	-58.7	-32.2	178.1	-65.1	0	0	0	0	112.2	Q63 A64 E65 L69 K88	Q63-S67 WeakPolarHBondContact O-CB 3.29Å; Q63-S67 PolarHBondContact O-N 2.99Å; Q63-S67 PolarHBondContact O-OG 3.48Å; A64-S67 WeakPolarHBondContact O-CB 3.49Å; A64-S67 PolarHBondContact O-N 3.31Å; E65-S67 VanDerWaalsContact C-N 3.28Å; E65-S67 PolarHBondContact O-N 2.96Å; S67-L69 VanDerWaalsContact C-N 3.27Å; S67-L69 PolarHBondContact O-N 3.43Å; S67-K88 PolarHBondContact O-NZ 2.9Å; S67-K88 VanDerWaalsContact O-NZ 3.15Å
68	T	92.9	Very high	92.3	Very high	105 Å²	105	80.8 Å²	80.8	64%	0.644	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-18	177.8	73.1	0	0	0	0	114.2	A64 E65 I66	A64-T68 WeakPolarHBondContact O-CG2 3.34Å; A64-T68 PolarHBondContact O-N 3.44Å; E65-T68 PolarHBondContact O-N 3.37Å; E65-T68 VanDerWaalsContact O-N 3.14Å; E65-T68 PolarHBondContact O-OG1 3.34Å; I66-T68 PolarHBondContact O-N 2.9Å
69	L	91.3	Very high	92.2	Very high	62 Å²	62	78.6 Å²	78.6	33%	0.325	43%	0.432	S	S	.	.	S	Bend	trans	-77.4	147.9	-177.4	-58.7	176.3	0	0	0	111.5	I66 S67 T73 L75 K88	I66-L69 WeakPolarHBondContact O-CB 3.47Å; I66-L69 PolarHBondContact O-N 3.23Å; S67-L69 VanDerWaalsContact C-N 3.27Å; S67-L69 PolarHBondContact O-N 3.43Å; L69-T73 HydrophobicContact CD1-CG2 4.44Å; L69-L75 HydrophobicContact CD1-CD2 3.74Å; L69-K88 PolarHBondContact O-NZ 2.92Å
70	P	92	Very high	92.1	Very high	92 Å²	92	82.6 Å²	82.6	60%	0.597	47%	0.473	S	S	*	.			trans	-54.9	144.6	173.3	-23.5	32.5	0	0	0	112	N72 T73	P70-N72 PolarHBondContact O-N 2.94Å; P70-N72 VanDerWaalsContact O-N 3.17Å; P70-T73 WeakPolarHBondContact CD-OG1 3.47Å; P70-T73 VanDerWaalsContact O-CB 3.26Å; P70-T73 WeakPolarHBondContact O-CB 3.48Å; P70-T73 PolarHBondContact O-N 3.5Å; P70-T73 PolarHBondContact O-OG1 3.02Å
71	A	85.4	Confident	92.1	Very high	70 Å²	70	89.9 Å²	89.9	58%	0.579	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-34.9	-175.8	0	0	0	0	0	113.7	T73	A71-T73 PolarHBondContact O-N 3.3Å
72	N	87.9	Confident	92.1	Very high	161 Å²	161	90.7 Å²	90.7	86%	0.861	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	16	-178.8	-159.9	28.7	0	0	0	114	P70	P70-N72 PolarHBondContact O-N 2.94Å; P70-N72 VanDerWaalsContact O-N 3.17Å
73	T	91.6	Very high	92.1	Very high	44 Å²	44	95.9 Å²	95.9	27%	0.27	52%	0.519	S	S	.	.			trans	-81.1	121.7	179.9	-52.7	0	0	0	0	109.3	L69 P70 A71 L75	L69-T73 HydrophobicContact CD1-CG2 4.44Å; P70-T73 WeakPolarHBondContact CD-OG1 3.47Å; P70-T73 VanDerWaalsContact O-CB 3.26Å; P70-T73 WeakPolarHBondContact O-CB 3.48Å; P70-T73 PolarHBondContact O-N 3.5Å; P70-T73 PolarHBondContact O-OG1 3.02Å; A71-T73 PolarHBondContact O-N 3.3Å; T73-L75 HydrophobicContact CG2-CD2 3.98Å
74	R	90.7	Very high	92.2	Very high	185 Å²	185	96.9 Å²	96.9	70%	0.698	53%	0.528	S	S	*	.			trans	-80.9	132.9	171.9	-59.1	-164.8	-73.8	-170.3	-6	110.1	L85	R74-L85 HydrophobicContact CB-CD1 3.62Å
75	L	93.2	Very high	92.2	Very high	24 Å²	24	97.8 Å²	97.8	13%	0.126	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.6	-174.4	-61.5	176	0	0	0	110.5	I66 L69 T73 L85 Q86 K88 I91	I66-L75 HydrophobicContact CG1-CD1 4.29Å; I66-L75 HydrophobicContact CG2-CD1 3.74Å; L69-L75 HydrophobicContact CD1-CD2 3.74Å; T73-L75 HydrophobicContact CG2-CD2 3.98Å; L75-L85 WeakPolarHBondContact O-CA 3.43Å; L75-Q86 PolarHBondContact N-O 3.01Å; L75-Q86 VanDerWaalsContact N-O 3.08Å; L75-Q86 PolarHBondContact O-N 2.94Å; L75-K88 HydrophobicContact CD1-CB 4.42Å; L75-K88 HydrophobicContact CD1-CG 4.39Å; L75-I91 HydrophobicContact CB-CD1 3.32Å; L75-I91 HydrophobicContact CB-CG1 4.47Å; L75-I91 HydrophobicContact CD1-CB 4.43Å; L75-I91 HydrophobicContact CD1-CD1 3.87Å; L75-I91 HydrophobicContact CG-CD1 4.24Å
76	Y	93.8	Very high	92.2	Very high	155 Å²	155	93.7 Å²	93.7	61%	0.608	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.4	178.1	-70.6	-87.8	0	0	0	110.3	F83 V84 L85	Y76-F83 HydrophobicContact CD1-CB 4.23Å; Y76-V84 CarbonylContact C-O 3.57Å; Y76-V84 VanDerWaalsContact CA-O 3.29Å; Y76-V84 WeakPolarHBondContact CA-O 3.46Å; Y76-L85 HydrophobicContact CD1-CB 4.28Å; Y76-L85 HydrophobicContact CD1-CD1 4.25Å; Y76-L85 HydrophobicContact CD2-CD1 4.42Å; Y76-L85 HydrophobicContact CE1-CB 3.98Å; Y76-L85 HydrophobicContact CE1-CD1 3.79Å; Y76-L85 HydrophobicContact CE1-CG 4.48Å; Y76-L85 HydrophobicContact CE2-CD1 3.97Å
77	E	91.4	Very high	92.3	Very high	52 Å²	52	94.6 Å²	94.6	24%	0.243	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	128.8	172.9	-169	-159.2	170.4	0	0	110	V79 F83 V84 Q86 L94	E77-V79 PolarHBondContact O-N 3.29Å; E77-F83 CarbonylContact O-C 3.54Å; E77-F83 WeakPolarHBondContact O-CA 3.36Å; E77-V84 PolarHBondContact N-O 2.9Å; E77-V84 PolarHBondContact O-N 3.32Å; E77-Q86 VanDerWaalsContact CB-OE1 3.3Å; E77-Q86 PolarHBondContact OE2-NE2 3.3Å; E77-Q86 PolarHBondContact OE2-OE1 2.62Å; E77-Q86 VanDerWaalsContact OE2-OE1 3.12Å; E77-L94 VanDerWaalsContact CD-CD2 3.43Å; E77-L94 HydrophobicContact CG-CD2 4.04Å; E77-L94 WeakPolarHBondContact OE1-CD2 3.45Å
78	G	91.4	Very high	92.3	Very high	48 Å²	48	92.6 Å²	92.6	50%	0.495	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.8	175.3	0	0	0	0	0	112.2	M82	G78-M82 WeakPolarHBondContact CA-O 3.4Å
79	V	91.6	Very high	92.3	Very high	79 Å²	79	92.7 Å²	92.7	48%	0.479	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	92.5	174.2	-174	0	0	0	0	109	E77 R81 M82 V84	E77-V79 PolarHBondContact O-N 3.29Å; V79-R81 PolarHBondContact O-N 3.1Å; V79-R81 VanDerWaalsContact O-N 3.13Å; V79-M82 PolarHBondContact N-O 3.17Å; V79-M82 PolarHBondContact O-N 2.85Å; V79-V84 HydrophobicContact CG2-CG2 4.18Å
80	G	92.3	Very high	92.3	Very high	84 Å²	84	94.9 Å²	94.9	87%	0.866	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-109.2	-174.8	0	0	0	0	0	112
81	R	94.6	Very high	92.4	Very high	247 Å²	247	91.1 Å²	91.1	93%	0.932	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	3.3	176	-65.4	-176.5	-67.9	-179.9	-1.1	113.2	V79	V79-R81 PolarHBondContact O-N 3.1Å; V79-R81 VanDerWaalsContact O-N 3.13Å
82	M	95.8	Very high	92.7	Very high	135 Å²	135	89.4 Å²	89.4	67%	0.665	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	157.4	-178.9	-63.3	178.3	65.4	0	0	110.5	G78 V79	G78-M82 WeakPolarHBondContact CA-O 3.4Å; V79-M82 PolarHBondContact N-O 3.17Å; V79-M82 PolarHBondContact O-N 2.85Å
83	F	95.4	Very high	93	Very high	156 Å²	156	86.9 Å²	86.9	68%	0.684	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.4	174	-68.9	-82.3	0	0	0	108.9	Y76 E77	Y76-F83 HydrophobicContact CD1-CB 4.23Å; E77-F83 CarbonylContact O-C 3.54Å; E77-F83 WeakPolarHBondContact O-CA 3.36Å
84	V	94.7	Very high	93.1	Very high	63 Å²	63	88.2 Å²	88.2	38%	0.382	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	-177.2	-176.4	0	0	0	0	109	Y76 E77 V79 Q86	Y76-V84 CarbonylContact C-O 3.57Å; Y76-V84 VanDerWaalsContact CA-O 3.29Å; Y76-V84 WeakPolarHBondContact CA-O 3.46Å; E77-V84 PolarHBondContact N-O 2.9Å; E77-V84 PolarHBondContact O-N 3.32Å; V79-V84 HydrophobicContact CG2-CG2 4.18Å; V84-Q86 PolarHBondContact O-N 2.92Å
85	L	95	Very high	93.2	Very high	74 Å²	74	80 Å²	80	39%	0.387	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.5	176.5	-174.5	68.3	0	0	0	109.8	R74 L75 Y76	R74-L85 HydrophobicContact CB-CD1 3.62Å; L75-L85 WeakPolarHBondContact O-CA 3.43Å; Y76-L85 HydrophobicContact CD1-CB 4.28Å; Y76-L85 HydrophobicContact CD1-CD1 4.25Å; Y76-L85 HydrophobicContact CD2-CD1 4.42Å; Y76-L85 HydrophobicContact CE1-CB 3.98Å; Y76-L85 HydrophobicContact CE1-CD1 3.79Å; Y76-L85 HydrophobicContact CE1-CG 4.48Å; Y76-L85 HydrophobicContact CE2-CD1 3.97Å
86	Q	92.8	Very high	93.3	Very high	43 Å²	43	82.1 Å²	82.1	20%	0.201	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	160.5	179.4	-78.7	176.9	-16.8	0	0	111.3	L75 E77 V84 E90 I91	L75-Q86 PolarHBondContact N-O 3.01Å; L75-Q86 VanDerWaalsContact N-O 3.08Å; L75-Q86 PolarHBondContact O-N 2.94Å; E77-Q86 VanDerWaalsContact CB-OE1 3.3Å; E77-Q86 PolarHBondContact OE2-NE2 3.3Å; E77-Q86 PolarHBondContact OE2-OE1 2.62Å; E77-Q86 VanDerWaalsContact OE2-OE1 3.12Å; V84-Q86 PolarHBondContact O-N 2.92Å; Q86-E90 WeakPolarHBondContact CA-OE2 3.35Å; Q86-E90 HydrophobicContact CB-CB 4.39Å; Q86-E90 WeakPolarHBondContact CB-OE2 3.26Å; Q86-I91 HydrophobicContact CB-CD1 4.26Å; Q86-I91 HydrophobicContact CB-CG1 3.94Å
87	S	93.4	Very high	93.4	Very high	40 Å²	40	79.5 Å²	79.5	28%	0.28	43%	0.426	S	S	.	.			trans	-73.9	165.1	170.9	97.9	0	0	0	0	111	E89 E90 I91	S87-E89 VanDerWaalsContact C-N 3.33Å; S87-E89 WeakPolarHBondContact CB-OE2 3.41Å; S87-E89 PolarHBondContact OG-N 2.74Å; S87-E89 PolarHBondContact OG-OE2 3.42Å; S87-E90 PolarHBondContact N-OE2 3.11Å; S87-E90 PolarHBondContact OG-N 3.25Å; S87-I91 PolarHBondContact O-N 3.02Å
88	K	92.1	Very high	93.5	Very high	26 Å²	26	81.8 Å²	81.8	11%	0.113	44%	0.435	C	S	.	.	H	α-helix	trans	-64.5	-42.1	175.6	-176.1	-178.7	176.6	178.5	0	111	I66 S67 L69 L75 E90 I91 D92	I66-K88 HydrophobicContact CG2-CD 4.49Å; I66-K88 HydrophobicContact CG2-CG 3.95Å; I66-K88 WeakPolarHBondContact O-CE 3.44Å; I66-K88 PolarHBondContact O-NZ 3.39Å; S67-K88 PolarHBondContact O-NZ 2.9Å; S67-K88 VanDerWaalsContact O-NZ 3.15Å; L69-K88 PolarHBondContact O-NZ 2.92Å; L75-K88 HydrophobicContact CD1-CB 4.42Å; L75-K88 HydrophobicContact CD1-CG 4.39Å; K88-E90 PolarHBondContact O-N 3.34Å; K88-I91 PolarHBondContact O-N 3.15Å; K88-D92 PolarHBondContact O-N 2.91Å
89	E	91.8	Very high	93.6	Very high	107 Å²	107	80.7 Å²	80.7	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-60.7	-45.5	-179.9	-59.2	74.9	-162	0	0	111.4	S87 I91 D92 D93	S87-E89 VanDerWaalsContact C-N 3.33Å; S87-E89 WeakPolarHBondContact CB-OE2 3.41Å; S87-E89 PolarHBondContact OG-N 2.74Å; S87-E89 PolarHBondContact OG-OE2 3.42Å; E89-I91 VanDerWaalsContact C-N 3.31Å; E89-I91 PolarHBondContact O-N 3.46Å; E89-D92 PolarHBondContact O-N 3.38Å; E89-D93 PolarHBondContact O-N 3.38Å
90	E	92.4	Very high	93.9	Very high	107 Å²	107	83.2 Å²	83.2	50%	0.5	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-40.5	177.7	-67.8	173.4	153.7	0	0	112.1	Q86 S87 K88 L94	Q86-E90 WeakPolarHBondContact CA-OE2 3.35Å; Q86-E90 HydrophobicContact CB-CB 4.39Å; Q86-E90 WeakPolarHBondContact CB-OE2 3.26Å; S87-E90 PolarHBondContact N-OE2 3.11Å; S87-E90 PolarHBondContact OG-N 3.25Å; K88-E90 PolarHBondContact O-N 3.34Å; E90-L94 WeakPolarHBondContact O-CB 3.27Å; E90-L94 PolarHBondContact O-N 3.46Å
91	I	93.3	Very high	94	Very high	13 Å²	13	82.6 Å²	82.6	7%	0.067	40%	0.401	C	S	.	.	H	α-helix	trans	-70.9	-39.7	177.2	-65.5	-166.3	0	0	0	111.5	I66 L75 Q86 S87 K88 E89 D93 L94 L95	I66-I91 HydrophobicContact CD1-CG2 3.65Å; L75-I91 HydrophobicContact CB-CD1 3.32Å; L75-I91 HydrophobicContact CB-CG1 4.47Å; L75-I91 HydrophobicContact CD1-CB 4.43Å; L75-I91 HydrophobicContact CD1-CD1 3.87Å; L75-I91 HydrophobicContact CG-CD1 4.24Å; Q86-I91 HydrophobicContact CB-CD1 4.26Å; Q86-I91 HydrophobicContact CB-CG1 3.94Å; S87-I91 PolarHBondContact O-N 3.02Å; K88-I91 PolarHBondContact O-N 3.15Å; E89-I91 VanDerWaalsContact C-N 3.31Å; E89-I91 PolarHBondContact O-N 3.46Å; I91-D93 VanDerWaalsContact C-N 3.34Å; I91-D93 PolarHBondContact O-N 3.44Å; I91-L94 PolarHBondContact O-N 2.92Å; I91-L95 HydrophobicContact CG2-CD1 3.75Å; I91-L95 HydrophobicContact CG2-CG 4.11Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 VanDerWaalsContact O-CG 3.23Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.39Å
92	D	92.4	Very high	94.1	Very high	35 Å²	35	71.3 Å²	71.3	19%	0.187	36%	0.36	C	S	.	.	H	α-helix	trans	-64	-39.8	177.7	-83	-23.8	0	0	0	111.7	K88 E89 L95 T96	K88-D92 PolarHBondContact O-N 2.91Å; E89-D92 PolarHBondContact O-N 3.38Å; D92-L95 PolarHBondContact O-N 3.11Å; D92-T96 WeakPolarHBondContact O-CB 3.22Å; D92-T96 PolarHBondContact O-N 2.95Å; D92-T96 PolarHBondContact O-OG1 2.94Å
93	D	93.6	Very high	94.1	Very high	108 Å²	108	67.2 Å²	67.2	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-62.7	-47.8	173.5	-75.3	-16.4	0	0	0	110.9	E89 I91 L95 T96 D97	E89-D93 PolarHBondContact O-N 3.38Å; I91-D93 VanDerWaalsContact C-N 3.34Å; I91-D93 PolarHBondContact O-N 3.44Å; D93-L95 PolarHBondContact O-N 3.37Å; D93-T96 WeakPolarHBondContact O-CB 3.3Å; D93-T96 PolarHBondContact O-N 2.82Å; D93-T96 VanDerWaalsContact O-N 3.16Å; D93-D97 PolarHBondContact O-N 3.44Å
94	L	92.8	Very high	94.2	Very high	71 Å²	71	63.4 Å²	63.4	37%	0.372	33%	0.328	S	S	.	.	H	α-helix	trans	-57.2	-45.7	176.3	178.6	74.6	0	0	0	112.3	E77 E90 I91 T96 K98	E77-L94 VanDerWaalsContact CD-CD2 3.43Å; E77-L94 HydrophobicContact CG-CD2 4.04Å; E77-L94 WeakPolarHBondContact OE1-CD2 3.45Å; E90-L94 WeakPolarHBondContact O-CB 3.27Å; E90-L94 PolarHBondContact O-N 3.46Å; I91-L94 PolarHBondContact O-N 2.92Å; L94-T96 VanDerWaalsContact C-N 3.31Å; L94-K98 VanDerWaalsContact O-CB 3.27Å; L94-K98 WeakPolarHBondContact O-CB 3.42Å; L94-K98 PolarHBondContact O-N 2.98Å
95	L	93.8	Very high	94.3	Very high	14 Å²	14	65.4 Å²	65.4	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-67.7	-33.9	179.3	-69.8	172.3	0	0	0	111.8	T59 T62 Q63 I66 I91 D92 D93 Q99	T59-L95 HydrophobicContact CG2-CB 4.25Å; T59-L95 HydrophobicContact CG2-CD2 3.73Å; T62-L95 HydrophobicContact CG2-CD1 4.26Å; T62-L95 HydrophobicContact CG2-CD2 4.33Å; Q63-L95 HydrophobicContact CB-CB 4.47Å; Q63-L95 HydrophobicContact CB-CD1 4.05Å; Q63-L95 HydrophobicContact CG-CD1 4.43Å; I66-L95 HydrophobicContact CD1-CD1 3.52Å; I91-L95 HydrophobicContact CG2-CD1 3.75Å; I91-L95 HydrophobicContact CG2-CG 4.11Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 VanDerWaalsContact O-CG 3.23Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.39Å; D92-L95 PolarHBondContact O-N 3.11Å; D93-L95 PolarHBondContact O-N 3.37Å; L95-Q99 WeakPolarHBondContact O-CG 3.45Å; L95-Q99 PolarHBondContact O-N 3.46Å; L95-Q99 PolarHBondContact O-NE2 3.41Å
96	T	94.6	Very high	94.4	Very high	67 Å²	67	62.9 Å²	62.9	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-68.9	-46.6	176.3	-60.1	0	0	0	0	110.9	Q63 D92 D93 L94 K98 Q99 K100	Q63-T96 PolarHBondContact NE2-OG1 2.76Å; Q63-T96 VanDerWaalsContact NE2-OG1 3.12Å; D92-T96 WeakPolarHBondContact O-CB 3.22Å; D92-T96 PolarHBondContact O-N 2.95Å; D92-T96 PolarHBondContact O-OG1 2.94Å; D93-T96 WeakPolarHBondContact O-CB 3.3Å; D93-T96 PolarHBondContact O-N 2.82Å; D93-T96 VanDerWaalsContact O-N 3.16Å; L94-T96 VanDerWaalsContact C-N 3.31Å; T96-K98 VanDerWaalsContact C-N 3.32Å; T96-K98 PolarHBondContact O-N 3.08Å; T96-Q99 WeakPolarHBondContact O-CB 3.21Å; T96-Q99 PolarHBondContact O-N 3.25Å; T96-K100 PolarHBondContact O-N 3.32Å
97	D	95.6	Very high	94.6	Very high	100 Å²	100	66.1 Å²	66.1	54%	0.535	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-39.5	175.8	-81.5	-14	0	0	0	112.1	D93 K100 T101	D93-D97 PolarHBondContact O-N 3.44Å; D97-K100 PolarHBondContact O-N 3.24Å; D97-T101 WeakPolarHBondContact O-CB 3.42Å; D97-T101 PolarHBondContact O-N 3.22Å; D97-T101 PolarHBondContact O-OG1 2.88Å
98	K	94.4	Very high	94.7	Very high	100 Å²	100	70.3 Å²	70.3	44%	0.435	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-43	174.5	-174.3	174.8	-179.2	178.4	0	111.8	T59 L94 T96 T101 V102	T59-K98 HydrophobicContact CG2-CB 4.32Å; T59-K98 HydrophobicContact CG2-CD 4.07Å; T59-K98 HydrophobicContact CG2-CG 4.26Å; L94-K98 VanDerWaalsContact O-CB 3.27Å; L94-K98 WeakPolarHBondContact O-CB 3.42Å; L94-K98 PolarHBondContact O-N 2.98Å; T96-K98 VanDerWaalsContact C-N 3.32Å; T96-K98 PolarHBondContact O-N 3.08Å; K98-T101 PolarHBondContact O-N 3.41Å; K98-V102 VanDerWaalsContact O-CG2 3.28Å; K98-V102 WeakPolarHBondContact O-CG2 3.46Å; K98-V102 PolarHBondContact O-N 3.3Å
99	Q	94.4	Very high	95	Very high	26 Å²	26	70.1 Å²	70.1	12%	0.121	35%	0.346	C	S	.	.	H	α-helix	trans	-62.4	-47.6	175.5	-79.1	174	72.7	0	0	111.7	T59 K60 L95 T96 T101 V102 D103	T59-Q99 HydrophobicContact CG2-CG 3.68Å; K60-Q99 VanDerWaalsContact CG-OE1 3.27Å; L95-Q99 WeakPolarHBondContact O-CG 3.45Å; L95-Q99 PolarHBondContact O-N 3.46Å; L95-Q99 PolarHBondContact O-NE2 3.41Å; T96-Q99 WeakPolarHBondContact O-CB 3.21Å; T96-Q99 PolarHBondContact O-N 3.25Å; Q99-T101 VanDerWaalsContact C-N 3.33Å; Q99-T101 PolarHBondContact O-N 3.47Å; Q99-V102 PolarHBondContact O-N 3.06Å; Q99-D103 PolarHBondContact O-N 3.02Å
100	K	96.3	Very high	95.2	Very high	131 Å²	131	69.7 Å²	69.7	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-58.4	-46	178	-173.9	-179.9	177.9	-174.5	0	111.7	T96 D97 V102 D103 D104	T96-K100 PolarHBondContact O-N 3.32Å; D97-K100 PolarHBondContact O-N 3.24Å; K100-V102 VanDerWaalsContact C-N 3.3Å; K100-V102 PolarHBondContact O-N 3.32Å; K100-D103 PolarHBondContact O-N 3.07Å; K100-D104 WeakPolarHBondContact O-CB 3.34Å; K100-D104 VanDerWaalsContact O-CG 3.32Å; K100-D104 PolarHBondContact O-N 3.35Å
101	T	96.2	Very high	95.4	Very high	71 Å²	71	71.2 Å²	71.2	44%	0.436	35%	0.352	S	S	.	.	H	α-helix	trans	-60.3	-40.1	177.7	-59.5	0	0	0	0	112.2	D97 K98 Q99 K105	D97-T101 WeakPolarHBondContact O-CB 3.42Å; D97-T101 PolarHBondContact O-N 3.22Å; D97-T101 PolarHBondContact O-OG1 2.88Å; K98-T101 PolarHBondContact O-N 3.41Å; Q99-T101 VanDerWaalsContact C-N 3.33Å; Q99-T101 PolarHBondContact O-N 3.47Å; T101-K105 HydrophobicContact CG2-CD 4.39Å; T101-K105 VanDerWaalsContact O-CG 3.31Å; T101-K105 WeakPolarHBondContact O-CG 3.35Å; T101-K105 PolarHBondContact O-N 2.88Å
102	V	96.1	Very high	95.4	Very high	10 Å²	10	76.2 Å²	76.2	6%	0.061	37%	0.373	C	S	.	.	H	α-helix	trans	-69.1	-43.5	177.3	170.3	0	0	0	0	110.9	L52 V55 Q56 K98 Q99 K100 K105 I106	L52-V102 HydrophobicContact CB-CG1 4.1Å; L52-V102 HydrophobicContact CD2-CG1 4.28Å; L52-V102 HydrophobicContact CD2-CG2 4.41Å; L52-V102 WeakPolarHBondContact O-CG1 3.36Å; V55-V102 HydrophobicContact CG1-CG2 4.05Å; Q56-V102 HydrophobicContact CB-CG1 3.84Å; Q56-V102 HydrophobicContact CG-CG1 4.27Å; K98-V102 VanDerWaalsContact O-CG2 3.28Å; K98-V102 WeakPolarHBondContact O-CG2 3.46Å; K98-V102 PolarHBondContact O-N 3.3Å; Q99-V102 PolarHBondContact O-N 3.06Å; K100-V102 VanDerWaalsContact C-N 3.3Å; K100-V102 PolarHBondContact O-N 3.32Å; V102-K105 PolarHBondContact O-N 2.9Å; V102-I106 HydrophobicContact CG1-CD1 3.96Å; V102-I106 WeakPolarHBondContact O-CG1 3.31Å; V102-I106 PolarHBondContact O-N 3.42Å
103	D	96.1	Very high	95.6	Very high	50 Å²	50	77.2 Å²	77.2	27%	0.267	38%	0.376	S	S	.	.	H	α-helix	trans	-62.1	-43.8	178.3	-78.6	8.3	0	0	0	111.9	Q56 Q99 K100 I106 K107	Q56-D103 PolarHBondContact NE2-OD1 2.77Å; Q99-D103 PolarHBondContact O-N 3.02Å; K100-D103 PolarHBondContact O-N 3.07Å; D103-I106 PolarHBondContact O-N 3.39Å; D103-K107 WeakPolarHBondContact O-CG 3.22Å; D103-K107 PolarHBondContact O-N 3.12Å
104	D	97.2	Very high	95.7	Very high	76 Å²	76	76.4 Å²	76.4	41%	0.406	37%	0.374	S	S	.	.	H	α-helix	trans	-65.6	-39.6	179	-69.6	-19.5	0	0	0	111.3	K100 K107 E108	K100-D104 WeakPolarHBondContact O-CB 3.34Å; K100-D104 VanDerWaalsContact O-CG 3.32Å; K100-D104 PolarHBondContact O-N 3.35Å; D104-K107 PolarHBondContact O-N 2.81Å; D104-K107 IonicContact OD1-NZ 3.51Å; D104-E108 WeakPolarHBondContact O-CB 3.37Å; D104-E108 PolarHBondContact O-N 3.04Å
105	K	96.3	Very high	95.8	Very high	104 Å²	104	80.6 Å²	80.6	45%	0.452	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-39.7	173.8	-76.2	174.5	-179.5	177.6	0	112.9	L52 T101 V102 E108 L109	L52-K105 HydrophobicContact CD1-CB 3.87Å; T101-K105 HydrophobicContact CG2-CD 4.39Å; T101-K105 VanDerWaalsContact O-CG 3.31Å; T101-K105 WeakPolarHBondContact O-CG 3.35Å; T101-K105 PolarHBondContact O-N 2.88Å; V102-K105 PolarHBondContact O-N 2.9Å; K105-E108 PolarHBondContact O-N 3.36Å; K105-L109 WeakPolarHBondContact O-CG 3.3Å; K105-L109 PolarHBondContact O-N 3.34Å
106	I	96.6	Very high	95.8	Very high	22 Å²	22	81 Å²	81	11%	0.113	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-48.7	175.8	-71.7	169.5	0	0	0	109.6	I49 L52 V102 D103 E108 L109 E110	I49-I106 HydrophobicContact CG2-CG2 4.4Å; L52-I106 HydrophobicContact CB-CD1 3.98Å; L52-I106 HydrophobicContact CB-CG1 3.75Å; L52-I106 HydrophobicContact CD1-CG1 4.06Å; V102-I106 HydrophobicContact CG1-CD1 3.96Å; V102-I106 WeakPolarHBondContact O-CG1 3.31Å; V102-I106 PolarHBondContact O-N 3.42Å; D103-I106 PolarHBondContact O-N 3.39Å; I106-E108 VanDerWaalsContact C-N 3.32Å; I106-E108 PolarHBondContact O-N 3.23Å; I106-L109 PolarHBondContact O-N 3.46Å; I106-E110 HydrophobicContact CG2-CG 4.36Å; I106-E110 WeakPolarHBondContact O-CG 3.45Å; I106-E110 PolarHBondContact O-N 2.96Å
107	K	97.1	Very high	95.7	Very high	110 Å²	110	82.3 Å²	82.3	48%	0.478	39%	0.39	S	S	.	.	H	α-helix	trans	-58.7	-42.7	177.7	-70	170	-170.3	162.9	0	112.2	D103 D104 E110 Q111	D103-K107 WeakPolarHBondContact O-CG 3.22Å; D103-K107 PolarHBondContact O-N 3.12Å; D104-K107 PolarHBondContact O-N 2.81Å; D104-K107 IonicContact OD1-NZ 3.51Å; K107-E110 PolarHBondContact O-N 2.97Å; K107-Q111 WeakPolarHBondContact O-CB 3.48Å; K107-Q111 VanDerWaalsContact O-CG 3.27Å; K107-Q111 WeakPolarHBondContact O-CG 3.4Å; K107-Q111 PolarHBondContact O-N 2.91Å
108	E	96.8	Very high	95.7	Very high	128 Å²	128	85.3 Å²	85.3	60%	0.598	39%	0.394	S	S	*	.	H	α-helix	trans	-60.7	-45	177.3	-171	-171.4	160.5	0	0	111.5	D104 K105 I106 Q111 K112	D104-E108 WeakPolarHBondContact O-CB 3.37Å; D104-E108 PolarHBondContact O-N 3.04Å; K105-E108 PolarHBondContact O-N 3.36Å; I106-E108 VanDerWaalsContact C-N 3.32Å; I106-E108 PolarHBondContact O-N 3.23Å; E108-Q111 PolarHBondContact O-N 3.08Å; E108-K112 WeakPolarHBondContact O-CB 3.4Å; E108-K112 PolarHBondContact O-N 3.39Å
109	L	96.7	Very high	95.6	Very high	22 Å²	22	81.6 Å²	81.6	12%	0.115	38%	0.38	C	S	.	.	H	α-helix	trans	-65.9	-40.5	177.9	-71.4	171.1	0	0	0	112.4	A45 Q48 I49 L52 K105 I106 K112 K113	A45-L109 HydrophobicContact CB-CD2 4.37Å; Q48-L109 HydrophobicContact CB-CD1 3.69Å; I49-L109 HydrophobicContact CD1-CB 3.95Å; I49-L109 HydrophobicContact CG1-CB 3.81Å; I49-L109 HydrophobicContact CG1-CD1 3.99Å; L52-L109 HydrophobicContact CD1-CD1 3.8Å; K105-L109 WeakPolarHBondContact O-CG 3.3Å; K105-L109 PolarHBondContact O-N 3.34Å; I106-L109 PolarHBondContact O-N 3.46Å; L109-K112 PolarHBondContact O-N 2.98Å; L109-K113 WeakPolarHBondContact O-CB 3.46Å; L109-K113 PolarHBondContact O-N 2.9Å
110	E	96	Very high	95.6	Very high	98 Å²	98	81 Å²	81	46%	0.458	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-46.3	175.1	-73.6	177.8	164.7	0	0	111.5	I49 I106 K107 K112 K113 V114	I49-E110 HydrophobicContact CD1-CG 3.92Å; I106-E110 HydrophobicContact CG2-CG 4.36Å; I106-E110 WeakPolarHBondContact O-CG 3.45Å; I106-E110 PolarHBondContact O-N 2.96Å; K107-E110 PolarHBondContact O-N 2.97Å; E110-K112 VanDerWaalsContact C-N 3.33Å; E110-K112 PolarHBondContact O-N 3.14Å; E110-K113 WeakPolarHBondContact O-CB 3.35Å; E110-K113 PolarHBondContact O-N 3.02Å; E110-V114 WeakPolarHBondContact O-CG2 3.37Å; E110-V114 PolarHBondContact O-N 3.37Å
111	Q	96.4	Very high	95.5	Very high	139 Å²	139	80.9 Å²	80.9	65%	0.65	38%	0.378	S	S	*	.	H	α-helix	trans	-60.6	-43.4	175.8	-74.2	175.8	0.2	0	0	111.7	K107 E108 K113 V114 Y115	K107-Q111 WeakPolarHBondContact O-CB 3.48Å; K107-Q111 VanDerWaalsContact O-CG 3.27Å; K107-Q111 WeakPolarHBondContact O-CG 3.4Å; K107-Q111 PolarHBondContact O-N 2.91Å; E108-Q111 PolarHBondContact O-N 3.08Å; Q111-K113 VanDerWaalsContact C-N 3.32Å; Q111-K113 PolarHBondContact O-N 3.24Å; Q111-V114 PolarHBondContact O-N 3.19Å; Q111-Y115 WeakPolarHBondContact O-CB 3.49Å; Q111-Y115 PolarHBondContact O-N 3.37Å
112	K	94.8	Very high	95.4	Very high	118 Å²	118	82.2 Å²	82.2	51%	0.513	38%	0.379	S	S	.	.	H	α-helix	trans	-61.9	-40.1	177.2	-173.9	175.8	-177.4	175.3	0	111.9	E108 L109 E110 Y115 L116	E108-K112 WeakPolarHBondContact O-CB 3.4Å; E108-K112 PolarHBondContact O-N 3.39Å; L109-K112 PolarHBondContact O-N 2.98Å; E110-K112 VanDerWaalsContact C-N 3.33Å; E110-K112 PolarHBondContact O-N 3.14Å; K112-Y115 PolarHBondContact O-N 3.49Å; K112-L116 HydrophobicContact CG-CD1 4.26Å; K112-L116 VanDerWaalsContact O-CG 3.26Å; K112-L116 WeakPolarHBondContact O-CG 3.5Å; K112-L116 PolarHBondContact O-N 3.28Å
113	K	95.1	Very high	95.1	Very high	57 Å²	57	82.9 Å²	82.9	25%	0.248	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-51.7	175.7	173.6	175.3	170	175.3	0	111.5	V42 D46 L109 E110 Q111 Y115 L116 E117	V42-K113 HydrophobicContact CG1-CD 4.02Å; V42-K113 HydrophobicContact CG1-CG 4.04Å; V42-K113 HydrophobicContact CG2-CG 4.19Å; D46-K113 IonicContact OD1-NZ 3.36Å; D46-K113 PolarHBondContact OD1-NZ 2.79Å; D46-K113 IonicContact OD2-NZ 2.66Å; L109-K113 WeakPolarHBondContact O-CB 3.46Å; L109-K113 PolarHBondContact O-N 2.9Å; E110-K113 WeakPolarHBondContact O-CB 3.35Å; E110-K113 PolarHBondContact O-N 3.02Å; Q111-K113 VanDerWaalsContact C-N 3.32Å; Q111-K113 PolarHBondContact O-N 3.24Å; K113-Y115 VanDerWaalsContact C-N 3.27Å; K113-Y115 PolarHBondContact O-N 3.35Å; K113-L116 PolarHBondContact O-N 3.42Å; K113-L116 VanDerWaalsContact O-N 3.15Å; K113-E117 WeakPolarHBondContact CE-OE1 3.49Å; K113-E117 WeakPolarHBondContact O-CG 3.26Å; K113-E117 PolarHBondContact O-N 3.2Å
114	V	95.6	Very high	94.9	Very high	91 Å²	91	84 Å²	84	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-58.4	-41.2	178.1	173.9	0	0	0	0	111.2	E110 Q111 R118	E110-V114 WeakPolarHBondContact O-CG2 3.37Å; E110-V114 PolarHBondContact O-N 3.37Å; Q111-V114 PolarHBondContact O-N 3.19Å; V114-R118 VanDerWaalsContact O-CB 3.3Å; V114-R118 WeakPolarHBondContact O-CB 3.47Å; V114-R118 PolarHBondContact O-N 3.39Å
115	Y	95.6	Very high	94.7	Very high	158 Å²	158	83.2 Å²	83.2	62%	0.62	39%	0.385	S	S	*	.	H	α-helix	trans	-61.3	-47	176.3	173.4	-98.2	0	0	0	112.4	Q111 K112 K113 R118 S119	Q111-Y115 WeakPolarHBondContact O-CB 3.49Å; Q111-Y115 PolarHBondContact O-N 3.37Å; K112-Y115 PolarHBondContact O-N 3.49Å; K113-Y115 VanDerWaalsContact C-N 3.27Å; K113-Y115 PolarHBondContact O-N 3.35Å; Y115-R118 PolarHBondContact O-N 2.74Å; Y115-S119 WeakPolarHBondContact O-CB 3Å; Y115-S119 PolarHBondContact O-N 3.32Å
116	L	93.5	Very high	94.4	Very high	24 Å²	24	82.9 Å²	82.9	13%	0.126	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-44.7	179.6	-72.7	169.2	0	0	0	111.7	T38 K41 K112 K113 S119 V120	T38-L116 HydrophobicContact CG2-CB 3.83Å; K41-L116 HydrophobicContact CB-CD1 3.79Å; K41-L116 HydrophobicContact CD-CD1 4.36Å; K41-L116 HydrophobicContact CD-CD2 4.45Å; K112-L116 HydrophobicContact CG-CD1 4.26Å; K112-L116 VanDerWaalsContact O-CG 3.26Å; K112-L116 WeakPolarHBondContact O-CG 3.5Å; K112-L116 PolarHBondContact O-N 3.28Å; K113-L116 PolarHBondContact O-N 3.42Å; K113-L116 VanDerWaalsContact O-N 3.15Å; L116-S119 PolarHBondContact O-N 2.93Å; L116-V120 PolarHBondContact O-N 2.88Å; L116-V120 VanDerWaalsContact O-N 3.08Å
117	E	92.8	Very high	93.9	Very high	93 Å²	93	82.5 Å²	82.5	44%	0.435	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-45.7	176.5	-71.5	172.7	176.4	0	0	111.5	V42 K113 S119 V120 K121	V42-E117 HydrophobicContact CG2-CG 4.44Å; K113-E117 WeakPolarHBondContact CE-OE1 3.49Å; K113-E117 WeakPolarHBondContact O-CG 3.26Å; K113-E117 PolarHBondContact O-N 3.2Å; E117-S119 VanDerWaalsContact C-N 3.34Å; E117-S119 PolarHBondContact O-N 3.32Å; E117-V120 PolarHBondContact O-N 3.3Å; E117-K121 PolarHBondContact O-N 3.31Å; E117-K121 VanDerWaalsContact O-N 3.08Å
118	R	95.5	Very high	93.5	Very high	164 Å²	164	84.4 Å²	84.4	62%	0.619	39%	0.39	S	S	*	.	H	α-helix	trans	-61.2	-42.6	175.5	-177.8	175.8	173.9	168.7	2.6	111.8	V114 Y115 V120 K121 E122	V114-R118 VanDerWaalsContact O-CB 3.3Å; V114-R118 WeakPolarHBondContact O-CB 3.47Å; V114-R118 PolarHBondContact O-N 3.39Å; Y115-R118 PolarHBondContact O-N 2.74Å; R118-V120 VanDerWaalsContact C-N 3.31Å; R118-V120 PolarHBondContact O-N 3.2Å; R118-K121 PolarHBondContact O-N 2.89Å; R118-E122 HydrophobicContact CG-CG 4.33Å; R118-E122 WeakPolarHBondContact CG-OE1 3.43Å; R118-E122 IonicContact CZ-OE1 2.79Å; R118-E122 IonicContact NE-OE1 3.51Å; R118-E122 PolarHBondContact NE-OE1 3.13Å; R118-E122 IonicContact NH2-OE1 3.37Å; R118-E122 WeakPolarHBondContact O-CG 3.47Å; R118-E122 PolarHBondContact O-N 3.1Å
119	S	93.5	Very high	93.1	Very high	22 Å²	22	84.6 Å²	84.6	15%	0.154	39%	0.391	C	S	.	.	H	α-helix	trans	-64.1	-34	-179.8	-164	0	0	0	0	113	K34 Y115 L116 E117 A123	K34-S119 VanDerWaalsContact CE-OG 3.31Å; K34-S119 WeakPolarHBondContact CE-OG 3.42Å; K34-S119 PolarHBondContact NZ-O 2.94Å; K34-S119 PolarHBondContact NZ-OG 3.35Å; Y115-S119 WeakPolarHBondContact O-CB 3Å; Y115-S119 PolarHBondContact O-N 3.32Å; L116-S119 PolarHBondContact O-N 2.93Å; E117-S119 VanDerWaalsContact C-N 3.34Å; E117-S119 PolarHBondContact O-N 3.32Å; S119-A123 PolarHBondContact O-N 3.11Å
120	V	93.3	Very high	92.5	Very high	13 Å²	13	86.9 Å²	86.9	8%	0.079	40%	0.402	C	S	.	.	H	α-helix	trans	-69.8	-48	172.9	172.6	0	0	0	0	110.1	K34 M35 T38 L116 E117 R118 E122 A123 E124	K34-V120 HydrophobicContact CG-CG2 4.44Å; M35-V120 HydrophobicContact CB-CG1 4.49Å; M35-V120 HydrophobicContact CG-CG1 4.41Å; T38-V120 HydrophobicContact CG2-CG2 3.61Å; T38-V120 WeakPolarHBondContact OG1-CG2 3.32Å; L116-V120 PolarHBondContact O-N 2.88Å; L116-V120 VanDerWaalsContact O-N 3.08Å; E117-V120 PolarHBondContact O-N 3.3Å; R118-V120 VanDerWaalsContact C-N 3.31Å; R118-V120 PolarHBondContact O-N 3.2Å; V120-E122 VanDerWaalsContact C-N 3.33Å; V120-E122 PolarHBondContact O-N 3.02Å; V120-A123 WeakPolarHBondContact O-CB 3.46Å; V120-A123 PolarHBondContact O-N 3.37Å; V120-E124 HydrophobicContact CG1-CG 4.32Å; V120-E124 WeakPolarHBondContact O-CG 3.35Å; V120-E124 PolarHBondContact O-N 3.04Å
121	K	94.4	Very high	91.9	Very high	128 Å²	128	85.5 Å²	85.5	56%	0.557	40%	0.398	S	S	*	.	H	α-helix	trans	-58	-43.7	179.4	-171.2	-180	178.3	-175.9	0	112.6	E117 R118 A123 E124 D125	E117-K121 PolarHBondContact O-N 3.31Å; E117-K121 VanDerWaalsContact O-N 3.08Å; R118-K121 PolarHBondContact O-N 2.89Å; K121-A123 VanDerWaalsContact C-N 3.29Å; K121-A123 PolarHBondContact O-N 3Å; K121-E124 WeakPolarHBondContact O-CB 3.36Å; K121-E124 PolarHBondContact O-N 3.46Å; K121-D125 WeakPolarHBondContact O-CB 3.45Å; K121-D125 PolarHBondContact O-N 3.35Å
122	E	93.4	Very high	91.2	Very high	100 Å²	100	83.5 Å²	83.5	47%	0.467	39%	0.391	S	S	.	.	H	α-helix	trans	-61.4	-37.3	175.8	-73.6	171.9	179.1	0	0	112.2	R118 V120 N126	R118-E122 HydrophobicContact CG-CG 4.33Å; R118-E122 WeakPolarHBondContact CG-OE1 3.43Å; R118-E122 IonicContact CZ-OE1 2.79Å; R118-E122 IonicContact NE-OE1 3.51Å; R118-E122 PolarHBondContact NE-OE1 3.13Å; R118-E122 IonicContact NH2-OE1 3.37Å; R118-E122 WeakPolarHBondContact O-CG 3.47Å; R118-E122 PolarHBondContact O-N 3.1Å; V120-E122 VanDerWaalsContact C-N 3.33Å; V120-E122 PolarHBondContact O-N 3.02Å; E122-N126 WeakPolarHBondContact O-CB 3.35Å; E122-N126 PolarHBondContact O-N 3.45Å; E122-N126 VanDerWaalsContact O-N 3.1Å
123	A	90.8	Very high	90.4	Very high	23 Å²	23	81.1 Å²	81.1	19%	0.19	39%	0.389	C	S	.	.	H	α-helix	trans	-71.1	-36.3	175.7	0	0	0	0	0	112.4	L31 K34 S119 V120 K121 I127	L31-A123 HydrophobicContact CD1-CB 3.69Å; K34-A123 HydrophobicContact CD-CB 4.35Å; S119-A123 PolarHBondContact O-N 3.11Å; V120-A123 WeakPolarHBondContact O-CB 3.46Å; V120-A123 PolarHBondContact O-N 3.37Å; K121-A123 VanDerWaalsContact C-N 3.29Å; K121-A123 PolarHBondContact O-N 3Å; A123-I127 PolarHBondContact O-N 2.98Å
124	E	91.4	Very high	89.1	Confident	75 Å²	75	84 Å²	84	35%	0.35	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-45.9	173.1	-69.4	-179.1	166.5	0	0	112.1	L31 V120 K121 I127 R128	L31-E124 HydrophobicContact CD1-CG 3.9Å; L31-E124 HydrophobicContact CD2-CG 3.92Å; L31-E124 HydrophobicContact CG-CG 4.48Å; V120-E124 HydrophobicContact CG1-CG 4.32Å; V120-E124 WeakPolarHBondContact O-CG 3.35Å; V120-E124 PolarHBondContact O-N 3.04Å; K121-E124 WeakPolarHBondContact O-CB 3.36Å; K121-E124 PolarHBondContact O-N 3.46Å; E124-I127 PolarHBondContact O-N 3.44Å; E124-R128 WeakPolarHBondContact O-CB 3.39Å; E124-R128 PolarHBondContact O-N 3Å
125	D	92.6	Very high	87.5	Confident	59 Å²	59	90 Å²	90	32%	0.316	41%	0.411	S	S	.	.	H	α-helix	trans	-65.2	-40.9	-179	-74.2	-25.7	0	0	0	111.2	K121 I127 R128 E129	K121-D125 WeakPolarHBondContact O-CB 3.45Å; K121-D125 PolarHBondContact O-N 3.35Å; D125-I127 PolarHBondContact O-N 3.31Å; D125-R128 WeakPolarHBondContact O-CB 3.39Å; D125-R128 PolarHBondContact O-N 3.02Å; D125-R128 VanDerWaalsContact O-N 3.13Å; D125-R128 IonicContact OD1-NH1 3.75Å; D125-E129 WeakPolarHBondContact O-CG 3.48Å; D125-E129 PolarHBondContact O-N 3.43Å
126	N	89.8	Confident	85.6	Confident	97 Å²	97	86.4 Å²	86.4	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-58.8	-45.5	174.7	-167.8	-1.1	0	0	0	111.8	E122 R128 E129 M130	E122-N126 WeakPolarHBondContact O-CB 3.35Å; E122-N126 PolarHBondContact O-N 3.45Å; E122-N126 VanDerWaalsContact O-N 3.1Å; N126-R128 VanDerWaalsContact C-N 3.34Å; N126-R128 PolarHBondContact O-N 2.92Å; N126-E129 PolarHBondContact O-N 2.97Å; N126-M130 WeakPolarHBondContact O-CG 3.48Å; N126-M130 PolarHBondContact O-N 2.95Å
127	I	87.8	Confident	83.2	Confident	13 Å²	13	94.7 Å²	94.7	7%	0.067	45%	0.452	C	S	.	.	H	α-helix	trans	-65.7	-37.7	176.2	-71.1	166.9	0	0	0	111.4	L24 A27 F28 L31 A123 E124 D125 M130 L131	L24-I127 HydrophobicContact CD1-CG2 4.37Å; A27-I127 HydrophobicContact CB-CD1 4.16Å; A27-I127 HydrophobicContact CB-CG1 4.23Å; F28-I127 HydrophobicContact CD1-CG2 4.28Å; F28-I127 HydrophobicContact CD2-CG2 4.29Å; F28-I127 HydrophobicContact CE1-CG2 3.68Å; F28-I127 HydrophobicContact CE2-CG2 3.68Å; F28-I127 HydrophobicContact CZ-CG2 3.33Å; L31-I127 HydrophobicContact CB-CD1 3.66Å; L31-I127 HydrophobicContact CD2-CD1 3.59Å; L31-I127 HydrophobicContact CG-CD1 4.14Å; A123-I127 PolarHBondContact O-N 2.98Å; E124-I127 PolarHBondContact O-N 3.44Å; D125-I127 PolarHBondContact O-N 3.31Å; I127-M130 PolarHBondContact O-N 3.11Å; I127-L131 WeakPolarHBondContact O-CG 3.35Å; I127-L131 PolarHBondContact O-N 2.98Å; I127-L131 VanDerWaalsContact O-N 3.11Å
128	R	88.4	Confident	82.7	Confident	151 Å²	151	94.8 Å²	94.8	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-42.7	175.5	-178.1	-177.3	-104.7	118.8	-2.3	111.4	E124 D125 N126 L131 L132	E124-R128 WeakPolarHBondContact O-CB 3.39Å; E124-R128 PolarHBondContact O-N 3Å; D125-R128 WeakPolarHBondContact O-CB 3.39Å; D125-R128 PolarHBondContact O-N 3.02Å; D125-R128 VanDerWaalsContact O-N 3.13Å; D125-R128 IonicContact OD1-NH1 3.75Å; N126-R128 VanDerWaalsContact C-N 3.34Å; N126-R128 PolarHBondContact O-N 2.92Å; R128-L131 WeakPolarHBondContact O-CB 3.29Å; R128-L131 PolarHBondContact O-N 3.48Å; R128-L132 HydrophobicContact CG-CD1 4.17Å; R128-L132 WeakPolarHBondContact O-CG 3.48Å; R128-L132 PolarHBondContact O-N 3.16Å
129	E	87.8	Confident	82	Confident	132 Å²	132	91.2 Å²	91.2	62%	0.617	44%	0.444	S	S	*	.	H	α-helix	trans	-64.1	-40.9	176	-72.8	-177.8	-179.4	0	0	112.3	D125 N126 L131 L132 S133	D125-E129 WeakPolarHBondContact O-CG 3.48Å; D125-E129 PolarHBondContact O-N 3.43Å; N126-E129 PolarHBondContact O-N 2.97Å; E129-L131 PolarHBondContact O-N 3.35Å; E129-L132 PolarHBondContact O-N 3.46Å; E129-S133 WeakPolarHBondContact O-CB 3.49Å; E129-S133 PolarHBondContact O-N 3.1Å; E129-S133 PolarHBondContact O-OG 3.22Å
130	M	84.1	Confident	81.4	Confident	70 Å²	70	95 Å²	95	35%	0.345	46%	0.46	S	S	.	.	H	α-helix	trans	-58.9	-34.5	172.7	-69	180	77.6	0	0	112.4	L24 N126 I127 S133	L24-M130 HydrophobicContact CD1-CB 4.46Å; N126-M130 WeakPolarHBondContact O-CG 3.48Å; N126-M130 PolarHBondContact O-N 2.95Å; I127-M130 PolarHBondContact O-N 3.11Å; M130-S133 PolarHBondContact O-OG 3.22Å
131	L	82.7	Confident	80.7	Confident	69 Å²	69	99.8 Å²	99.8	36%	0.361	48%	0.482	S	S	.	.	H	α-helix	trans	-75.2	-38.9	176	-71.8	174.4	0	0	0	113.1	L24 F28 I127 R128 E129 R134 R135	L24-L131 HydrophobicContact CD1-CD2 4.46Å; L24-L131 HydrophobicContact CD2-CD2 3.8Å; F28-L131 HydrophobicContact CZ-CD1 4.08Å; I127-L131 WeakPolarHBondContact O-CG 3.35Å; I127-L131 PolarHBondContact O-N 2.98Å; I127-L131 VanDerWaalsContact O-N 3.11Å; R128-L131 WeakPolarHBondContact O-CB 3.29Å; R128-L131 PolarHBondContact O-N 3.48Å; E129-L131 PolarHBondContact O-N 3.35Å; L131-R134 WeakPolarHBondContact O-CB 3.48Å; L131-R134 PolarHBondContact O-N 2.9Å; L131-R135 PolarHBondContact O-N 3.16Å
132	L	82.8	Confident	79.8	Confident	96 Å²	96	98.1 Å²	98.1	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-71.3	-42.7	-178.5	-71.8	173.4	0	0	0	112.1	R128 E129 R134 R135 A136	R128-L132 HydrophobicContact CG-CD1 4.17Å; R128-L132 WeakPolarHBondContact O-CG 3.48Å; R128-L132 PolarHBondContact O-N 3.16Å; E129-L132 PolarHBondContact O-N 3.46Å; L132-R134 PolarHBondContact O-N 3.34Å; L132-R134 VanDerWaalsContact O-N 3.16Å; L132-R135 PolarHBondContact O-N 3.33Å; L132-A136 PolarHBondContact O-N 3.45Å
133	S	77.4	Confident	78.9	Confident	68 Å²	68	97.9 Å²	97.9	48%	0.476	48%	0.478	S	S	.	.	H	α-helix	trans	-56.8	-29.1	174.3	54.1	0	0	0	0	112.5	E129 M130 H137	E129-S133 WeakPolarHBondContact O-CB 3.49Å; E129-S133 PolarHBondContact O-N 3.1Å; E129-S133 PolarHBondContact O-OG 3.22Å; M130-S133 PolarHBondContact O-OG 3.22Å; S133-H137 PolarHBondContact O-CD2 3.14Å
134	R	68.8	Low	78	Confident	119 Å²	119	103.3 Å²	103.3	45%	0.449	50%	0.499	S	S	.	.	H	α-helix	trans	-75.1	-27.9	175.1	-167.9	177.1	-177.6	177.3	4.7	114.2	D21 L131 L132	D21-R134 IonicContact OD1-CZ 3.88Å; D21-R134 IonicContact OD1-NH1 2.94Å; D21-R134 PolarHBondContact OD1-NH1 2.91Å; D21-R134 IonicContact OD1-NH2 2.74Å; D21-R134 PolarHBondContact OD1-NH2 3.2Å; D21-R134 IonicContact OD2-CZ 3.84Å; D21-R134 IonicContact OD2-NH1 3.78Å; D21-R134 IonicContact OD2-NH2 3.69Å; D21-R134 PolarHBondContact OD2-NH2 3.39Å; L131-R134 WeakPolarHBondContact O-CB 3.48Å; L131-R134 PolarHBondContact O-N 2.9Å; L132-R134 PolarHBondContact O-N 3.34Å; L132-R134 VanDerWaalsContact O-N 3.16Å
135	R	60.8	Low	77	Confident	217 Å²	217	105.5 Å²	105.5	82%	0.819	51%	0.51	S	S	*	.	H	α-helix	trans	-82.2	-17.7	178.3	-74.3	-176.1	179.5	163.8	1	113.1	L131 L132 H137	L131-R135 PolarHBondContact O-N 3.16Å; L132-R135 PolarHBondContact O-N 3.33Å; R135-H137 VanDerWaalsContact C-N 3.32Å
136	A	55.7	Low	75.7	Confident	82 Å²	82	109.3 Å²	109.3	68%	0.678	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	0.6	179.9	0	0	0	0	0	114.1	L132	L132-A136 PolarHBondContact O-N 3.45Å
137	H	42.9	Very low	74.4	Confident	198 Å²	198	110.5 Å²	110.5	92%	0.917	53%	0.527	S	S	*	.			trans	-129.6	0	-176.6	-74.8	-52.5	0	0	0	114	R13 S133 R135	R13-H137 PolarHBondContact NH2-OXT 2.87Å; R13-H137 VanDerWaalsContact NH2-OXT 3.16Å; S133-H137 PolarHBondContact O-CD2 3.14Å; R135-H137 VanDerWaalsContact C-N 3.32Å

Retrieved 137 of 137 residues in 36.9 ms (Link to these results)

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