A0A077ZFW7_TRITR Loading...

STI1 domain-containing protein

One HIP oligomer binds the ATPase domains of at least two HSC70 molecules dependent on activation of the HSC70 ATPase by HSP40. Stabilizes the ADP state of HSC70 that has a high affinity for substrate protein. Through its own chaperone activity, it may contribute to the interaction of HSC70 with various target proteins.

AlphaFold DB , UniProt , Accession A0A077ZFW7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 147 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	57.4	Low	64.3	Low	189 Å²	189	99.3 Å²	99.3	93%	0.931	57%	0.568	S	S	*	*				0	110.1	0	-114	155.8	164.5	0	0	107.8
2	S	67.8	Low	64.2	Low	63 Å²	63	104.7 Å²	104.7	44%	0.441	57%	0.572	S	S	.	*			trans	-63.3	143.8	175.6	168.8	0	0	0	0	109.4	Y4 E5 A6	S2-Y4 PolarHBondContact O-N 3.37Å; S2-Y4 PolarHBondContact OG-N 3.21Å; S2-E5 WeakPolarHBondContact O-CB 3.45Å; S2-E5 PolarHBondContact O-N 3.42Å; S2-A6 PolarHBondContact O-N 2.98Å
3	P	73.2	Confident	64.8	Low	108 Å²	108	102.7 Å²	102.7	70%	0.701	57%	0.568	S	S	*	*	H	α-helix	trans	-53.2	-29.2	177.6	18.7	-30.9	0	0	0	112.7	V7	P3-V7 PolarHBondContact O-N 2.88Å
4	Y	62.8	Low	65.3	Low	189 Å²	189	99.2 Å²	99.2	74%	0.741	56%	0.559	S	S	*	*	H	α-helix	trans	-67.8	-36.6	174.5	-120	-95.1	0	0	0	113.5	S2 V7 V8	S2-Y4 PolarHBondContact O-N 3.37Å; S2-Y4 PolarHBondContact OG-N 3.21Å; Y4-V7 PolarHBondContact O-N 3.33Å; Y4-V8 WeakPolarHBondContact O-CG2 3.25Å; Y4-V8 PolarHBondContact O-N 3.21Å; Y4-V8 VanDerWaalsContact O-N 3.13Å
5	E	66.6	Low	65.9	Low	113 Å²	113	101.9 Å²	101.9	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-69.4	-36.1	177.5	-73.9	-167.9	136.5	0	0	111.9	S2 V7 V8 V9	S2-E5 WeakPolarHBondContact O-CB 3.45Å; S2-E5 PolarHBondContact O-N 3.42Å; E5-V7 PolarHBondContact O-N 2.85Å; E5-V8 PolarHBondContact O-N 2.84Å; E5-V9 WeakPolarHBondContact O-CB 3.4Å; E5-V9 VanDerWaalsContact O-CG2 3.24Å; E5-V9 WeakPolarHBondContact O-CG2 3.31Å; E5-V9 PolarHBondContact O-N 3.14Å
6	A	66.8	Low	66.5	Low	52 Å²	52	104.4 Å²	104.4	43%	0.43	57%	0.566	S	S	.	*	H	α-helix	trans	-62.9	-41.3	176.3	0	0	0	0	0	111.9	S2 V9 A10	S2-A6 PolarHBondContact O-N 2.98Å; A6-V9 PolarHBondContact O-N 2.74Å; A6-A10 VanDerWaalsContact O-CB 3.3Å; A6-A10 WeakPolarHBondContact O-CB 3.21Å; A6-A10 PolarHBondContact O-N 3.41Å
7	V	63.4	Low	66.9	Low	92 Å²	92	104.9 Å²	104.9	56%	0.558	57%	0.567	S	S	*	*	H	α-helix	trans	-65.3	-42.7	175.5	173.5	0	0	0	0	111.4	P3 Y4 E5 A10 C11	P3-V7 PolarHBondContact O-N 2.88Å; Y4-V7 PolarHBondContact O-N 3.33Å; E5-V7 PolarHBondContact O-N 2.85Å; V7-A10 PolarHBondContact O-N 2.67Å; V7-C11 VanDerWaalsContact O-CB 3.3Å; V7-C11 WeakPolarHBondContact O-CB 3.16Å; V7-C11 PolarHBondContact O-N 3.43Å
8	V	62.4	Low	67.1	Low	78 Å²	78	106.9 Å²	106.9	47%	0.473	57%	0.574	S	S	.	*	H	α-helix	trans	-67.2	-39	178.5	173.8	0	0	0	0	111.8	Y4 E5 R12	Y4-V8 WeakPolarHBondContact O-CG2 3.25Å; Y4-V8 PolarHBondContact O-N 3.21Å; Y4-V8 VanDerWaalsContact O-N 3.13Å; E5-V8 PolarHBondContact O-N 2.84Å; V8-R12 PolarHBondContact O-N 3.32Å; V8-R12 VanDerWaalsContact O-N 3.16Å
9	V	63.6	Low	67.8	Low	84 Å²	84	108.4 Å²	108.4	51%	0.509	58%	0.577	S	S	.	*	H	α-helix	trans	-67.5	-40.2	176	170.8	0	0	0	0	111.2	E5 A6 R12 P13	E5-V9 WeakPolarHBondContact O-CB 3.4Å; E5-V9 VanDerWaalsContact O-CG2 3.24Å; E5-V9 WeakPolarHBondContact O-CG2 3.31Å; E5-V9 PolarHBondContact O-N 3.14Å; A6-V9 PolarHBondContact O-N 2.74Å; V9-R12 PolarHBondContact O-N 3.26Å; V9-P13 WeakPolarHBondContact O-CD 3.33Å
10	A	62.7	Low	68.5	Low	65 Å²	65	108.7 Å²	108.7	54%	0.537	58%	0.575	S	S	.	*	H	α-helix	trans	-71.7	-34	175.8	0	0	0	0	0	113.2	A6 V7 R12 P13	A6-A10 VanDerWaalsContact O-CB 3.3Å; A6-A10 WeakPolarHBondContact O-CB 3.21Å; A6-A10 PolarHBondContact O-N 3.41Å; V7-A10 PolarHBondContact O-N 2.67Å; A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3Å; A10-P13 VanDerWaalsContact O-CD 3.3Å; A10-P13 WeakPolarHBondContact O-CD 3.44Å; A10-P13 WeakPolarHBondContact O-CG 3.29Å
11	C	60.9	Low	68.9	Low	59 Å²	59	109.5 Å²	109.5	40%	0.399	57%	0.573	S	S	.	*	H	α-helix	trans	-72.1	-23.6	175.4	-95.3	0	0	0	0	113.5	V7 A14 K15	V7-C11 VanDerWaalsContact O-CB 3.3Å; V7-C11 WeakPolarHBondContact O-CB 3.16Å; V7-C11 PolarHBondContact O-N 3.43Å; C11-A14 PolarHBondContact O-N 3.14Å; C11-K15 WeakPolarHBondContact O-CG 3.46Å; C11-K15 PolarHBondContact O-N 3.45Å
12	R	62.5	Low	70.1	Confident	164 Å²	164	108.5 Å²	108.5	62%	0.619	56%	0.559	S	S	*	*	H	α-helix	trans	-62.9	-48.8	-179.1	-169.2	173.3	-66.7	-115.5	0.8	113.6	V8 V9 A10 K16	V8-R12 PolarHBondContact O-N 3.32Å; V8-R12 VanDerWaalsContact O-N 3.16Å; V9-R12 PolarHBondContact O-N 3.26Å; A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3Å; R12-K16 PolarHBondContact O-N 3.47Å
13	P	72.1	Confident	71	Confident	79 Å²	79	111 Å²	111	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-67.5	-33.6	171.9	23.7	-30.2	0	0	0	112.5	V9 A10 K15 K16 L17	V9-P13 WeakPolarHBondContact O-CD 3.33Å; A10-P13 VanDerWaalsContact O-CD 3.3Å; A10-P13 WeakPolarHBondContact O-CD 3.44Å; A10-P13 WeakPolarHBondContact O-CG 3.29Å; P13-K15 PolarHBondContact O-N 3.08Å; P13-K16 PolarHBondContact O-N 2.95Å; P13-L17 PolarHBondContact O-N 3.33Å
14	A	72	Confident	71.4	Confident	54 Å²	54	110.1 Å²	110.1	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-62.7	-42.2	177	0	0	0	0	0	112.9	C11 L17 M18	C11-A14 PolarHBondContact O-N 3.14Å; A14-L17 WeakPolarHBondContact O-CB 3.5Å; A14-L17 PolarHBondContact O-N 2.85Å; A14-M18 PolarHBondContact O-N 3.23Å; A14-M18 VanDerWaalsContact O-N 3.12Å
15	K	74.5	Confident	72.1	Confident	139 Å²	139	106.8 Å²	106.8	60%	0.604	54%	0.542	S	S	*	.	H	α-helix	trans	-62.5	-45	175.4	-73.9	179.5	-179.9	-177.7	0	112	C11 P13 L17 M18 E19	C11-K15 WeakPolarHBondContact O-CG 3.46Å; C11-K15 PolarHBondContact O-N 3.45Å; P13-K15 PolarHBondContact O-N 3.08Å; K15-L17 VanDerWaalsContact C-N 3.29Å; K15-L17 PolarHBondContact O-N 3.32Å; K15-M18 PolarHBondContact O-N 2.82Å; K15-E19 WeakPolarHBondContact O-CG 3.42Å; K15-E19 PolarHBondContact O-N 3.25Å; K15-E19 VanDerWaalsContact O-N 3.1Å
16	K	75.5	Confident	73	Confident	143 Å²	143	108.8 Å²	108.8	62%	0.622	55%	0.545	S	S	*	.	H	α-helix	trans	-61.2	-36.9	175.6	-71.7	-177.6	177	-177.2	0	112.4	R12 P13 H20	R12-K16 PolarHBondContact O-N 3.47Å; P13-K16 PolarHBondContact O-N 2.95Å; K16-H20 PolarHBondContact O-N 3.49Å; K16-H20 VanDerWaalsContact O-N 3.1Å
17	L	72.6	Confident	74	Confident	113 Å²	113	112.6 Å²	112.6	59%	0.592	55%	0.552	S	S	*	*	H	α-helix	trans	-66.1	-42.9	178.2	-152.5	86	0	0	0	111.9	P13 A14 K15 H20 K21	P13-L17 PolarHBondContact O-N 3.33Å; A14-L17 WeakPolarHBondContact O-CB 3.5Å; A14-L17 PolarHBondContact O-N 2.85Å; K15-L17 VanDerWaalsContact C-N 3.29Å; K15-L17 PolarHBondContact O-N 3.32Å; L17-H20 PolarHBondContact O-N 2.86Å; L17-K21 PolarHBondContact O-N 3.35Å; L17-K21 VanDerWaalsContact O-N 3.08Å
18	M	71.8	Confident	75.2	Confident	140 Å²	140	110.9 Å²	110.9	69%	0.69	55%	0.548	S	S	*	.	H	α-helix	trans	-66.1	-41.8	177.5	-69.6	-138.9	-67.4	0	0	112.4	A14 K15 H20 K21 R22	A14-M18 PolarHBondContact O-N 3.23Å; A14-M18 VanDerWaalsContact O-N 3.12Å; K15-M18 PolarHBondContact O-N 2.82Å; M18-H20 VanDerWaalsContact C-N 3.29Å; M18-H20 PolarHBondContact O-N 3.09Å; M18-K21 PolarHBondContact O-N 3.41Å; M18-R22 PolarHBondContact O-N 3.16Å
19	E	79	Confident	76.2	Confident	135 Å²	135	112.3 Å²	112.3	63%	0.631	55%	0.553	S	S	*	*	H	α-helix	trans	-62	-38.1	175.6	-72.8	177.4	172.7	0	0	112.2	K15 R22 K23	K15-E19 WeakPolarHBondContact O-CG 3.42Å; K15-E19 PolarHBondContact O-N 3.25Å; K15-E19 VanDerWaalsContact O-N 3.1Å; E19-R22 PolarHBondContact O-N 2.88Å; E19-K23 WeakPolarHBondContact O-CB 3.43Å; E19-K23 PolarHBondContact O-N 3.44Å
20	H	83.3	Confident	77.2	Confident	114 Å²	114	113.8 Å²	113.8	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-44.8	176	-170	-98	0	0	0	111.9	K16 L17 M18 R22 K23 L24	K16-H20 PolarHBondContact O-N 3.49Å; K16-H20 VanDerWaalsContact O-N 3.1Å; L17-H20 PolarHBondContact O-N 2.86Å; M18-H20 VanDerWaalsContact C-N 3.29Å; M18-H20 PolarHBondContact O-N 3.09Å; H20-R22 PolarHBondContact O-N 3.33Å; H20-K23 WeakPolarHBondContact O-CB 3.43Å; H20-K23 PolarHBondContact O-N 3.37Å; H20-K23 VanDerWaalsContact O-N 3.11Å; H20-L24 WeakPolarHBondContact O-CG 3.47Å; H20-L24 PolarHBondContact O-N 2.8Å
21	K	76.4	Confident	78.5	Confident	126 Å²	126	117.8 Å²	117.8	55%	0.548	56%	0.563	S	S	.	*	H	α-helix	trans	-58.8	-47.3	174.8	-73.8	-173.5	175.4	-174.8	0	111.8	L17 M18 K23 L24 E25	L17-K21 PolarHBondContact O-N 3.35Å; L17-K21 VanDerWaalsContact O-N 3.08Å; M18-K21 PolarHBondContact O-N 3.41Å; K21-K23 PolarHBondContact O-N 2.81Å; K21-L24 PolarHBondContact O-N 3.1Å; K21-E25 WeakPolarHBondContact O-CG 3.34Å; K21-E25 PolarHBondContact O-N 3.13Å
22	R	81.5	Confident	79.8	Confident	168 Å²	168	121 Å²	121	63%	0.634	57%	0.57	S	S	*	*	H	α-helix	trans	-61.3	-28.6	175.7	-170.4	178.7	179.5	-173	1.9	113.1	M18 E19 H20 R26	M18-R22 PolarHBondContact O-N 3.16Å; E19-R22 PolarHBondContact O-N 2.88Å; H20-R22 PolarHBondContact O-N 3.33Å; R22-R26 WeakPolarHBondContact O-CG 3.39Å; R22-R26 PolarHBondContact O-N 3.21Å; R22-R26 PolarHBondContact O-NE 3.12Å
23	K	86.7	Confident	81	Confident	116 Å²	116	115.9 Å²	115.9	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-76.6	-37	174.6	-169.4	174.1	-175.3	175.3	0	111.7	E19 H20 K21 K27	E19-K23 WeakPolarHBondContact O-CB 3.43Å; E19-K23 PolarHBondContact O-N 3.44Å; H20-K23 WeakPolarHBondContact O-CB 3.43Å; H20-K23 PolarHBondContact O-N 3.37Å; H20-K23 VanDerWaalsContact O-N 3.11Å; K21-K23 PolarHBondContact O-N 2.81Å; K23-K27 WeakPolarHBondContact O-CG 3.44Å; K23-K27 PolarHBondContact O-N 3.1Å
24	L	81.9	Confident	81.8	Confident	90 Å²	90	121 Å²	121	47%	0.471	57%	0.572	S	S	.	*	H	α-helix	trans	-68.4	-43.4	175.4	-69.8	177	0	0	0	111.8	H20 K21 R26 K27 A28	H20-L24 WeakPolarHBondContact O-CG 3.47Å; H20-L24 PolarHBondContact O-N 2.8Å; K21-L24 PolarHBondContact O-N 3.1Å; L24-R26 PolarHBondContact O-N 2.97Å; L24-K27 PolarHBondContact O-N 3.32Å; L24-K27 VanDerWaalsContact O-N 3.14Å; L24-A28 PolarHBondContact O-N 3.4Å
25	E	77.7	Confident	82.4	Confident	119 Å²	119	122.9 Å²	122.9	56%	0.556	57%	0.571	S	S	*	*	H	α-helix	trans	-57.7	-49.7	176.6	-73.2	168.2	168	0	0	111.1	K21 K27 A28 D29	K21-E25 WeakPolarHBondContact O-CG 3.34Å; K21-E25 PolarHBondContact O-N 3.13Å; E25-K27 VanDerWaalsContact C-N 3.28Å; E25-K27 PolarHBondContact O-N 3.03Å; E25-A28 PolarHBondContact O-N 3.07Å; E25-D29 PolarHBondContact O-N 3.02Å
26	R	86.5	Confident	82.9	Confident	154 Å²	154	121.6 Å²	121.6	58%	0.581	57%	0.568	S	S	*	*	H	α-helix	trans	-56.8	-39.2	175.1	-76.4	-176.7	-78	176.4	-4.7	113.5	R22 L24 D30	R22-R26 WeakPolarHBondContact O-CG 3.39Å; R22-R26 PolarHBondContact O-N 3.21Å; R22-R26 PolarHBondContact O-NE 3.12Å; L24-R26 PolarHBondContact O-N 2.97Å; R26-D30 WeakPolarHBondContact O-CB 3.35Å; R26-D30 PolarHBondContact O-N 2.93Å; R26-D30 VanDerWaalsContact O-N 3.08Å
27	K	87.1	Confident	83.4	Confident	132 Å²	132	121.2 Å²	121.2	57%	0.574	57%	0.568	S	S	*	*	H	α-helix	trans	-71.2	-35	177.2	-76	-179	174	-170.6	0	112.5	K23 L24 E25 K31	K23-K27 WeakPolarHBondContact O-CG 3.44Å; K23-K27 PolarHBondContact O-N 3.1Å; L24-K27 PolarHBondContact O-N 3.32Å; L24-K27 VanDerWaalsContact O-N 3.14Å; E25-K27 VanDerWaalsContact C-N 3.28Å; E25-K27 PolarHBondContact O-N 3.03Å; K27-K31 WeakPolarHBondContact O-CB 3.3Å; K27-K31 PolarHBondContact O-N 3.31Å; K27-K31 VanDerWaalsContact O-N 3.09Å
28	A	88	Confident	84.2	Confident	57 Å²	57	125.3 Å²	125.3	47%	0.471	58%	0.575	S	S	.	*	H	α-helix	trans	-69.8	-43.2	177.4	0	0	0	0	0	110.8	L24 E25 K31 K32	L24-A28 PolarHBondContact O-N 3.4Å; E25-A28 PolarHBondContact O-N 3.07Å; A28-K31 PolarHBondContact O-N 2.67Å; A28-K32 WeakPolarHBondContact O-CB 3.46Å; A28-K32 PolarHBondContact O-N 3.31Å
29	D	83.3	Confident	84.8	Confident	108 Å²	108	124.8 Å²	124.8	58%	0.578	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-44.9	176.8	-71.2	-17.5	0	0	0	111.5	E25 K31 K32 A33	E25-D29 PolarHBondContact O-N 3.02Å; D29-K31 VanDerWaalsContact C-N 3.35Å; D29-K31 PolarHBondContact O-N 3.43Å; D29-K32 PolarHBondContact O-N 3.41Å; D29-A33 WeakPolarHBondContact O-CB 3.35Å; D29-A33 PolarHBondContact O-N 3.12Å
30	D	85.4	Confident	85	Confident	115 Å²	115	128 Å²	128	62%	0.615	58%	0.576	S	S	*	*	H	α-helix	trans	-60.8	-42.4	175.4	-175.2	76.1	0	0	0	112.1	R26 A33 R34	R26-D30 WeakPolarHBondContact O-CB 3.35Å; R26-D30 PolarHBondContact O-N 2.93Å; R26-D30 VanDerWaalsContact O-N 3.08Å; D30-A33 PolarHBondContact O-N 3.38Å; D30-R34 WeakPolarHBondContact O-CB 3.34Å; D30-R34 PolarHBondContact O-N 2.87Å
31	K	89.6	Confident	85.2	Confident	148 Å²	148	129.9 Å²	129.9	64%	0.643	58%	0.582	S	S	*	*	H	α-helix	trans	-64.8	-41.3	176	-170.8	179.3	179.9	-172.3	0	111.8	K27 A28 D29 R34 E35	K27-K31 WeakPolarHBondContact O-CB 3.3Å; K27-K31 PolarHBondContact O-N 3.31Å; K27-K31 VanDerWaalsContact O-N 3.09Å; A28-K31 PolarHBondContact O-N 2.67Å; D29-K31 VanDerWaalsContact C-N 3.35Å; D29-K31 PolarHBondContact O-N 3.43Å; K31-R34 PolarHBondContact O-N 2.87Å; K31-E35 WeakPolarHBondContact O-CB 3.25Å; K31-E35 PolarHBondContact O-N 3.01Å
32	K	88.3	Confident	85.6	Confident	128 Å²	128	126.4 Å²	126.4	56%	0.557	58%	0.577	S	S	*	*	H	α-helix	trans	-66	-45.1	178.1	-171	-178.1	176.4	-170.6	0	111	A28 D29 R34 E35 E36	A28-K32 WeakPolarHBondContact O-CB 3.46Å; A28-K32 PolarHBondContact O-N 3.31Å; D29-K32 PolarHBondContact O-N 3.41Å; K32-R34 VanDerWaalsContact C-N 3.34Å; K32-R34 PolarHBondContact O-N 3.47Å; K32-E35 PolarHBondContact O-N 2.95Å; K32-E36 WeakPolarHBondContact CE-OE1 3.47Å; K32-E36 WeakPolarHBondContact O-CB 3.38Å; K32-E36 WeakPolarHBondContact O-CG 3.34Å; K32-E36 PolarHBondContact O-N 3.07Å
33	A	87.6	Confident	85.6	Confident	56 Å²	56	121.3 Å²	121.3	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-59.3	-44.2	175.5	0	0	0	0	0	111.6	D29 D30 E36 E37	D29-A33 WeakPolarHBondContact O-CB 3.35Å; D29-A33 PolarHBondContact O-N 3.12Å; D30-A33 PolarHBondContact O-N 3.38Å; A33-E36 PolarHBondContact O-N 3.19Å; A33-E37 WeakPolarHBondContact O-CB 3.5Å; A33-E37 PolarHBondContact O-N 3.49Å
34	R	88.5	Confident	85.3	Confident	187 Å²	187	118 Å²	118	71%	0.706	57%	0.565	S	S	*	*	H	α-helix	trans	-66.1	-36.9	176.6	-171.4	176.9	179.3	-167.1	0.2	113	D30 K31 K32 R38	D30-R34 WeakPolarHBondContact O-CB 3.34Å; D30-R34 PolarHBondContact O-N 2.87Å; K31-R34 PolarHBondContact O-N 2.87Å; K32-R34 VanDerWaalsContact C-N 3.34Å; K32-R34 PolarHBondContact O-N 3.47Å; R34-R38 VanDerWaalsContact O-CB 3.28Å; R34-R38 WeakPolarHBondContact O-CB 3.35Å; R34-R38 PolarHBondContact O-N 3.22Å
35	E	84.2	Confident	85	Confident	92 Å²	92	118.1 Å²	118.1	43%	0.43	56%	0.564	S	S	.	*	H	α-helix	trans	-70.4	-41.7	176.5	-168.4	-176.8	151.2	0	0	111.6	K31 K32 R38 K39	K31-E35 WeakPolarHBondContact O-CB 3.25Å; K31-E35 PolarHBondContact O-N 3.01Å; K32-E35 PolarHBondContact O-N 2.95Å; E35-R38 PolarHBondContact O-N 3.04Å; E35-K39 HydrophobicContact CG-CD 4.44Å; E35-K39 WeakPolarHBondContact O-CB 3.46Å; E35-K39 WeakPolarHBondContact O-CG 3.39Å; E35-K39 PolarHBondContact O-N 3.07Å; E35-K39 WeakPolarHBondContact OE1-CE 3.4Å; E35-K39 IonicContact OE1-NZ 2.87Å; E35-K39 PolarHBondContact OE1-NZ 3.36Å
36	E	86.7	Confident	84.9	Confident	113 Å²	113	121.9 Å²	121.9	53%	0.528	57%	0.573	S	S	.	*	H	α-helix	trans	-64.3	-42	174.2	-75.6	-174.4	171.8	0	0	111.6	K32 A33 R38 K39 R40	K32-E36 WeakPolarHBondContact CE-OE1 3.47Å; K32-E36 WeakPolarHBondContact O-CB 3.38Å; K32-E36 WeakPolarHBondContact O-CG 3.34Å; K32-E36 PolarHBondContact O-N 3.07Å; A33-E36 PolarHBondContact O-N 3.19Å; E36-R38 PolarHBondContact O-N 2.9Å; E36-K39 PolarHBondContact O-N 3.38Å; E36-R40 VanDerWaalsContact O-CB 3.26Å; E36-R40 WeakPolarHBondContact O-CB 3.16Å; E36-R40 PolarHBondContact O-N 3.05Å
37	E	86.2	Confident	84.3	Confident	135 Å²	135	116.6 Å²	116.6	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-61.8	-44.2	173.5	-170.6	-172	173.2	0	0	111.1	A33 R40 K41	A33-E37 WeakPolarHBondContact O-CB 3.5Å; A33-E37 PolarHBondContact O-N 3.49Å; E37-R40 PolarHBondContact O-N 2.88Å; E37-K41 VanDerWaalsContact O-CB 3.27Å; E37-K41 WeakPolarHBondContact O-CB 3.29Å; E37-K41 PolarHBondContact O-N 3.2Å
38	R	87.9	Confident	83.6	Confident	198 Å²	198	117.8 Å²	117.8	75%	0.747	57%	0.567	S	S	*	*	H	α-helix	trans	-64.4	-41.2	176.8	-175.6	178.2	162	-158.8	-4.7	111.9	R34 E35 E36 K41 A42	R34-R38 VanDerWaalsContact O-CB 3.28Å; R34-R38 WeakPolarHBondContact O-CB 3.35Å; R34-R38 PolarHBondContact O-N 3.22Å; E35-R38 PolarHBondContact O-N 3.04Å; E36-R38 PolarHBondContact O-N 2.9Å; R38-K41 PolarHBondContact O-N 2.92Å; R38-A42 VanDerWaalsContact O-CB 3.23Å; R38-A42 WeakPolarHBondContact O-CB 3.17Å; R38-A42 PolarHBondContact O-N 3.33Å
39	K	85.5	Confident	82.5	Confident	129 Å²	129	123.1 Å²	123.1	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-64.1	-44.3	174.4	-78.5	176.8	-176.3	167.2	0	111	E35 E36 A42 A43	E35-K39 HydrophobicContact CG-CD 4.44Å; E35-K39 WeakPolarHBondContact O-CB 3.46Å; E35-K39 WeakPolarHBondContact O-CG 3.39Å; E35-K39 PolarHBondContact O-N 3.07Å; E35-K39 WeakPolarHBondContact OE1-CE 3.4Å; E35-K39 IonicContact OE1-NZ 2.87Å; E35-K39 PolarHBondContact OE1-NZ 3.36Å; E36-K39 PolarHBondContact O-N 3.38Å; K39-A42 PolarHBondContact O-N 3.12Å; K39-A43 VanDerWaalsContact O-CB 3.26Å; K39-A43 WeakPolarHBondContact O-CB 3.23Å; K39-A43 PolarHBondContact O-N 3.18Å
40	R	83	Confident	81.3	Confident	204 Å²	204	125.1 Å²	125.1	77%	0.77	58%	0.581	S	S	*	*	H	α-helix	trans	-63.5	-42.4	176.5	-171.8	177.1	-178.7	-175.3	0.3	111.6	E36 E37 A44	E36-R40 VanDerWaalsContact O-CB 3.26Å; E36-R40 WeakPolarHBondContact O-CB 3.16Å; E36-R40 PolarHBondContact O-N 3.05Å; E37-R40 PolarHBondContact O-N 2.88Å; R40-A44 VanDerWaalsContact O-CB 3.25Å; R40-A44 WeakPolarHBondContact O-CB 3.44Å; R40-A44 PolarHBondContact O-N 2.72Å
41	K	87.7	Confident	80	Confident	152 Å²	152	126.4 Å²	126.4	66%	0.661	58%	0.581	S	S	*	*	H	α-helix	trans	-66.5	-43.1	176.1	-172.4	174.8	-179.3	178.4	0	111.8	E37 R38 A44 E45	E37-K41 VanDerWaalsContact O-CB 3.27Å; E37-K41 WeakPolarHBondContact O-CB 3.29Å; E37-K41 PolarHBondContact O-N 3.2Å; R38-K41 PolarHBondContact O-N 2.92Å; K41-A44 PolarHBondContact O-N 3.46Å; K41-E45 WeakPolarHBondContact O-CB 3.49Å; K41-E45 PolarHBondContact O-N 3.22Å
42	A	84	Confident	78.5	Confident	53 Å²	53	123.5 Å²	123.5	44%	0.438	58%	0.584	S	S	.	*	H	α-helix	trans	-66	-40.8	176.1	0	0	0	0	0	112.2	R38 K39 E45 R46	R38-A42 VanDerWaalsContact O-CB 3.23Å; R38-A42 WeakPolarHBondContact O-CB 3.17Å; R38-A42 PolarHBondContact O-N 3.33Å; K39-A42 PolarHBondContact O-N 3.12Å; A42-E45 PolarHBondContact O-N 2.85Å; A42-R46 WeakPolarHBondContact O-CB 3.43Å; A42-R46 PolarHBondContact O-N 3.27Å
43	A	82	Confident	76.9	Confident	62 Å²	62	125.2 Å²	125.2	51%	0.512	60%	0.6	S	S	.	*	H	α-helix	trans	-63.9	-41.9	173.4	0	0	0	0	0	111.4	K39 R46 A47	K39-A43 VanDerWaalsContact O-CB 3.26Å; K39-A43 WeakPolarHBondContact O-CB 3.23Å; K39-A43 PolarHBondContact O-N 3.18Å; A43-R46 PolarHBondContact O-N 2.8Å; A43-A47 WeakPolarHBondContact O-CB 3.35Å; A43-A47 PolarHBondContact O-N 2.88Å
44	A	80.5	Confident	74.9	Confident	46 Å²	46	124.5 Å²	124.5	38%	0.38	60%	0.598	S	S	.	*	H	α-helix	trans	-65.6	-37.9	174.8	0	0	0	0	0	112.4	R40 K41 K48	R40-A44 VanDerWaalsContact O-CB 3.25Å; R40-A44 WeakPolarHBondContact O-CB 3.44Å; R40-A44 PolarHBondContact O-N 2.72Å; K41-A44 PolarHBondContact O-N 3.46Å; A44-K48 WeakPolarHBondContact O-CB 3.42Å; A44-K48 VanDerWaalsContact O-CG 3.25Å; A44-K48 WeakPolarHBondContact O-CG 3.47Å; A44-K48 PolarHBondContact O-N 2.86Å
45	E	75.2	Confident	72.8	Confident	93 Å²	93	124.5 Å²	124.5	44%	0.435	61%	0.606	S	S	.	*	H	α-helix	trans	-67.5	-42.6	174.8	-168.5	-170.4	150.3	0	0	111.3	K41 A42 A47 K48 R49	K41-E45 WeakPolarHBondContact O-CB 3.49Å; K41-E45 PolarHBondContact O-N 3.22Å; A42-E45 PolarHBondContact O-N 2.85Å; E45-A47 PolarHBondContact O-N 3.14Å; E45-K48 PolarHBondContact O-N 2.71Å; E45-K48 VanDerWaalsContact O-N 3.13Å; E45-R49 WeakPolarHBondContact O-CG 3.4Å; E45-R49 PolarHBondContact O-N 2.86Å; E45-R49 IonicContact OE1-CZ 3.3Å; E45-R49 VanDerWaalsContact OE1-CZ 3.3Å; E45-R49 IonicContact OE1-NE 2.94Å; E45-R49 PolarHBondContact OE1-NE 3.34Å; E45-R49 IonicContact OE1-NH2 2.8Å; E45-R49 PolarHBondContact OE1-NH2 3.49Å
46	R	75.9	Confident	70.7	Confident	197 Å²	197	125.9 Å²	125.9	74%	0.743	62%	0.623	S	S	*	*	H	α-helix	trans	-60.8	-45.8	175.4	-168.5	176	-179.9	-163.5	-0.8	111.2	A42 A43 K48 R49 E50	A42-R46 WeakPolarHBondContact O-CB 3.43Å; A42-R46 PolarHBondContact O-N 3.27Å; A43-R46 PolarHBondContact O-N 2.8Å; R46-K48 VanDerWaalsContact C-N 3.29Å; R46-K48 PolarHBondContact O-N 2.72Å; R46-R49 PolarHBondContact O-N 3.5Å; R46-E50 WeakPolarHBondContact O-CB 3.37Å; R46-E50 PolarHBondContact O-N 3.46Å
47	A	73.8	Confident	68.5	Low	44 Å²	44	130 Å²	130	36%	0.364	64%	0.639	S	S	.	*	H	α-helix	trans	-64	-31.2	174.5	0	0	0	0	0	113	A43 E45 K51	A43-A47 WeakPolarHBondContact O-CB 3.35Å; A43-A47 PolarHBondContact O-N 2.88Å; E45-A47 PolarHBondContact O-N 3.14Å; A47-K51 VanDerWaalsContact O-CG 3.28Å; A47-K51 WeakPolarHBondContact O-CG 3.17Å; A47-K51 PolarHBondContact O-N 2.9Å
48	K	73.3	Confident	66.7	Low	156 Å²	156	132.4 Å²	132.4	68%	0.678	65%	0.648	S	S	*	*	H	α-helix	trans	-73.5	-40.1	174.4	-78.5	176	-178.7	-172.8	0	112.7	A44 E45 R46 K51 A52	A44-K48 WeakPolarHBondContact O-CB 3.42Å; A44-K48 VanDerWaalsContact O-CG 3.25Å; A44-K48 WeakPolarHBondContact O-CG 3.47Å; A44-K48 PolarHBondContact O-N 2.86Å; E45-K48 PolarHBondContact O-N 2.71Å; E45-K48 VanDerWaalsContact O-N 3.13Å; R46-K48 VanDerWaalsContact C-N 3.29Å; R46-K48 PolarHBondContact O-N 2.72Å; K48-K51 PolarHBondContact O-N 3.16Å; K48-A52 PolarHBondContact O-N 3.43Å
49	R	64.1	Low	64.4	Low	170 Å²	170	128.7 Å²	128.7	64%	0.642	65%	0.649	S	S	*	*	H	α-helix	trans	-66.9	-40.4	175.9	-72.3	-179.8	-177.5	-125.4	5	111.5	E45 R46 K51 A52 D53	E45-R49 WeakPolarHBondContact O-CG 3.4Å; E45-R49 PolarHBondContact O-N 2.86Å; E45-R49 IonicContact OE1-CZ 3.3Å; E45-R49 VanDerWaalsContact OE1-CZ 3.3Å; E45-R49 IonicContact OE1-NE 2.94Å; E45-R49 PolarHBondContact OE1-NE 3.34Å; E45-R49 IonicContact OE1-NH2 2.8Å; E45-R49 PolarHBondContact OE1-NH2 3.49Å; R46-R49 PolarHBondContact O-N 3.5Å; R49-K51 PolarHBondContact O-N 3.28Å; R49-A52 PolarHBondContact O-N 3.16Å; R49-D53 PolarHBondContact O-N 3.01Å; R49-D53 VanDerWaalsContact O-N 3.16Å
50	E	57.8	Low	62.3	Low	150 Å²	150	129.9 Å²	129.9	70%	0.701	66%	0.657	S	S	*	*	H	α-helix	trans	-61.8	-29.1	174.5	-167	177.4	161.9	0	0	112.5	R46	R46-E50 WeakPolarHBondContact O-CB 3.37Å; R46-E50 PolarHBondContact O-N 3.46Å
51	K	58.1	Low	60.5	Low	142 Å²	142	126.5 Å²	126.5	62%	0.617	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-12.3	172.6	-71.7	-176.5	-179	-153.5	0	114.9	A47 K48 R49	A47-K51 VanDerWaalsContact O-CG 3.28Å; A47-K51 WeakPolarHBondContact O-CG 3.17Å; A47-K51 PolarHBondContact O-N 2.9Å; K48-K51 PolarHBondContact O-N 3.16Å; R49-K51 PolarHBondContact O-N 3.28Å
52	A	58.5	Low	58.4	Low	86 Å²	86	123.4 Å²	123.4	71%	0.711	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-26.7	-177	0	0	0	0	0	112.6	K48 R49 G54	K48-A52 PolarHBondContact O-N 3.43Å; R49-A52 PolarHBondContact O-N 3.16Å; A52-G54 VanDerWaalsContact C-N 3.33Å
53	D	55.5	Low	56.6	Low	164 Å²	164	127.2 Å²	127.2	88%	0.877	68%	0.682	S	S	*	*	S	Bend	trans	-91.2	4.2	177.8	-142.6	-119.6	0	0	0	112.9	R49	R49-D53 PolarHBondContact O-N 3.01Å; R49-D53 VanDerWaalsContact O-N 3.16Å
54	G	44.1	Very low	55.2	Low	42 Å²	42	130.3 Å²	130.3	43%	0.433	69%	0.688	S	S	.	*	S	Bend	trans	-146.5	129.2	175.8	0	0	0	0	0	111.3	A52	A52-G54 VanDerWaalsContact C-N 3.33Å
55	E	45.6	Very low	53.6	Low	186 Å²	186	133.7 Å²	133.7	87%	0.869	71%	0.706	S	S	*	*			trans	-16.6	150.5	171.4	-107.9	159.9	68.4	0	0	119.7	K57	E55-K57 PolarHBondContact O-N 3.06Å
56	P	40.7	Very low	52.6	Low	122 Å²	122	135.5 Å²	135.5	79%	0.792	72%	0.718	S	S	*	*			trans	-77.3	115.7	-160.7	33.4	-31	0	0	0	112
57	K	38.8	Very low	51.6	Low	198 Å²	198	128 Å²	128	86%	0.861	69%	0.693	S	S	*	*			trans	-123.7	127.9	156.6	-83.9	-167.2	173.7	79.4	0	111.3	E55	E55-K57 PolarHBondContact O-N 3.06Å
58	K	48.8	Very low	50.7	Low	186 Å²	186	128 Å²	128	81%	0.809	70%	0.697	S	S	*	*			trans	-39.1	157.2	-178.2	-71.9	165.7	176.3	166.4	0	115.5	E60	K58-E60 PolarHBondContact O-N 3.11Å
59	P	40.3	Very low	50	Low	120 Å²	120	122.2 Å²	122.2	78%	0.779	68%	0.682	S	S	*	*			trans	-77.5	105	177.3	32.7	-29.5	0	0	0	109.4
60	E	41.7	Very low	49.8	Very low	154 Å²	154	115.7 Å²	115.7	72%	0.72	66%	0.66	S	S	*	*			trans	-111	146.2	166	-70.4	-138.6	116.7	0	0	109.8	K58 S62	K58-E60 PolarHBondContact O-N 3.11Å; E60-S62 PolarHBondContact O-N 3.29Å
61	P	43.8	Very low	50.1	Low	134 Å²	134	114.2 Å²	114.2	87%	0.87	65%	0.651	S	S	*	*	S	Bend	trans	-76.2	61.2	-174.7	35.1	-36.1	0	0	0	110.6
62	S	43.8	Very low	50.6	Low	86 Å²	86	112.2 Å²	112.2	60%	0.601	66%	0.655	S	S	*	*			trans	-148	63.1	-165	-59.1	0	0	0	0	110.4	E60 M64	E60-S62 PolarHBondContact O-N 3.29Å; S62-M64 PolarHBondContact O-N 2.96Å; S62-M64 VanDerWaalsContact O-N 3.11Å
63	S	45.9	Very low	51.1	Low	133 Å²	133	109.1 Å²	109.1	93%	0.93	63%	0.626	S	S	*	*			trans	-84.3	58.9	164.8	-160.4	0	0	0	0	109
64	M	52.6	Low	52	Low	128 Å²	128	105.4 Å²	105.4	63%	0.631	61%	0.611	S	S	*	*	S	Bend	trans	-114.1	129.5	159.3	-80.5	-149.8	-113.1	0	0	107.3	S62 N66 L67	S62-M64 PolarHBondContact O-N 2.96Å; S62-M64 VanDerWaalsContact O-N 3.11Å; M64-N66 PolarHBondContact O-N 3.31Å; M64-L67 HydrophobicContact CB-CD1 3.67Å; M64-L67 HydrophobicContact CB-CG 3.97Å; M64-L67 HydrophobicContact CE-CD1 3.59Å; M64-L67 HydrophobicContact CG-CD1 4.07Å; M64-L67 HydrophobicContact SD-CD1 3.48Å; M64-L67 WeakPolarHBondContact SD-CD1 3.48Å; M64-L67 HydrophobicContact SD-CG 4.16Å
65	P	48.6	Very low	53.4	Low	117 Å²	117	106.2 Å²	106.2	76%	0.76	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	115.4	-178.3	27.3	-31.9	0	0	0	108.2	L67	P65-L67 VanDerWaalsContact C-N 3.29Å; P65-L67 PolarHBondContact O-N 3Å
66	N	52.7	Low	54.7	Low	130 Å²	130	98.2 Å²	98.2	70%	0.695	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.6	44.5	163.1	-157.9	15.5	0	0	0	115.8	M64 G68 G69	M64-N66 PolarHBondContact O-N 3.31Å; N66-G68 PolarHBondContact O-N 3.38Å; N66-G68 VanDerWaalsContact O-N 3.16Å; N66-G69 PolarHBondContact O-N 3.21Å
67	L	55	Low	56.4	Low	39 Å²	39	94.9 Å²	94.9	20%	0.204	54%	0.542	C	S	.	.	H	α-helix	trans	-59.2	-24.5	174.6	-101.4	179.2	0	0	0	112.3	M64 P65 G69 L70 F71	M64-L67 HydrophobicContact CB-CD1 3.67Å; M64-L67 HydrophobicContact CB-CG 3.97Å; M64-L67 HydrophobicContact CE-CD1 3.59Å; M64-L67 HydrophobicContact CG-CD1 4.07Å; M64-L67 HydrophobicContact SD-CD1 3.48Å; M64-L67 WeakPolarHBondContact SD-CD1 3.48Å; M64-L67 HydrophobicContact SD-CG 4.16Å; P65-L67 VanDerWaalsContact C-N 3.29Å; P65-L67 PolarHBondContact O-N 3Å; L67-G69 PolarHBondContact O-N 3.32Å; L67-L70 HydrophobicContact CD2-CB 4.3Å; L67-L70 HydrophobicContact CD2-CD1 4.17Å; L67-L70 CarbonylContact O-C 3.6Å; L67-L70 WeakPolarHBondContact O-CB 3.3Å; L67-L70 PolarHBondContact O-N 3.3Å; L67-L70 VanDerWaalsContact O-N 3.16Å; L67-F71 HydrophobicContact CB-CD2 4.01Å; L67-F71 HydrophobicContact CB-CE2 3.61Å; L67-F71 HydrophobicContact CB-CZ 4.45Å; L67-F71 HydrophobicContact CD1-CE2 3.93Å; L67-F71 HydrophobicContact CD1-CZ 4.12Å; L67-F71 HydrophobicContact CD2-CD2 4.4Å; L67-F71 HydrophobicContact CD2-CE1 4.47Å; L67-F71 HydrophobicContact CD2-CE2 3.77Å; L67-F71 HydrophobicContact CD2-CZ 3.78Å; L67-F71 HydrophobicContact CG-CE2 3.98Å; L67-F71 HydrophobicContact CG-CZ 4.35Å; L67-F71 WeakPolarHBondContact O-CD2 3.18Å; L67-F71 WeakPolarHBondContact O-CG 3.46Å; L67-F71 PolarHBondContact O-N 3.33Å
68	G	54.2	Low	58.2	Low	44 Å²	44	90.7 Å²	90.7	45%	0.454	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-36.7	178.3	0	0	0	0	0	114.1	N66 S72	N66-G68 PolarHBondContact O-N 3.38Å; N66-G68 VanDerWaalsContact O-N 3.16Å; G68-S72 WeakPolarHBondContact O-CB 3.49Å; G68-S72 PolarHBondContact O-N 3.16Å; G68-S72 VanDerWaalsContact O-N 3.14Å; G68-S72 PolarHBondContact O-OG 3.2Å
69	G	60.3	Low	59.4	Low	35 Å²	35	81.9 Å²	81.9	36%	0.361	49%	0.486	S	S	.	.	H	α-helix	trans	-72.7	-31.1	173.6	0	0	0	0	0	112.7	N66 L67 S72 D73	N66-G69 PolarHBondContact O-N 3.21Å; L67-G69 PolarHBondContact O-N 3.32Å; G69-S72 PolarHBondContact O-N 2.79Å; G69-D73 PolarHBondContact O-N 2.69Å
70	L	59.7	Low	61	Low	34 Å²	34	80.7 Å²	80.7	18%	0.178	47%	0.468	C	S	.	.	H	α-helix	trans	-71.9	-35.5	175.6	-72.3	149.5	0	0	0	111.8	L67 L76 F80	L67-L70 HydrophobicContact CD2-CB 4.3Å; L67-L70 HydrophobicContact CD2-CD1 4.17Å; L67-L70 CarbonylContact O-C 3.6Å; L67-L70 WeakPolarHBondContact O-CB 3.3Å; L67-L70 PolarHBondContact O-N 3.3Å; L67-L70 VanDerWaalsContact O-N 3.16Å; L70-L76 HydrophobicContact CB-CB 4.5Å; L70-L76 HydrophobicContact CB-CD1 4.42Å; L70-L76 HydrophobicContact CD2-CB 4.13Å; L70-L76 HydrophobicContact CD2-CD1 3.56Å; L70-L76 HydrophobicContact CD2-CD2 3.62Å; L70-L76 HydrophobicContact CD2-CG 3.95Å; L70-L76 HydrophobicContact CG-CD1 4.19Å; L70-L76 VanDerWaalsContact O-CB 3.23Å; L70-L76 WeakPolarHBondContact O-CB 3.27Å; L70-F80 HydrophobicContact CB-CE2 3.95Å; L70-F80 HydrophobicContact CD1-CE2 4.32Å; L70-F80 HydrophobicContact CD1-CZ 4.31Å; L70-F80 HydrophobicContact CD2-CE2 3.51Å; L70-F80 HydrophobicContact CD2-CZ 4.03Å; L70-F80 HydrophobicContact CG-CE2 4.12Å
71	F	64.5	Low	62.8	Low	118 Å²	118	80.2 Å²	80.2	52%	0.518	47%	0.466	S	S	.	.	H	α-helix	trans	-78	-21.2	174.8	-66.4	-60	0	0	0	113.5	L67 L77	L67-F71 HydrophobicContact CB-CD2 4.01Å; L67-F71 HydrophobicContact CB-CE2 3.61Å; L67-F71 HydrophobicContact CB-CZ 4.45Å; L67-F71 HydrophobicContact CD1-CE2 3.93Å; L67-F71 HydrophobicContact CD1-CZ 4.12Å; L67-F71 HydrophobicContact CD2-CD2 4.4Å; L67-F71 HydrophobicContact CD2-CE1 4.47Å; L67-F71 HydrophobicContact CD2-CE2 3.77Å; L67-F71 HydrophobicContact CD2-CZ 3.78Å; L67-F71 HydrophobicContact CG-CE2 3.98Å; L67-F71 HydrophobicContact CG-CZ 4.35Å; L67-F71 WeakPolarHBondContact O-CD2 3.18Å; L67-F71 WeakPolarHBondContact O-CG 3.46Å; L67-F71 PolarHBondContact O-N 3.33Å; F71-L77 HydrophobicContact CB-CD2 4.36Å; F71-L77 HydrophobicContact CD1-CD2 3.6Å; F71-L77 HydrophobicContact CE1-CD2 4.45Å; F71-L77 HydrophobicContact CG-CD2 4.45Å; F71-L77 WeakPolarHBondContact O-CD1 3.41Å
72	S	68.6	Low	64.4	Low	100 Å²	100	76.2 Å²	76.2	70%	0.699	44%	0.438	S	S	*	.	H	α-helix	trans	-81.7	-18.1	178.1	-59.3	0	0	0	0	112.8	G68 G69	G68-S72 WeakPolarHBondContact O-CB 3.49Å; G68-S72 PolarHBondContact O-N 3.16Å; G68-S72 VanDerWaalsContact O-N 3.14Å; G68-S72 PolarHBondContact O-OG 3.2Å; G69-S72 PolarHBondContact O-N 2.79Å
73	D	68.4	Low	66.1	Low	21 Å²	21	77.3 Å²	77.3	11%	0.112	44%	0.443	C	S	.	.			trans	-97.3	112.9	178.4	-161.8	-32.9	0	0	0	109.6	G69 E75 L76 L77 L114 K118	G69-D73 PolarHBondContact O-N 2.69Å; D73-E75 PolarHBondContact O-N 3.34Å; D73-E75 VanDerWaalsContact O-N 3.1Å; D73-E75 PolarHBondContact OD1-N 2.82Å; D73-E75 VanDerWaalsContact OD1-N 3.12Å; D73-L76 HydrophobicContact CB-CB 4.01Å; D73-L76 HydrophobicContact CB-CD1 3.68Å; D73-L76 HydrophobicContact CB-CG 3.97Å; D73-L76 PolarHBondContact O-N 2.83Å; D73-L76 VanDerWaalsContact O-N 3.07Å; D73-L77 PolarHBondContact O-N 3.13Å; D73-L114 WeakPolarHBondContact OD2-CD1 3.5Å; D73-K118 IonicContact OD2-NZ 2.69Å; D73-K118 PolarHBondContact OD2-NZ 3.4Å
74	P	74	Confident	67.7	Low	86 Å²	86	75 Å²	75	56%	0.558	42%	0.417	S	S	*	.	H	α-helix	trans	-60.1	-23.3	-179	26.4	-35.4	0	0	0	112.5	K78	P74-K78 WeakPolarHBondContact O-CG 3.45Å; P74-K78 PolarHBondContact O-N 2.87Å
75	E	73.2	Confident	69	Low	59 Å²	59	69 Å²	69	28%	0.276	39%	0.388	S	S	.	.	H	α-helix	trans	-77.5	-38.8	176.4	-60.9	-160.4	154.6	0	0	112.1	D73 L77 K78 I79 L114	D73-E75 PolarHBondContact O-N 3.34Å; D73-E75 VanDerWaalsContact O-N 3.1Å; D73-E75 PolarHBondContact OD1-N 2.82Å; D73-E75 VanDerWaalsContact OD1-N 3.12Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-K78 WeakPolarHBondContact O-CB 3.48Å; E75-K78 PolarHBondContact O-N 3.35Å; E75-I79 WeakPolarHBondContact O-CD1 3.46Å; E75-I79 WeakPolarHBondContact O-CG1 3.31Å; E75-I79 PolarHBondContact O-N 2.91Å; E75-L114 HydrophobicContact CB-CB 4.46Å; E75-L114 HydrophobicContact CB-CD1 4.11Å; E75-L114 WeakPolarHBondContact OE2-CA 3.3Å; E75-L114 WeakPolarHBondContact OE2-CB 3.4Å; E75-L114 PolarHBondContact OE2-N 2.86Å
76	L	72.5	Confident	70.6	Confident	18 Å²	18	64.6 Å²	64.6	9%	0.094	36%	0.361	C	S	.	.	H	α-helix	trans	-65.8	-39.2	174.6	-72.2	166.8	0	0	0	110.9	L70 D73 K78 I79 F80 F89 L114	L70-L76 HydrophobicContact CB-CB 4.5Å; L70-L76 HydrophobicContact CB-CD1 4.42Å; L70-L76 HydrophobicContact CD2-CB 4.13Å; L70-L76 HydrophobicContact CD2-CD1 3.56Å; L70-L76 HydrophobicContact CD2-CD2 3.62Å; L70-L76 HydrophobicContact CD2-CG 3.95Å; L70-L76 HydrophobicContact CG-CD1 4.19Å; L70-L76 VanDerWaalsContact O-CB 3.23Å; L70-L76 WeakPolarHBondContact O-CB 3.27Å; D73-L76 HydrophobicContact CB-CB 4.01Å; D73-L76 HydrophobicContact CB-CD1 3.68Å; D73-L76 HydrophobicContact CB-CG 3.97Å; D73-L76 PolarHBondContact O-N 2.83Å; D73-L76 VanDerWaalsContact O-N 3.07Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 2.86Å; L76-I79 HydrophobicContact CD2-CD1 4.02Å; L76-I79 WeakPolarHBondContact O-CB 3.31Å; L76-I79 PolarHBondContact O-N 2.93Å; L76-I79 VanDerWaalsContact O-N 3.12Å; L76-F80 WeakPolarHBondContact O-CD2 3.23Å; L76-F80 PolarHBondContact O-N 3.5Å; L76-F89 HydrophobicContact CD2-CE1 4.3Å; L76-F89 HydrophobicContact CD2-CZ 4.23Å; L76-L114 HydrophobicContact CD1-CD2 4.34Å; L76-L114 HydrophobicContact CD2-CD2 3.19Å; L76-L114 HydrophobicContact CG-CD2 3.51Å
77	L	77.1	Confident	72.1	Confident	53 Å²	53	61.3 Å²	61.3	28%	0.277	35%	0.347	S	S	.	.	H	α-helix	trans	-55.3	-44.2	171.7	-73.1	179.9	0	0	0	112.3	F71 D73 E75 F80 Q81	F71-L77 HydrophobicContact CB-CD2 4.36Å; F71-L77 HydrophobicContact CD1-CD2 3.6Å; F71-L77 HydrophobicContact CE1-CD2 4.45Å; F71-L77 HydrophobicContact CG-CD2 4.45Å; F71-L77 WeakPolarHBondContact O-CD1 3.41Å; D73-L77 PolarHBondContact O-N 3.13Å; E75-L77 VanDerWaalsContact C-N 3.33Å; L77-F80 PolarHBondContact O-N 2.8Å; L77-Q81 WeakPolarHBondContact O-CB 3.36Å; L77-Q81 WeakPolarHBondContact O-CG 3.39Å; L77-Q81 PolarHBondContact O-N 3.44Å
78	K	75.3	Confident	73.5	Confident	110 Å²	110	59.5 Å²	59.5	48%	0.478	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.1	-70.6	172.1	-178.1	176.7	0	111.5	P74 E75 L76 F80 Q81 D82	P74-K78 WeakPolarHBondContact O-CG 3.45Å; P74-K78 PolarHBondContact O-N 2.87Å; E75-K78 WeakPolarHBondContact O-CB 3.48Å; E75-K78 PolarHBondContact O-N 3.35Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 2.86Å; K78-F80 VanDerWaalsContact C-N 3.31Å; K78-F80 PolarHBondContact O-N 2.94Å; K78-Q81 PolarHBondContact O-N 2.86Å; K78-D82 WeakPolarHBondContact O-CB 3.35Å; K78-D82 PolarHBondContact O-N 2.79Å
79	I	74	Confident	74.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-39.1	177.1	-68.3	155.2	0	0	0	111.8	E75 L76 D82 L85 A86 F89 L111 L114	E75-I79 WeakPolarHBondContact O-CD1 3.46Å; E75-I79 WeakPolarHBondContact O-CG1 3.31Å; E75-I79 PolarHBondContact O-N 2.91Å; L76-I79 HydrophobicContact CD2-CD1 4.02Å; L76-I79 WeakPolarHBondContact O-CB 3.31Å; L76-I79 PolarHBondContact O-N 2.93Å; L76-I79 VanDerWaalsContact O-N 3.12Å; I79-D82 VanDerWaalsContact O-O 3.1Å; I79-L85 HydrophobicContact CB-CB 4.24Å; I79-L85 HydrophobicContact CG1-CB 4.34Å; I79-L85 HydrophobicContact CG1-CD1 4.29Å; I79-L85 HydrophobicContact CG2-CB 3.97Å; I79-A86 PolarHBondContact O-N 2.87Å; I79-F89 HydrophobicContact CG2-CB 3.84Å; I79-F89 HydrophobicContact CG2-CG 4.29Å; I79-L111 HydrophobicContact CD1-CB 4.05Å; I79-L111 HydrophobicContact CD1-CD1 3.43Å; I79-L111 VanDerWaalsContact CD1-CD1 3.43Å; I79-L111 HydrophobicContact CD1-CG 4.25Å; I79-L111 HydrophobicContact CG1-CB 4.06Å; I79-L111 HydrophobicContact CG1-CD1 4.13Å; I79-L114 HydrophobicContact CD1-CB 4.46Å; I79-L114 HydrophobicContact CD1-CD2 3.45Å; I79-L114 VanDerWaalsContact CD1-CD2 3.45Å
80	F	74.8	Confident	75.9	Confident	94 Å²	94	62.7 Å²	62.7	41%	0.412	33%	0.331	S	S	.	.	H	α-helix	trans	-76	-29.5	176	-80.6	-72.8	0	0	0	113.8	L70 L76 L77 K78	L70-F80 HydrophobicContact CB-CE2 3.95Å; L70-F80 HydrophobicContact CD1-CE2 4.32Å; L70-F80 HydrophobicContact CD1-CZ 4.31Å; L70-F80 HydrophobicContact CD2-CE2 3.51Å; L70-F80 HydrophobicContact CD2-CZ 4.03Å; L70-F80 HydrophobicContact CG-CE2 4.12Å; L76-F80 WeakPolarHBondContact O-CD2 3.23Å; L76-F80 PolarHBondContact O-N 3.5Å; L77-F80 PolarHBondContact O-N 2.8Å; K78-F80 VanDerWaalsContact C-N 3.31Å; K78-F80 PolarHBondContact O-N 2.94Å
81	Q	78.7	Confident	77.1	Confident	144 Å²	144	63.2 Å²	63.2	67%	0.673	33%	0.334	S	S	*	.	H	α-helix	trans	-73.5	-32	175	-74.4	173.2	26.1	0	0	111.5	L77 K78 P83	L77-Q81 WeakPolarHBondContact O-CB 3.36Å; L77-Q81 WeakPolarHBondContact O-CG 3.39Å; L77-Q81 PolarHBondContact O-N 3.44Å; K78-Q81 PolarHBondContact O-N 2.86Å; Q81-P83 WeakPolarHBondContact O-CD 2.92Å
82	D	78.7	Confident	77.9	Confident	51 Å²	51	58 Å²	58	27%	0.273	31%	0.311	S	S	.	.	S	Bend	trans	-83.4	115.9	178.7	-78.6	-39.3	0	0	0	111.2	K78 I79 E84 L85 A86	K78-D82 WeakPolarHBondContact O-CB 3.35Å; K78-D82 PolarHBondContact O-N 2.79Å; I79-D82 VanDerWaalsContact O-O 3.1Å; D82-E84 PolarHBondContact O-N 3.34Å; D82-L85 HydrophobicContact CB-CB 3.81Å; D82-L85 HydrophobicContact CB-CD1 3.76Å; D82-L85 HydrophobicContact CB-CG 3.61Å; D82-L85 PolarHBondContact O-N 3.34Å; D82-L85 VanDerWaalsContact OD2-CD1 3.25Å; D82-L85 WeakPolarHBondContact OD2-CD1 3.11Å; D82-A86 PolarHBondContact O-N 3.33Å
83	P	79.2	Confident	78.4	Confident	109 Å²	109	58.2 Å²	58.2	71%	0.708	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.3	-177.8	26.8	-35.4	0	0	0	113.3	Q81 P87	Q81-P83 WeakPolarHBondContact O-CD 2.92Å; P83-P87 WeakPolarHBondContact O-CD 3.48Å; P83-P87 WeakPolarHBondContact O-CG 3.1Å
84	E	79.1	Confident	79.3	Confident	85 Å²	85	61.3 Å²	61.3	40%	0.397	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-26	176.7	-63.6	-175.6	155.1	0	0	112.8	D82 P87 A88 N105 K107	D82-E84 PolarHBondContact O-N 3.34Å; E84-P87 WeakPolarHBondContact O-CG 3.39Å; E84-A88 VanDerWaalsContact O-CB 3.3Å; E84-A88 WeakPolarHBondContact O-CB 3.28Å; E84-A88 PolarHBondContact O-N 3.5Å; E84-N105 PolarHBondContact OE2-ND2 3.38Å; E84-K107 IonicContact OE2-NZ 2.67Å; E84-K107 PolarHBondContact OE2-NZ 3.21Å
85	L	80.5	Confident	79.9	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-87.2	-34.3	-176.4	-61.4	-173.1	0	0	0	112.6	I79 D82 A88 F89 K107 F108	I79-L85 HydrophobicContact CB-CB 4.24Å; I79-L85 HydrophobicContact CG1-CB 4.34Å; I79-L85 HydrophobicContact CG1-CD1 4.29Å; I79-L85 HydrophobicContact CG2-CB 3.97Å; D82-L85 HydrophobicContact CB-CB 3.81Å; D82-L85 HydrophobicContact CB-CD1 3.76Å; D82-L85 HydrophobicContact CB-CG 3.61Å; D82-L85 PolarHBondContact O-N 3.34Å; D82-L85 VanDerWaalsContact OD2-CD1 3.25Å; D82-L85 WeakPolarHBondContact OD2-CD1 3.11Å; L85-A88 PolarHBondContact O-N 3.47Å; L85-F89 WeakPolarHBondContact O-CB 3.26Å; L85-F89 PolarHBondContact O-N 3.34Å; L85-K107 HydrophobicContact CD1-CB 4.4Å; L85-K107 WeakPolarHBondContact CD1-O 3.45Å; L85-K107 HydrophobicContact CD2-CB 4.05Å; L85-K107 HydrophobicContact CG-CB 4.35Å; L85-F108 HydrophobicContact CD2-CB 4.01Å; L85-F108 HydrophobicContact CD2-CD2 4.13Å
86	A	81.8	Confident	80.2	Confident	25 Å²	25	62.9 Å²	62.9	21%	0.207	34%	0.342	C	S	.	.	H	α-helix	trans	-55	-52.7	174.3	0	0	0	0	0	113	I79 D82 A88 Q90	I79-A86 PolarHBondContact O-N 2.87Å; D82-A86 PolarHBondContact O-N 3.33Å; A86-A88 VanDerWaalsContact C-N 3.33Å; A86-Q90 WeakPolarHBondContact O-CG 3.38Å; A86-Q90 PolarHBondContact O-N 3.44Å
87	P	85.3	Confident	80.8	Confident	61 Å²	61	63.8 Å²	63.8	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-67.8	-35.1	175.8	27.5	-34.7	0	0	0	111.6	P83 E84 F89 Q90 D91	P83-P87 WeakPolarHBondContact O-CD 3.48Å; P83-P87 WeakPolarHBondContact O-CG 3.1Å; E84-P87 WeakPolarHBondContact O-CG 3.39Å; P87-F89 PolarHBondContact O-N 2.8Å; P87-Q90 PolarHBondContact O-N 3.4Å; P87-D91 VanDerWaalsContact O-CB 3.23Å; P87-D91 WeakPolarHBondContact O-CB 3.4Å; P87-D91 PolarHBondContact O-N 2.85Å
88	A	83.2	Confident	81.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-44.7	178.1	0	0	0	0	0	111.9	E84 L85 A86 Q90 D91 I92 Y102 F108 L111	E84-A88 VanDerWaalsContact O-CB 3.3Å; E84-A88 WeakPolarHBondContact O-CB 3.28Å; E84-A88 PolarHBondContact O-N 3.5Å; L85-A88 PolarHBondContact O-N 3.47Å; A86-A88 VanDerWaalsContact C-N 3.33Å; A88-Q90 PolarHBondContact O-N 2.79Å; A88-D91 PolarHBondContact O-N 2.87Å; A88-I92 WeakPolarHBondContact O-CD1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.49Å; A88-I92 PolarHBondContact O-N 3.24Å; A88-Y102 HydrophobicContact CB-CD1 3.41Å; A88-Y102 VanDerWaalsContact CB-CD1 3.41Å; A88-Y102 HydrophobicContact CB-CD2 3.82Å; A88-Y102 HydrophobicContact CB-CE1 3.45Å; A88-Y102 VanDerWaalsContact CB-CE1 3.45Å; A88-Y102 HydrophobicContact CB-CE2 3.88Å; A88-Y102 HydrophobicContact CB-CG 3.61Å; A88-F108 HydrophobicContact CB-CD2 3.87Å; A88-F108 HydrophobicContact CB-CE2 3.77Å; A88-L111 HydrophobicContact CB-CD2 4.28Å
89	F	81	Confident	81.4	Confident	19 Å²	19	58.2 Å²	58.2	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-45.3	176.5	-179.4	-125.6	0	0	0	112	L76 I79 L85 P87 D91 I92 M93 L111 F119	L76-F89 HydrophobicContact CD2-CE1 4.3Å; L76-F89 HydrophobicContact CD2-CZ 4.23Å; I79-F89 HydrophobicContact CG2-CB 3.84Å; I79-F89 HydrophobicContact CG2-CG 4.29Å; L85-F89 WeakPolarHBondContact O-CB 3.26Å; L85-F89 PolarHBondContact O-N 3.34Å; P87-F89 PolarHBondContact O-N 2.8Å; F89-D91 VanDerWaalsContact C-N 3.31Å; F89-D91 PolarHBondContact O-N 3.45Å; F89-I92 PolarHBondContact O-N 2.85Å; F89-M93 HydrophobicContact CD1-CE 3.39Å; F89-M93 HydrophobicContact CD1-SD 4.26Å; F89-M93 HydrophobicContact CD2-CE 4.31Å; F89-M93 HydrophobicContact CD2-CG 4.18Å; F89-M93 HydrophobicContact CD2-SD 4.38Å; F89-M93 HydrophobicContact CE1-CE 3.18Å; F89-M93 HydrophobicContact CE1-SD 3.61Å; F89-M93 HydrophobicContact CE2-CE 4.17Å; F89-M93 HydrophobicContact CE2-CG 3.91Å; F89-M93 HydrophobicContact CE2-SD 3.78Å; F89-M93 HydrophobicContact CG-CE 3.99Å; F89-M93 HydrophobicContact CZ-CE 3.63Å; F89-M93 HydrophobicContact CZ-CG 4.13Å; F89-M93 HydrophobicContact CZ-SD 3.35Å; F89-M93 WeakPolarHBondContact CZ-SD 3.36Å; F89-M93 WeakPolarHBondContact O-CB 3.49Å; F89-M93 VanDerWaalsContact O-CG 3.31Å; F89-M93 WeakPolarHBondContact O-CG 3.46Å; F89-M93 PolarHBondContact O-N 2.96Å; F89-L111 HydrophobicContact CB-CD1 4.1Å; F89-L111 HydrophobicContact CB-CD2 3.73Å; F89-L111 HydrophobicContact CD2-CD1 3.4Å; F89-L111 VanDerWaalsContact CD2-CD1 3.4Å; F89-L111 HydrophobicContact CD2-CD2 4.42Å; F89-L111 HydrophobicContact CE2-CD1 4.12Å; F89-L111 HydrophobicContact CG-CD1 4.05Å; F89-F119 HydrophobicContact CE2-CE2 4.17Å; F89-F119 HydrophobicContact CZ-CE2 4.38Å
90	Q	84.2	Confident	81.9	Confident	128 Å²	128	65 Å²	65	60%	0.598	36%	0.361	S	S	*	.	H	α-helix	trans	-61.6	-41.2	174.9	-70.4	-177.3	-20.6	0	0	112	A86 P87 A88 M93 A94	A86-Q90 WeakPolarHBondContact O-CG 3.38Å; A86-Q90 PolarHBondContact O-N 3.44Å; P87-Q90 PolarHBondContact O-N 3.4Å; A88-Q90 PolarHBondContact O-N 2.79Å; Q90-M93 PolarHBondContact O-N 2.91Å; Q90-A94 VanDerWaalsContact O-CB 3.31Å; Q90-A94 WeakPolarHBondContact O-CB 3.23Å; Q90-A94 PolarHBondContact O-N 2.96Å
91	D	85.5	Confident	82.3	Confident	44 Å²	44	67 Å²	67	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-69.6	-38.4	-178.4	-166.2	34.9	0	0	0	112.4	P87 A88 F89 N95 N98 Y102	P87-D91 VanDerWaalsContact O-CB 3.23Å; P87-D91 WeakPolarHBondContact O-CB 3.4Å; P87-D91 PolarHBondContact O-N 2.85Å; A88-D91 PolarHBondContact O-N 2.87Å; F89-D91 VanDerWaalsContact C-N 3.31Å; F89-D91 PolarHBondContact O-N 3.45Å; D91-N95 PolarHBondContact O-N 2.87Å; D91-N98 PolarHBondContact OD1-ND2 3.24Å; D91-N98 VanDerWaalsContact OD2-CB 3.27Å; D91-N98 WeakPolarHBondContact OD2-CB 3.41Å; D91-N98 PolarHBondContact OD2-ND2 3.46Å; D91-Y102 HydrophobicContact CB-CE2 3.98Å; D91-Y102 WeakPolarHBondContact CB-OH 3.46Å; D91-Y102 VanDerWaalsContact OD2-CE2 3.29Å; D91-Y102 WeakPolarHBondContact OD2-CE2 3.34Å; D91-Y102 PolarHBondContact OD2-OH 3Å
92	I	80.9	Confident	82.6	Confident	8 Å²	8	62.7 Å²	62.7	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-68.3	-43.6	172	-52.7	153	0	0	0	111.2	A88 F89 A94 N95 P96 M99 Y102 F108 L111 M115	A88-I92 WeakPolarHBondContact O-CD1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.49Å; A88-I92 PolarHBondContact O-N 3.24Å; F89-I92 PolarHBondContact O-N 2.85Å; I92-A94 PolarHBondContact O-N 3.23Å; I92-N95 WeakPolarHBondContact CA-O 3.26Å; I92-N95 CarbonylContact O-C 2.98Å; I92-N95 PolarHBondContact O-N 2.93Å; I92-N95 VanDerWaalsContact O-N 3.12Å; I92-P96 WeakPolarHBondContact O-CA 3.39Å; I92-P96 VanDerWaalsContact O-N 3.11Å; I92-M99 HydrophobicContact CD1-CE 4.36Å; I92-M99 HydrophobicContact CG1-CB 4.28Å; I92-M99 HydrophobicContact CG2-CB 4.27Å; I92-Y102 HydrophobicContact CG1-CD2 4.49Å; I92-F108 HydrophobicContact CD1-CE1 4.4Å; I92-F108 HydrophobicContact CD1-CE2 3.33Å; I92-F108 HydrophobicContact CD1-CZ 3.17Å; I92-F108 HydrophobicContact CG1-CE2 4.03Å; I92-F108 HydrophobicContact CG1-CZ 3.79Å; I92-L111 HydrophobicContact CD1-CD2 3.77Å; I92-L111 HydrophobicContact CD1-CG 4.1Å; I92-M115 HydrophobicContact CG2-CE 4.47Å; I92-M115 HydrophobicContact CG2-SD 3.56Å; I92-M115 VanDerWaalsContact CG2-SD 3.56Å
93	M	79.6	Confident	82.6	Confident	105 Å²	105	65.7 Å²	65.7	52%	0.517	36%	0.361	S	S	.	.	H	α-helix	trans	-63	-35.5	179.5	-78.7	-164.5	-63.2	0	0	111.2	F89 Q90	F89-M93 HydrophobicContact CD1-CE 3.39Å; F89-M93 HydrophobicContact CD1-SD 4.26Å; F89-M93 HydrophobicContact CD2-CE 4.31Å; F89-M93 HydrophobicContact CD2-CG 4.18Å; F89-M93 HydrophobicContact CD2-SD 4.38Å; F89-M93 HydrophobicContact CE1-CE 3.18Å; F89-M93 HydrophobicContact CE1-SD 3.61Å; F89-M93 HydrophobicContact CE2-CE 4.17Å; F89-M93 HydrophobicContact CE2-CG 3.91Å; F89-M93 HydrophobicContact CE2-SD 3.78Å; F89-M93 HydrophobicContact CG-CE 3.99Å; F89-M93 HydrophobicContact CZ-CE 3.63Å; F89-M93 HydrophobicContact CZ-CG 4.13Å; F89-M93 HydrophobicContact CZ-SD 3.35Å; F89-M93 WeakPolarHBondContact CZ-SD 3.36Å; F89-M93 WeakPolarHBondContact O-CB 3.49Å; F89-M93 VanDerWaalsContact O-CG 3.31Å; F89-M93 WeakPolarHBondContact O-CG 3.46Å; F89-M93 PolarHBondContact O-N 2.96Å; Q90-M93 PolarHBondContact O-N 2.91Å
94	A	86.5	Confident	82.6	Confident	86 Å²	86	67 Å²	67	71%	0.711	36%	0.362	S	S	*	.	H	α-helix	trans	-72.5	-37.3	172.5	0	0	0	0	0	112	Q90 I92	Q90-A94 VanDerWaalsContact O-CB 3.31Å; Q90-A94 WeakPolarHBondContact O-CB 3.23Å; Q90-A94 PolarHBondContact O-N 2.96Å; I92-A94 PolarHBondContact O-N 3.23Å
95	N	85.9	Confident	82.4	Confident	83 Å²	83	65 Å²	65	44%	0.444	35%	0.354	S	S	.	.			trans	-149.1	106.4	-179.1	-162.4	-30.9	0	0	0	111.6	D91 I92 G97 N98	D91-N95 PolarHBondContact O-N 2.87Å; I92-N95 WeakPolarHBondContact CA-O 3.26Å; I92-N95 CarbonylContact O-C 2.98Å; I92-N95 PolarHBondContact O-N 2.93Å; I92-N95 VanDerWaalsContact O-N 3.12Å; N95-G97 PolarHBondContact O-N 2.88Å; N95-G97 PolarHBondContact OD1-N 3.25Å; N95-N98 WeakPolarHBondContact O-CB 3.25Å; N95-N98 PolarHBondContact O-N 3.14Å
96	P	80	Confident	82.3	Confident	96 Å²	96	70.3 Å²	70.3	62%	0.623	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-61.4	-21.6	-175.2	22.9	-33.1	0	0	0	113.3	I92 N98 M99	I92-P96 WeakPolarHBondContact O-CA 3.39Å; I92-P96 VanDerWaalsContact O-N 3.11Å; P96-N98 VanDerWaalsContact C-N 3.26Å; P96-N98 PolarHBondContact O-N 3.07Å; P96-M99 WeakPolarHBondContact O-CB 3.42Å; P96-M99 PolarHBondContact O-N 2.89Å
97	G	85.7	Confident	82	Confident	37 Å²	37	73.4 Å²	73.4	38%	0.381	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-68.3	-19.7	174.4	0	0	0	0	0	114.3	N95 M99 F100	N95-G97 PolarHBondContact O-N 2.88Å; N95-G97 PolarHBondContact OD1-N 3.25Å; G97-M99 PolarHBondContact O-N 3.48Å; G97-F100 WeakPolarHBondContact O-CD2 3.27Å
98	N	85.4	Confident	81.6	Confident	24 Å²	24	70.6 Å²	70.6	13%	0.128	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-73.3	-13.4	178.7	-74.8	-25.7	0	0	0	113	D91 N95 P96 F100 K101 Y102	D91-N98 PolarHBondContact OD1-ND2 3.24Å; D91-N98 VanDerWaalsContact OD2-CB 3.27Å; D91-N98 WeakPolarHBondContact OD2-CB 3.41Å; D91-N98 PolarHBondContact OD2-ND2 3.46Å; N95-N98 WeakPolarHBondContact O-CB 3.25Å; N95-N98 PolarHBondContact O-N 3.14Å; P96-N98 VanDerWaalsContact C-N 3.26Å; P96-N98 PolarHBondContact O-N 3.07Å; N98-F100 PolarHBondContact O-N 3.44Å; N98-F100 VanDerWaalsContact O-N 3.16Å; N98-K101 WeakPolarHBondContact O-CB 3.38Å; N98-K101 PolarHBondContact O-N 3.09Å; N98-K101 PolarHBondContact OD1-NZ 3.31Å; N98-Y102 HydrophobicContact CB-CE2 4.3Å; N98-Y102 WeakPolarHBondContact O-CD2 3.35Å
99	M	80	Confident	81.3	Confident	22 Å²	22	72.9 Å²	72.9	11%	0.108	40%	0.398	C	S	.	.	H	α-helix	trans	-51.7	-37.4	172.5	170.9	163.4	-91.4	0	0	112.8	I92 P96 G97 K101 Y102 M103 F108 L112 M115	I92-M99 HydrophobicContact CD1-CE 4.36Å; I92-M99 HydrophobicContact CG1-CB 4.28Å; I92-M99 HydrophobicContact CG2-CB 4.27Å; P96-M99 WeakPolarHBondContact O-CB 3.42Å; P96-M99 PolarHBondContact O-N 2.89Å; G97-M99 PolarHBondContact O-N 3.48Å; M99-K101 PolarHBondContact O-N 3.08Å; M99-Y102 PolarHBondContact O-N 3.41Å; M99-Y102 VanDerWaalsContact O-N 3.13Å; M99-M103 PolarHBondContact O-N 3.3Å; M99-F108 HydrophobicContact CB-CZ 4.38Å; M99-F108 HydrophobicContact CE-CE1 3.69Å; M99-F108 HydrophobicContact CE-CZ 3.86Å; M99-F108 HydrophobicContact CG-CE1 3.84Å; M99-F108 HydrophobicContact CG-CZ 4.07Å; M99-L112 HydrophobicContact CE-CB 4.38Å; M99-L112 HydrophobicContact CE-CD1 3.26Å; M99-L112 HydrophobicContact CE-CG 4.4Å; M99-L112 HydrophobicContact SD-CD1 3.45Å; M99-L112 WeakPolarHBondContact SD-CD1 3.3Å; M99-M115 HydrophobicContact CE-CB 4.26Å; M99-M115 HydrophobicContact CE-CE 3.22Å; M99-M115 HydrophobicContact CE-CG 4.44Å; M99-M115 HydrophobicContact CE-SD 3.42Å; M99-M115 WeakPolarHBondContact CE-SD 3.45Å; M99-M115 HydrophobicContact SD-CE 3.43Å; M99-M115 WeakPolarHBondContact SD-CE 3.28Å; M99-M115 HydrophobicContact SD-SD 4.35Å
100	F	84.1	Confident	81.1	Confident	144 Å²	144	74 Å²	74	63%	0.632	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-29.7	179.8	-68	-71.5	0	0	0	113.6	G97 N98 Y102 M103	G97-F100 WeakPolarHBondContact O-CD2 3.27Å; N98-F100 PolarHBondContact O-N 3.44Å; N98-F100 VanDerWaalsContact O-N 3.16Å; F100-Y102 VanDerWaalsContact C-N 3.35Å; F100-M103 HydrophobicContact CD1-CE 4.5Å
101	K	84	Confident	80.7	Confident	135 Å²	135	68 Å²	68	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-67.8	-39.9	177.1	-65.3	173	176.5	160.8	0	111.3	N98 M99	N98-K101 WeakPolarHBondContact O-CB 3.38Å; N98-K101 PolarHBondContact O-N 3.09Å; N98-K101 PolarHBondContact OD1-NZ 3.31Å; M99-K101 PolarHBondContact O-N 3.08Å
102	Y	84.2	Confident	80.3	Confident	53 Å²	53	67.6 Å²	67.6	21%	0.208	38%	0.377	C	S	.	.	H	α-helix	trans	-90.4	-14.8	-177	-52.9	-75.4	0	0	0	113	A88 D91 I92 N98 M99 F100 N104 N105 F108	A88-Y102 HydrophobicContact CB-CD1 3.41Å; A88-Y102 VanDerWaalsContact CB-CD1 3.41Å; A88-Y102 HydrophobicContact CB-CD2 3.82Å; A88-Y102 HydrophobicContact CB-CE1 3.45Å; A88-Y102 VanDerWaalsContact CB-CE1 3.45Å; A88-Y102 HydrophobicContact CB-CE2 3.88Å; A88-Y102 HydrophobicContact CB-CG 3.61Å; D91-Y102 HydrophobicContact CB-CE2 3.98Å; D91-Y102 WeakPolarHBondContact CB-OH 3.46Å; D91-Y102 VanDerWaalsContact OD2-CE2 3.29Å; D91-Y102 WeakPolarHBondContact OD2-CE2 3.34Å; D91-Y102 PolarHBondContact OD2-OH 3Å; I92-Y102 HydrophobicContact CG1-CD2 4.49Å; N98-Y102 HydrophobicContact CB-CE2 4.3Å; N98-Y102 WeakPolarHBondContact O-CD2 3.35Å; M99-Y102 PolarHBondContact O-N 3.41Å; M99-Y102 VanDerWaalsContact O-N 3.13Å; F100-Y102 VanDerWaalsContact C-N 3.35Å; Y102-N104 PolarHBondContact O-N 3.12Å; Y102-N104 VanDerWaalsContact O-N 3.14Å; Y102-N105 WeakPolarHBondContact O-CA 3.46Å; Y102-N105 WeakPolarHBondContact O-CB 3.37Å; Y102-N105 PolarHBondContact O-N 3.49Å; Y102-F108 VanDerWaalsContact CB-CG 3.41Å; Y102-F108 AromaticContact CD2-CE2 3.85Å; Y102-F108 HydrophobicContact CD2-CE2 3.85Å; Y102-F108 HydrophobicContact CD2-CZ 4.24Å; Y102-F108 AromaticContact CG-CD2 3.88Å; Y102-F108 HydrophobicContact CG-CD2 3.88Å; Y102-F108 AromaticContact CG-CE2 3.68Å; Y102-F108 HydrophobicContact CG-CE2 3.68Å; Y102-F108 HydrophobicContact CG-CZ 4.28Å; Y102-F108 WeakPolarHBondContact O-CB 3.47Å; Y102-F108 WeakPolarHBondContact O-CG 3.37Å
103	M	78.8	Confident	80.1	Confident	114 Å²	114	71 Å²	71	56%	0.562	40%	0.395	S	S	*	.	H	α-helix	trans	-55.9	-28.6	171.5	-167.2	178	77.1	0	0	112.1	M99 F100 N105	M99-M103 PolarHBondContact O-N 3.3Å; F100-M103 HydrophobicContact CD1-CE 4.5Å; M103-N105 VanDerWaalsContact C-N 3.31Å
104	N	79.9	Confident	79.8	Confident	137 Å²	137	66.1 Å²	66.1	73%	0.733	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-12.7	174.5	-66.2	-33.7	0	0	0	113.8	Y102	Y102-N104 PolarHBondContact O-N 3.12Å; Y102-N104 VanDerWaalsContact O-N 3.14Å
105	N	75.2	Confident	79.1	Confident	42 Å²	42	63.4 Å²	63.4	23%	0.225	35%	0.345	C	S	.	.	S	Bend	trans	-95.7	118.3	178.3	-171.4	-27.3	0	0	0	109.6	E84 Y102 M103 K107 F108	E84-N105 PolarHBondContact OE2-ND2 3.38Å; Y102-N105 WeakPolarHBondContact O-CA 3.46Å; Y102-N105 WeakPolarHBondContact O-CB 3.37Å; Y102-N105 PolarHBondContact O-N 3.49Å; M103-N105 VanDerWaalsContact C-N 3.31Å; N105-K107 PolarHBondContact O-N 3.5Å; N105-K107 VanDerWaalsContact O-N 3.14Å; N105-K107 PolarHBondContact OD1-N 2.94Å; N105-K107 VanDerWaalsContact OD1-N 3.1Å; N105-F108 HydrophobicContact CB-CB 4.41Å; N105-F108 WeakPolarHBondContact O-CB 3.36Å; N105-F108 PolarHBondContact O-N 3.08Å
106	P	77.9	Confident	78.5	Confident	113 Å²	113	64.4 Å²	64.4	73%	0.734	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.3	-176.5	24.6	-35.2	0	0	0	113.6	F108 A109	P106-F108 PolarHBondContact O-N 3.1Å; P106-A109 VanDerWaalsContact O-CB 3.29Å; P106-A109 WeakPolarHBondContact O-CB 3.38Å; P106-A109 PolarHBondContact O-N 3.04Å
107	K	74	Confident	78.1	Confident	90 Å²	90	64.7 Å²	64.7	39%	0.391	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.2	177.5	-60.5	-178.1	-167.9	155.6	0	111.9	E84 L85 N105 A109 S110	E84-K107 IonicContact OE2-NZ 2.67Å; E84-K107 PolarHBondContact OE2-NZ 3.21Å; L85-K107 HydrophobicContact CD1-CB 4.4Å; L85-K107 WeakPolarHBondContact CD1-O 3.45Å; L85-K107 HydrophobicContact CD2-CB 4.05Å; L85-K107 HydrophobicContact CG-CB 4.35Å; N105-K107 PolarHBondContact O-N 3.5Å; N105-K107 VanDerWaalsContact O-N 3.14Å; N105-K107 PolarHBondContact OD1-N 2.94Å; N105-K107 VanDerWaalsContact OD1-N 3.1Å; K107-A109 PolarHBondContact O-N 3.01Å; K107-S110 PolarHBondContact O-N 3.48Å
108	F	77.9	Confident	77.1	Confident	3 Å²	3	68.8 Å²	68.8	1%	0.013	35%	0.352	C	S	.	.	H	α-helix	trans	-71.6	-11.4	-178.4	-171.6	-96.4	0	0	0	113.2	L85 A88 I92 M99 Y102 N105 P106 S110 L111 L112	L85-F108 HydrophobicContact CD2-CB 4.01Å; L85-F108 HydrophobicContact CD2-CD2 4.13Å; A88-F108 HydrophobicContact CB-CD2 3.87Å; A88-F108 HydrophobicContact CB-CE2 3.77Å; I92-F108 HydrophobicContact CD1-CE1 4.4Å; I92-F108 HydrophobicContact CD1-CE2 3.33Å; I92-F108 HydrophobicContact CD1-CZ 3.17Å; I92-F108 HydrophobicContact CG1-CE2 4.03Å; I92-F108 HydrophobicContact CG1-CZ 3.79Å; M99-F108 HydrophobicContact CB-CZ 4.38Å; M99-F108 HydrophobicContact CE-CE1 3.69Å; M99-F108 HydrophobicContact CE-CZ 3.86Å; M99-F108 HydrophobicContact CG-CE1 3.84Å; M99-F108 HydrophobicContact CG-CZ 4.07Å; Y102-F108 VanDerWaalsContact CB-CG 3.41Å; Y102-F108 AromaticContact CD2-CE2 3.85Å; Y102-F108 HydrophobicContact CD2-CE2 3.85Å; Y102-F108 HydrophobicContact CD2-CZ 4.24Å; Y102-F108 AromaticContact CG-CD2 3.88Å; Y102-F108 HydrophobicContact CG-CD2 3.88Å; Y102-F108 AromaticContact CG-CE2 3.68Å; Y102-F108 HydrophobicContact CG-CE2 3.68Å; Y102-F108 HydrophobicContact CG-CZ 4.28Å; Y102-F108 WeakPolarHBondContact O-CB 3.47Å; Y102-F108 WeakPolarHBondContact O-CG 3.37Å; N105-F108 HydrophobicContact CB-CB 4.41Å; N105-F108 WeakPolarHBondContact O-CB 3.36Å; N105-F108 PolarHBondContact O-N 3.08Å; P106-F108 PolarHBondContact O-N 3.1Å; F108-S110 VanDerWaalsContact C-N 3.26Å; F108-S110 PolarHBondContact O-N 2.94Å; F108-L111 HydrophobicContact CD2-CB 4.16Å; F108-L111 HydrophobicContact CD2-CD2 3.64Å; F108-L111 HydrophobicContact CD2-CG 4.19Å; F108-L111 HydrophobicContact CE2-CB 4.45Å; F108-L111 HydrophobicContact CE2-CD2 3.43Å; F108-L111 VanDerWaalsContact CE2-CD2 3.43Å; F108-L111 HydrophobicContact CE2-CG 3.99Å; F108-L111 HydrophobicContact CZ-CD2 4.28Å; F108-L111 HydrophobicContact CZ-CG 4.45Å; F108-L111 PolarHBondContact O-N 3.34Å; F108-L111 VanDerWaalsContact O-N 3.08Å; F108-L112 HydrophobicContact CD1-CB 4.31Å; F108-L112 HydrophobicContact CE1-CB 4.35Å; F108-L112 WeakPolarHBondContact O-CB 3.46Å; F108-L112 PolarHBondContact O-N 3.11Å
109	A	77.4	Confident	76	Confident	48 Å²	48	73.6 Å²	73.6	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-55.8	-40.9	173.7	0	0	0	0	0	112.2	P106 K107 L111 L112 N113	P106-A109 VanDerWaalsContact O-CB 3.29Å; P106-A109 WeakPolarHBondContact O-CB 3.38Å; P106-A109 PolarHBondContact O-N 3.04Å; K107-A109 PolarHBondContact O-N 3.01Å; A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 3.1Å; A109-L112 WeakPolarHBondContact O-CB 3.38Å; A109-L112 PolarHBondContact O-N 3.05Å; A109-N113 VanDerWaalsContact O-CG 3.27Å; A109-N113 PolarHBondContact O-N 3.4Å; A109-N113 PolarHBondContact O-ND2 3.33Å
110	S	75.5	Confident	74.9	Confident	43 Å²	43	77.3 Å²	77.3	30%	0.301	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-41.3	176.2	-55.6	0	0	0	0	111.6	K107 F108 N113 L114	K107-S110 PolarHBondContact O-N 3.48Å; F108-S110 VanDerWaalsContact C-N 3.26Å; F108-S110 PolarHBondContact O-N 2.94Å; S110-N113 PolarHBondContact O-N 3.49Å; S110-L114 PolarHBondContact O-N 3.28Å; S110-L114 VanDerWaalsContact O-N 3.09Å
111	L	75.8	Confident	73.4	Confident	1 Å²	1	76 Å²	76	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-71.5	-37.4	177.7	175	53.1	0	0	0	112.7	I79 A88 F89 I92 F108 A109 N113 L114 M115	I79-L111 HydrophobicContact CD1-CB 4.05Å; I79-L111 HydrophobicContact CD1-CD1 3.43Å; I79-L111 VanDerWaalsContact CD1-CD1 3.43Å; I79-L111 HydrophobicContact CD1-CG 4.25Å; I79-L111 HydrophobicContact CG1-CB 4.06Å; I79-L111 HydrophobicContact CG1-CD1 4.13Å; A88-L111 HydrophobicContact CB-CD2 4.28Å; F89-L111 HydrophobicContact CB-CD1 4.1Å; F89-L111 HydrophobicContact CB-CD2 3.73Å; F89-L111 HydrophobicContact CD2-CD1 3.4Å; F89-L111 VanDerWaalsContact CD2-CD1 3.4Å; F89-L111 HydrophobicContact CD2-CD2 4.42Å; F89-L111 HydrophobicContact CE2-CD1 4.12Å; F89-L111 HydrophobicContact CG-CD1 4.05Å; I92-L111 HydrophobicContact CD1-CD2 3.77Å; I92-L111 HydrophobicContact CD1-CG 4.1Å; F108-L111 HydrophobicContact CD2-CB 4.16Å; F108-L111 HydrophobicContact CD2-CD2 3.64Å; F108-L111 HydrophobicContact CD2-CG 4.19Å; F108-L111 HydrophobicContact CE2-CB 4.45Å; F108-L111 HydrophobicContact CE2-CD2 3.43Å; F108-L111 VanDerWaalsContact CE2-CD2 3.43Å; F108-L111 HydrophobicContact CE2-CG 3.99Å; F108-L111 HydrophobicContact CZ-CD2 4.28Å; F108-L111 HydrophobicContact CZ-CG 4.45Å; F108-L111 PolarHBondContact O-N 3.34Å; F108-L111 VanDerWaalsContact O-N 3.08Å; A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 3.1Å; L111-N113 VanDerWaalsContact C-N 3.31Å; L111-N113 PolarHBondContact O-N 3.38Å; L111-L114 PolarHBondContact O-N 3.38Å; L111-M115 WeakPolarHBondContact O-CB 3.41Å; L111-M115 PolarHBondContact O-N 2.99Å
112	L	77.9	Confident	71.9	Confident	35 Å²	35	74.4 Å²	74.4	18%	0.183	40%	0.403	C	S	.	.	H	α-helix	trans	-60.7	-41.6	172.8	179.9	72.6	0	0	0	111	M99 F108 A109 M115 K116	M99-L112 HydrophobicContact CE-CB 4.38Å; M99-L112 HydrophobicContact CE-CD1 3.26Å; M99-L112 HydrophobicContact CE-CG 4.4Å; M99-L112 HydrophobicContact SD-CD1 3.45Å; M99-L112 WeakPolarHBondContact SD-CD1 3.3Å; F108-L112 HydrophobicContact CD1-CB 4.31Å; F108-L112 HydrophobicContact CE1-CB 4.35Å; F108-L112 WeakPolarHBondContact O-CB 3.46Å; F108-L112 PolarHBondContact O-N 3.11Å; A109-L112 WeakPolarHBondContact O-CB 3.38Å; A109-L112 PolarHBondContact O-N 3.05Å; L112-M115 PolarHBondContact O-N 3.35Å; L112-K116 HydrophobicContact CG-CD 4.18Å; L112-K116 WeakPolarHBondContact O-CB 3.24Å; L112-K116 VanDerWaalsContact O-CG 3.25Å; L112-K116 WeakPolarHBondContact O-CG 3.39Å; L112-K116 PolarHBondContact O-N 3.4Å
113	N	77.1	Confident	70	Confident	79 Å²	79	75.4 Å²	75.4	42%	0.422	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-45.2	175.8	-71.1	-29.3	0	0	0	111.4	A109 S110 L111 M115 K116 T117	A109-N113 VanDerWaalsContact O-CG 3.27Å; A109-N113 PolarHBondContact O-N 3.4Å; A109-N113 PolarHBondContact O-ND2 3.33Å; S110-N113 PolarHBondContact O-N 3.49Å; L111-N113 VanDerWaalsContact C-N 3.31Å; L111-N113 PolarHBondContact O-N 3.38Å; N113-M115 VanDerWaalsContact C-N 3.32Å; N113-M115 PolarHBondContact O-N 3.47Å; N113-K116 PolarHBondContact O-N 3.48Å; N113-T117 WeakPolarHBondContact O-CB 2.97Å; N113-T117 PolarHBondContact O-N 3.13Å; N113-T117 PolarHBondContact O-OG1 3.47Å
114	L	72.6	Confident	68.3	Low	3 Å²	3	73.3 Å²	73.3	2%	0.016	44%	0.436	C	S	.	.	H	α-helix	trans	-59.4	-43.6	174.5	-175.2	67.8	0	0	0	111.9	D73 E75 L76 I79 S110 L111 T117 K118	D73-L114 WeakPolarHBondContact OD2-CD1 3.5Å; E75-L114 HydrophobicContact CB-CB 4.46Å; E75-L114 HydrophobicContact CB-CD1 4.11Å; E75-L114 WeakPolarHBondContact OE2-CA 3.3Å; E75-L114 WeakPolarHBondContact OE2-CB 3.4Å; E75-L114 PolarHBondContact OE2-N 2.86Å; L76-L114 HydrophobicContact CD1-CD2 4.34Å; L76-L114 HydrophobicContact CD2-CD2 3.19Å; L76-L114 HydrophobicContact CG-CD2 3.51Å; I79-L114 HydrophobicContact CD1-CB 4.46Å; I79-L114 HydrophobicContact CD1-CD2 3.45Å; I79-L114 VanDerWaalsContact CD1-CD2 3.45Å; S110-L114 PolarHBondContact O-N 3.28Å; S110-L114 VanDerWaalsContact O-N 3.09Å; L111-L114 PolarHBondContact O-N 3.38Å; L114-T117 PolarHBondContact O-N 3.42Å; L114-K118 HydrophobicContact CD1-CG 3.69Å; L114-K118 HydrophobicContact CG-CG 4.25Å; L114-K118 WeakPolarHBondContact O-CB 3.38Å; L114-K118 WeakPolarHBondContact O-CG 3.5Å; L114-K118 PolarHBondContact O-N 3.48Å
115	M	72.4	Confident	66.6	Low	30 Å²	30	70.9 Å²	70.9	15%	0.148	44%	0.436	C	S	.	.	H	α-helix	trans	-68	-39.9	-179.9	-161.2	179.8	96.1	0	0	111.9	I92 M99 L111 L112 N113 T117 F119 M120	I92-M115 HydrophobicContact CG2-CE 4.47Å; I92-M115 HydrophobicContact CG2-SD 3.56Å; I92-M115 VanDerWaalsContact CG2-SD 3.56Å; M99-M115 HydrophobicContact CE-CB 4.26Å; M99-M115 HydrophobicContact CE-CE 3.22Å; M99-M115 HydrophobicContact CE-CG 4.44Å; M99-M115 HydrophobicContact CE-SD 3.42Å; M99-M115 WeakPolarHBondContact CE-SD 3.45Å; M99-M115 HydrophobicContact SD-CE 3.43Å; M99-M115 WeakPolarHBondContact SD-CE 3.28Å; M99-M115 HydrophobicContact SD-SD 4.35Å; L111-M115 WeakPolarHBondContact O-CB 3.41Å; L111-M115 PolarHBondContact O-N 2.99Å; L112-M115 PolarHBondContact O-N 3.35Å; N113-M115 VanDerWaalsContact C-N 3.32Å; N113-M115 PolarHBondContact O-N 3.47Å; M115-T117 VanDerWaalsContact C-N 3.27Å; M115-T117 PolarHBondContact O-N 2.93Å; M115-F119 HydrophobicContact CG-CB 3.62Å; M115-F119 HydrophobicContact CG-CD2 4.15Å; M115-F119 HydrophobicContact CG-CG 4.17Å; M115-F119 CarbonylContact O-C 3.43Å; M115-F119 VanDerWaalsContact O-CA 3.3Å; M115-F119 WeakPolarHBondContact O-CA 3.3Å; M115-F119 WeakPolarHBondContact O-CB 3.47Å; M115-F119 PolarHBondContact O-N 3.16Å; M115-M120 PolarHBondContact O-N 2.89Å
116	K	72.6	Confident	65.2	Low	104 Å²	104	77.8 Å²	77.8	45%	0.452	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-36.2	171.5	-74.1	171.9	177.1	178.5	0	111.9	L112 N113 M120	L112-K116 HydrophobicContact CG-CD 4.18Å; L112-K116 WeakPolarHBondContact O-CB 3.24Å; L112-K116 VanDerWaalsContact O-CG 3.25Å; L112-K116 WeakPolarHBondContact O-CG 3.39Å; L112-K116 PolarHBondContact O-N 3.4Å; N113-K116 PolarHBondContact O-N 3.48Å; K116-M120 CarbonylContact O-C 3.51Å
117	T	71.6	Confident	63.6	Low	102 Å²	102	77.5 Å²	77.5	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-80.3	-36	-177.2	-54	0	0	0	0	112.4	N113 L114 M115	N113-T117 WeakPolarHBondContact O-CB 2.97Å; N113-T117 PolarHBondContact O-N 3.13Å; N113-T117 PolarHBondContact O-OG1 3.47Å; L114-T117 PolarHBondContact O-N 3.42Å; M115-T117 VanDerWaalsContact C-N 3.27Å; M115-T117 PolarHBondContact O-N 2.93Å
118	K	65.5	Low	61.9	Low	122 Å²	122	77 Å²	77	53%	0.53	49%	0.487	S	S	.	.	H	α-helix	trans	-106.8	-34.4	-172.5	-60.3	-61.2	-178.4	80.1	0	114.7	D73 L114	D73-K118 IonicContact OD2-NZ 2.69Å; D73-K118 PolarHBondContact OD2-NZ 3.4Å; L114-K118 HydrophobicContact CD1-CG 3.69Å; L114-K118 HydrophobicContact CG-CG 4.25Å; L114-K118 WeakPolarHBondContact O-CB 3.38Å; L114-K118 WeakPolarHBondContact O-CG 3.5Å; L114-K118 PolarHBondContact O-N 3.48Å
119	F	62	Low	60.3	Low	125 Å²	125	82.8 Å²	82.8	55%	0.548	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-20.8	-169.5	-73.3	-86.3	0	0	0	113.8	F89 M115 P121	F89-F119 HydrophobicContact CE2-CE2 4.17Å; F89-F119 HydrophobicContact CZ-CE2 4.38Å; M115-F119 HydrophobicContact CG-CB 3.62Å; M115-F119 HydrophobicContact CG-CD2 4.15Å; M115-F119 HydrophobicContact CG-CG 4.17Å; M115-F119 CarbonylContact O-C 3.43Å; M115-F119 VanDerWaalsContact O-CA 3.3Å; M115-F119 WeakPolarHBondContact O-CA 3.3Å; M115-F119 WeakPolarHBondContact O-CB 3.47Å; M115-F119 PolarHBondContact O-N 3.16Å; F119-P121 VanDerWaalsContact O-CD 3.31Å; F119-P121 WeakPolarHBondContact O-CD 3.34Å
120	M	56.7	Low	58.7	Low	101 Å²	101	90.4 Å²	90.4	50%	0.498	55%	0.547	S	S	.	.			trans	-117.4	74.7	174.2	-146.6	-158.7	-61.2	0	0	108.7	M115 K116 S122	M115-M120 PolarHBondContact O-N 2.89Å; K116-M120 CarbonylContact O-C 3.51Å; M120-S122 PolarHBondContact O-N 3.33Å
121	P	52.2	Low	57.1	Low	115 Å²	115	92.8 Å²	92.8	75%	0.747	57%	0.57	S	S	*	*			trans	-64.5	84.1	166.3	29.7	-32.1	0	0	0	107	F119 G123	F119-P121 VanDerWaalsContact O-CD 3.31Å; F119-P121 WeakPolarHBondContact O-CD 3.34Å; P121-G123 PolarHBondContact O-N 2.87Å
122	S	52.2	Low	55.6	Low	103 Å²	103	100.8 Å²	100.8	72%	0.72	61%	0.613	S	S	*	*			trans	-54.1	109.9	161.7	179.9	0	0	0	0	104.5	M120 G124	M120-S122 PolarHBondContact O-N 3.33Å; S122-G124 PolarHBondContact O-N 3.04Å
123	G	45.7	Very low	53.9	Low	74 Å²	74	105.1 Å²	105.1	76%	0.763	64%	0.641	S	S	*	*	S	Bend	trans	-51.8	136.7	175	0	0	0	0	0	109.3	P121	P121-G123 PolarHBondContact O-N 2.87Å
124	G	41.4	Very low	52.4	Low	69 Å²	69	108.5 Å²	108.5	71%	0.711	65%	0.654	S	S	*	*			trans	108.2	108.8	167.5	0	0	0	0	0	114.1	S122	S122-G124 PolarHBondContact O-N 3.04Å
125	A	45.1	Very low	50.9	Low	87 Å²	87	116.3 Å²	116.3	72%	0.719	69%	0.688	S	S	*	*			trans	81.2	127.3	142	0	0	0	0	0	118.6
126	Q	45.8	Very low	49.4	Very low	187 Å²	187	124.7 Å²	124.7	87%	0.874	73%	0.726	S	S	*	*			trans	73.5	97.5	145	-67.2	168.9	-44.9	0	0	117.3
127	S	43.9	Very low	48	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	75%	0.746	S	S	*	*				-168.8	87.9	108.9	-178.5	0	0	0	0	108.9	T129	S127-T129 PolarHBondContact O-N 3.49Å
128	G	39.4	Very low	46.9	Very low	79 Å²	79	132.2 Å²	132.2	81%	0.814	76%	0.756	S	S	*	*			trans	-72.8	113	160.6	0	0	0	0	0	108.9
129	T	44.1	Very low	46.1	Very low	126 Å²	126	136 Å²	136	77%	0.773	77%	0.773	S	S	*	*			trans	-147.1	74.8	154.5	49.9	0	0	0	0	107.3	S127	S127-T129 PolarHBondContact O-N 3.49Å
130	K	42.4	Very low	45.2	Very low	207 Å²	207	133.5 Å²	133.5	90%	0.9	78%	0.782	S	S	*	*			trans	-125.3	144	154.9	-93.7	-168.3	178.2	-177.9	0	106.7
131	A	43.5	Very low	45.3	Very low	93 Å²	93	134.2 Å²	134.2	77%	0.769	79%	0.794	S	S	*	*			trans	86.3	82.4	166.5	0	0	0	0	0	116.2
132	D	43	Very low	45.7	Very low	170 Å²	170	134.8 Å²	134.8	91%	0.909	80%	0.796	S	S	*	*			trans	-128.4	80.2	140	-105.6	-67.2	0	0	0	107.5
133	T	42.6	Very low	46.2	Very low	126 Å²	126	135.6 Å²	135.6	77%	0.773	80%	0.796	S	S	*	*			trans	-148.8	113.1	162.6	-62.8	0	0	0	0	107.1
134	E	45.5	Very low	47	Very low	149 Å²	149	139.5 Å²	139.5	70%	0.696	80%	0.8	S	S	*	*	S	Bend	trans	86.5	116.2	150.6	-158.1	172.9	159.1	0	0	118.4
135	K	41.6	Very low	47.8	Very low	168 Å²	168	143.2 Å²	143.2	73%	0.73	80%	0.803	S	S	*	*			trans	65.6	99.4	152.6	-78.2	173.9	176.8	168.9	0	118
136	Q	40.9	Very low	48.9	Very low	205 Å²	205	145.2 Å²	145.2	96%	0.958	81%	0.806	S	S	*	*				-137.1	101.3	129.5	-72.2	-164.5	-19.6	0	0	110.3
137	E	42.4	Very low	49.2	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	83%	0.825	S	S	*	*			trans	-91.3	103.8	159.7	-178.5	-175.2	175.2	0	0	105.3
138	E	49.8	Very low	49.5	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	83%	0.83	S	S	*	*			trans	-172.7	115.6	147.3	-117	-168.5	132.1	0	0	112.6
139	K	47.1	Very low	50	Low	202 Å²	202	153.5 Å²	153.5	88%	0.878	83%	0.831	S	S	*	*			trans	17	128.1	137.5	-72.6	179.7	172.8	176.8	0	118.9
140	G	45	Very low	50.3	Low	72 Å²	72	155 Å²	155	74%	0.742	83%	0.834	S	S	*	*			trans	167.1	111.5	151.4	0	0	0	0	0	113
141	P	57.5	Low	50.8	Low	117 Å²	117	151.9 Å²	151.9	76%	0.76	83%	0.83	S	S	*	*			trans	-100.3	-171.9	-162	38.2	-30.6	0	0	0	113.5
142	T	60.4	Low	51.3	Low	126 Å²	126	155.6 Å²	155.6	77%	0.773	83%	0.834	S	S	*	*			trans	89.5	131.8	170.1	78.7	0	0	0	0	113
143	T	62.3	Low	51.8	Low	120 Å²	120	154.7 Å²	154.7	74%	0.736	83%	0.829	S	S	*	*			cis	-161	126.6	25.1	-37.5	0	0	0	0	106.4
144	D	63.9	Low	52.5	Low	157 Å²	157	156.7 Å²	156.7	84%	0.84	83%	0.833	S	S	*	*			trans	-79.2	130.3	161.9	-80.9	-80.7	0	0	0	108
145	D	58.3	Low	53	Low	146 Å²	146	157.3 Å²	157.3	78%	0.781	84%	0.843	S	S	*	*			trans	-40.4	126.1	177.3	-56.3	-93.4	0	0	0	113
146	V	67.6	Low	54	Low	130 Å²	130	156.4 Å²	156.4	79%	0.788	85%	0.852	S	S	*	*				58.6	99.9	76.2	-177.4	0	0	0	0	113.4
147	D	52.3	Low	55.1	Low	238 Å²	238	152 Å²	152	100%	1.273	84%	0.843	S	S	*	*			trans	61.1	0	161.5	-122.3	-106.9	0	0	0	120.2

Retrieved 147 of 147 residues in 53.7 ms (Link to these results)

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