A0A3Q0KQW6_SCHMA Loading...

Putative chaperone protein DNAj

AlphaFold DB , UniProt , Accession A0A3Q0KQW6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 196 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	47.6	Very low	243 Å²	243	142.7 Å²	142.7	100%	1.197	73%	0.73	S	S	*	*				0	111.8	0	-163	167.7	174	0	0	107	L3	M1-L3 PolarHBondContact O-N 3.45Å
2	F	41.9	Very low	47.6	Very low	209 Å²	209	140.3 Å²	140.3	92%	0.917	72%	0.719	S	S	*	*			trans	-57.7	132.3	-170.7	-97.2	-104	0	0	0	111.3	A4	F2-A4 PolarHBondContact O-N 2.94Å
3	L	46.1	Very low	47.9	Very low	162 Å²	162	136.8 Å²	136.8	85%	0.848	71%	0.708	S	S	*	*			trans	-59.6	94.6	176.3	-68.4	166	0	0	0	109.4	M1 T5	M1-L3 PolarHBondContact O-N 3.45Å; L3-T5 PolarHBondContact O-N 3.1Å
4	A	44.5	Very low	48.2	Very low	96 Å²	96	135.1 Å²	135.1	79%	0.793	69%	0.694	S	S	*	*			trans	-66.9	87.3	165.2	0	0	0	0	0	107.4	F2 S6	F2-A4 PolarHBondContact O-N 2.94Å; A4-S6 PolarHBondContact O-N 3.44Å
5	T	48.3	Very low	48.4	Very low	102 Å²	102	131.6 Å²	131.6	63%	0.626	68%	0.682	S	S	*	*			trans	-58.3	106.5	171.8	55.3	0	0	0	0	107.5	L3	L3-T5 PolarHBondContact O-N 3.1Å
6	S	49.3	Very low	48.6	Very low	74 Å²	74	131.9 Å²	131.9	52%	0.517	68%	0.677	S	S	.	*			trans	-50.3	140.4	-176.3	172.2	0	0	0	0	111.7	A4 K8 T9	A4-S6 PolarHBondContact O-N 3.44Å; S6-K8 PolarHBondContact O-N 3.12Å; S6-T9 PolarHBondContact O-N 3.29Å; S6-T9 PolarHBondContact O-OG1 3.3Å
7	N	53.4	Low	48.9	Very low	119 Å²	119	134.1 Å²	134.1	64%	0.636	68%	0.675	S	S	*	*	H	α-helix	trans	-48.2	-25.1	178.8	-159.4	-9.9	0	0	0	113.1	K11	N7-K11 PolarHBondContact O-N 2.64Å
8	K	49.9	Very low	49.3	Very low	157 Å²	157	136.2 Å²	136.2	68%	0.683	67%	0.673	S	S	*	*	H	α-helix	trans	-69.7	-37.2	179	-163.9	170.8	-176.1	176.9	0	114.2	S6 R10 K11 L12	S6-K8 PolarHBondContact O-N 3.12Å; K8-R10 VanDerWaalsContact C-N 3.35Å; K8-K11 PolarHBondContact O-N 2.87Å; K8-L12 PolarHBondContact O-N 3.2Å
9	T	50.8	Low	49.9	Very low	78 Å²	78	132.6 Å²	132.6	48%	0.479	66%	0.66	S	S	.	*	H	α-helix	trans	-70.6	-33.8	177.9	58.2	0	0	0	0	111.3	S6 K11 L12 T13	S6-T9 PolarHBondContact O-N 3.29Å; S6-T9 PolarHBondContact O-OG1 3.3Å; T9-K11 VanDerWaalsContact C-N 3.32Å; T9-K11 PolarHBondContact O-N 2.84Å; T9-L12 PolarHBondContact O-N 3.42Å; T9-T13 WeakPolarHBondContact O-CG2 3.44Å; T9-T13 PolarHBondContact O-N 3.11Å; T9-T13 PolarHBondContact O-OG1 2.93Å
10	R	49.1	Very low	50.1	Low	184 Å²	184	133.8 Å²	133.8	69%	0.694	66%	0.657	S	S	*	*	H	α-helix	trans	-64.1	-31.3	175.2	-161	-177	-91.3	-172.7	-6.1	113.1	K8 T13	K8-R10 VanDerWaalsContact C-N 3.35Å; R10-T13 PolarHBondContact O-OG1 2.98Å
11	K	52.5	Low	50.2	Low	146 Å²	146	134.5 Å²	134.5	64%	0.635	66%	0.657	S	S	*	*	H	α-helix	trans	-74.5	-41.9	176.4	-73.3	-172.3	-179	-176.6	0	113	N7 K8 T9 T13 H14 T15	N7-K11 PolarHBondContact O-N 2.64Å; K8-K11 PolarHBondContact O-N 2.87Å; T9-K11 VanDerWaalsContact C-N 3.32Å; T9-K11 PolarHBondContact O-N 2.84Å; K11-T13 VanDerWaalsContact C-N 3.33Å; K11-T13 PolarHBondContact O-N 3.25Å; K11-H14 WeakPolarHBondContact O-CB 3.2Å; K11-H14 PolarHBondContact O-N 3.17Å; K11-H14 VanDerWaalsContact O-N 3.08Å; K11-T15 PolarHBondContact O-N 3.29Å
12	L	48.3	Very low	50.9	Low	114 Å²	114	130.8 Å²	130.8	60%	0.597	63%	0.63	S	S	*	*	H	α-helix	trans	-67.1	-33.4	178.7	-72.2	168.4	0	0	0	112.4	K8 T9 H14 T15 F16	K8-L12 PolarHBondContact O-N 3.2Å; T9-L12 PolarHBondContact O-N 3.42Å; L12-H14 PolarHBondContact O-N 3.45Å; L12-T15 PolarHBondContact O-N 3.16Å; L12-T15 PolarHBondContact O-OG1 2.83Å; L12-T15 VanDerWaalsContact O-OG1 3.04Å; L12-F16 PolarHBondContact O-N 3.09Å
13	T	51	Low	51.3	Low	94 Å²	94	127 Å²	127	58%	0.577	61%	0.614	S	S	*	*	H	α-helix	trans	-65.3	-26.1	171.8	51.6	0	0	0	0	113	T9 R10 K11 R17	T9-T13 WeakPolarHBondContact O-CG2 3.44Å; T9-T13 PolarHBondContact O-N 3.11Å; T9-T13 PolarHBondContact O-OG1 2.93Å; R10-T13 PolarHBondContact O-OG1 2.98Å; K11-T13 VanDerWaalsContact C-N 3.33Å; K11-T13 PolarHBondContact O-N 3.25Å; T13-R17 WeakPolarHBondContact O-CB 3.37Å; T13-R17 PolarHBondContact O-N 3.18Å
14	H	51.7	Low	51.7	Low	113 Å²	113	124 Å²	124	52%	0.523	61%	0.606	S	S	.	*	H	α-helix	trans	-80	-34.8	-179.1	-158	-87.6	0	0	0	112.7	K11 L12 W18	K11-H14 WeakPolarHBondContact O-CB 3.2Å; K11-H14 PolarHBondContact O-N 3.17Å; K11-H14 VanDerWaalsContact O-N 3.08Å; L12-H14 PolarHBondContact O-N 3.45Å; H14-W18 PolarHBondContact O-N 2.86Å
15	T	52.1	Low	52.1	Low	83 Å²	83	124.1 Å²	124.1	51%	0.509	60%	0.597	S	S	.	*	H	α-helix	trans	-72.2	-43.2	179.3	53.8	0	0	0	0	111.8	K11 L12 R17 W18 V19	K11-T15 PolarHBondContact O-N 3.29Å; L12-T15 PolarHBondContact O-N 3.16Å; L12-T15 PolarHBondContact O-OG1 2.83Å; L12-T15 VanDerWaalsContact O-OG1 3.04Å; T15-R17 VanDerWaalsContact C-N 3.33Å; T15-R17 PolarHBondContact O-N 2.89Å; T15-W18 PolarHBondContact O-N 2.72Å; T15-V19 PolarHBondContact O-N 3.21Å
16	F	51.3	Low	52.5	Low	136 Å²	136	126 Å²	126	60%	0.596	60%	0.603	S	S	*	*	H	α-helix	trans	-63.5	-40.1	176.9	-129.8	-117.8	0	0	0	111.3	L12 W18 V19 Y20	L12-F16 PolarHBondContact O-N 3.09Å; F16-W18 VanDerWaalsContact C-N 3.28Å; F16-W18 PolarHBondContact O-N 3.11Å; F16-V19 PolarHBondContact O-N 3.49Å; F16-Y20 AromaticContact CD1-CD2 3.98Å; F16-Y20 HydrophobicContact CD1-CD2 3.98Å; F16-Y20 AromaticContact CD1-CE2 3.42Å; F16-Y20 HydrophobicContact CD1-CE2 3.42Å; F16-Y20 VanDerWaalsContact CD1-CE2 3.42Å; F16-Y20 HydrophobicContact CE1-CD2 4.39Å; F16-Y20 AromaticContact CE1-CE2 3.43Å; F16-Y20 HydrophobicContact CE1-CE2 3.43Å; F16-Y20 VanDerWaalsContact CE1-CE2 3.43Å; F16-Y20 HydrophobicContact CG-CE2 4.36Å; F16-Y20 HydrophobicContact CZ-CE2 4.34Å; F16-Y20 WeakPolarHBondContact O-CD2 3.37Å; F16-Y20 PolarHBondContact O-N 2.99Å; F16-Y20 VanDerWaalsContact O-N 3.15Å
17	R	53.4	Low	53.1	Low	170 Å²	170	127.5 Å²	127.5	64%	0.642	60%	0.6	S	S	*	*	H	α-helix	trans	-61.4	-31.6	175.4	-171.3	164.7	69.9	145.8	1.6	113.5	T13 T15 K21	T13-R17 WeakPolarHBondContact O-CB 3.37Å; T13-R17 PolarHBondContact O-N 3.18Å; T15-R17 VanDerWaalsContact C-N 3.33Å; T15-R17 PolarHBondContact O-N 2.89Å; R17-K21 WeakPolarHBondContact O-CB 3.35Å; R17-K21 PolarHBondContact O-N 3.24Å; R17-K21 VanDerWaalsContact O-N 3.12Å
18	W	55.7	Low	53.7	Low	172 Å²	172	129 Å²	129	65%	0.652	60%	0.603	S	S	*	*	H	α-helix	trans	-70.9	-41.2	178.1	-171.9	81.7	0	0	0	112.1	H14 T15 F16 K21 Y22	H14-W18 PolarHBondContact O-N 2.86Å; T15-W18 PolarHBondContact O-N 2.72Å; F16-W18 VanDerWaalsContact C-N 3.28Å; F16-W18 PolarHBondContact O-N 3.11Å; W18-K21 PolarHBondContact O-N 3.01Å; W18-Y22 PolarHBondContact O-N 3.41Å
19	V	62.3	Low	54.6	Low	68 Å²	68	131.2 Å²	131.2	41%	0.412	61%	0.613	S	S	.	*	H	α-helix	trans	-67.3	-46.2	178.2	179.2	0	0	0	0	111.3	T15 F16 K21 Y22 F23	T15-V19 PolarHBondContact O-N 3.21Å; F16-V19 PolarHBondContact O-N 3.49Å; V19-K21 VanDerWaalsContact C-N 3.29Å; V19-K21 PolarHBondContact O-N 3.45Å; V19-Y22 PolarHBondContact O-N 3.24Å; V19-F23 HydrophobicContact CG1-CD2 3.89Å; V19-F23 HydrophobicContact CG1-CE2 4.02Å; V19-F23 WeakPolarHBondContact O-CD2 3.24Å; V19-F23 PolarHBondContact O-N 3.08Å
20	Y	53	Low	56.1	Low	156 Å²	156	132.3 Å²	132.3	61%	0.612	61%	0.608	S	S	*	*	H	α-helix	trans	-62.2	-37	175.1	-82.5	-80	0	0	0	112.4	F16 F23 S24	F16-Y20 AromaticContact CD1-CD2 3.98Å; F16-Y20 HydrophobicContact CD1-CD2 3.98Å; F16-Y20 AromaticContact CD1-CE2 3.42Å; F16-Y20 HydrophobicContact CD1-CE2 3.42Å; F16-Y20 VanDerWaalsContact CD1-CE2 3.42Å; F16-Y20 HydrophobicContact CE1-CD2 4.39Å; F16-Y20 AromaticContact CE1-CE2 3.43Å; F16-Y20 HydrophobicContact CE1-CE2 3.43Å; F16-Y20 VanDerWaalsContact CE1-CE2 3.43Å; F16-Y20 HydrophobicContact CG-CE2 4.36Å; F16-Y20 HydrophobicContact CZ-CE2 4.34Å; F16-Y20 WeakPolarHBondContact O-CD2 3.37Å; F16-Y20 PolarHBondContact O-N 2.99Å; F16-Y20 VanDerWaalsContact O-N 3.15Å; Y20-F23 PolarHBondContact O-N 3.04Å; Y20-S24 VanDerWaalsContact O-CB 3.25Å; Y20-S24 WeakPolarHBondContact O-CB 3.47Å; Y20-S24 PolarHBondContact O-N 3.47Å; Y20-S24 PolarHBondContact O-OG 3.37Å
21	K	52.1	Low	58.1	Low	148 Å²	148	124.5 Å²	124.5	64%	0.643	58%	0.581	S	S	*	*	H	α-helix	trans	-62.7	-43.7	174.6	-172.2	172.3	179.1	175.7	0	111.4	R17 W18 V19 S24 T25	R17-K21 WeakPolarHBondContact O-CB 3.35Å; R17-K21 PolarHBondContact O-N 3.24Å; R17-K21 VanDerWaalsContact O-N 3.12Å; W18-K21 PolarHBondContact O-N 3.01Å; V19-K21 VanDerWaalsContact C-N 3.29Å; V19-K21 PolarHBondContact O-N 3.45Å; K21-S24 PolarHBondContact O-N 3Å; K21-S24 PolarHBondContact O-OG 3.33Å; K21-T25 PolarHBondContact O-OG1 3.43Å
22	Y	51.7	Low	60.1	Low	165 Å²	165	119.2 Å²	119.2	65%	0.647	56%	0.557	S	S	*	*	H	α-helix	trans	-60.8	-48.2	178	-163.6	-97	0	0	0	112	W18 V19 T25	W18-Y22 PolarHBondContact O-N 3.41Å; V19-Y22 PolarHBondContact O-N 3.24Å; Y22-T25 PolarHBondContact O-N 2.96Å
23	F	51.1	Low	62.4	Low	131 Å²	131	114 Å²	114	58%	0.575	53%	0.529	S	S	*	.	H	α-helix	trans	-74.2	-29.1	179.8	-80.7	-81.2	0	0	0	114.4	V19 Y20 T25 L26	V19-F23 HydrophobicContact CG1-CD2 3.89Å; V19-F23 HydrophobicContact CG1-CE2 4.02Å; V19-F23 WeakPolarHBondContact O-CD2 3.24Å; V19-F23 PolarHBondContact O-N 3.08Å; Y20-F23 PolarHBondContact O-N 3.04Å; F23-T25 PolarHBondContact O-N 3.05Å; F23-T25 VanDerWaalsContact O-N 3.12Å; F23-L26 HydrophobicContact CD1-CD1 4.28Å; F23-L26 PolarHBondContact O-N 3.29Å
24	S	54.7	Low	64.4	Low	98 Å²	98	116.1 Å²	116.1	69%	0.685	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10.6	173.7	69	0	0	0	0	113.8	Y20 K21	Y20-S24 VanDerWaalsContact O-CB 3.25Å; Y20-S24 WeakPolarHBondContact O-CB 3.47Å; Y20-S24 PolarHBondContact O-N 3.47Å; Y20-S24 PolarHBondContact O-OG 3.37Å; K21-S24 PolarHBondContact O-N 3Å; K21-S24 PolarHBondContact O-OG 3.33Å
25	T	53.4	Low	66.5	Low	98 Å²	98	112.1 Å²	112.1	60%	0.601	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	11.1	-179.1	-31.7	0	0	0	0	112.6	K21 Y22 F23 K27	K21-T25 PolarHBondContact O-OG1 3.43Å; Y22-T25 PolarHBondContact O-N 2.96Å; F23-T25 PolarHBondContact O-N 3.05Å; F23-T25 VanDerWaalsContact O-N 3.12Å; T25-K27 PolarHBondContact O-N 3.07Å
26	L	54.9	Low	68.5	Low	142 Å²	142	108.2 Å²	108.2	74%	0.743	49%	0.492	S	S	*	.			trans	-66.7	82.1	167.8	-67.7	-178	0	0	0	108.7	F23 E28	F23-L26 HydrophobicContact CD1-CD1 4.28Å; F23-L26 PolarHBondContact O-N 3.29Å; L26-E28 PolarHBondContact O-N 3.15Å
27	K	63.3	Low	70.6	Confident	105 Å²	105	108.7 Å²	108.7	46%	0.457	50%	0.501	S	S	.	.			trans	-60.3	127.1	179.1	-176.3	-176.8	175.1	-165.3	0	108.7	T25 F29 E77	T25-K27 PolarHBondContact O-N 3.07Å; K27-F29 PolarHBondContact O-N 3.17Å; K27-E77 IonicContact NZ-OE1 3.03Å; K27-E77 PolarHBondContact NZ-OE1 3.19Å; K27-E77 IonicContact NZ-OE2 3.76Å; K27-E77 PolarHBondContact NZ-OE2 3.39Å
28	E	65.1	Low	72.7	Confident	151 Å²	151	102 Å²	102	71%	0.706	48%	0.479	S	S	*	.			trans	-60.9	124.7	171.5	-168.2	171.9	-162.7	0	0	109.1	L26 R30	L26-E28 PolarHBondContact O-N 3.15Å; E28-R30 PolarHBondContact O-N 2.95Å
29	F	68.5	Low	74.5	Confident	204 Å²	204	101.7 Å²	101.7	90%	0.895	48%	0.482	S	S	*	.			trans	-68.5	97.8	176.5	-89.6	-85	0	0	0	109	K27	K27-F29 PolarHBondContact O-N 3.17Å
30	R	82.7	Confident	75.9	Confident	100 Å²	100	101.4 Å²	101.4	38%	0.377	48%	0.483	S	S	.	.			trans	-90.1	144.7	167.8	-67.6	-158.6	-62	-99.1	-10.4	110.8	E28 Y32 V35 E74	E28-R30 PolarHBondContact O-N 2.95Å; R30-Y32 PolarHBondContact O-N 2.84Å; R30-V35 HydrophobicContact CB-CG2 4.09Å; R30-E74 IonicContact CZ-OE1 3.54Å; R30-E74 IonicContact CZ-OE2 3.68Å; R30-E74 IonicContact NH2-OE1 3.99Å; R30-E74 PolarHBondContact NH2-OE1 2.87Å; R30-E74 IonicContact NH2-OE2 3.78Å; R30-E74 PolarHBondContact NH2-OE2 2.97Å
31	D	90.8	Very high	77.8	Confident	21 Å²	21	99.7 Å²	99.7	11%	0.112	49%	0.489	C	S	.	.			trans	-64.7	129.2	175.8	-167.9	-27.3	0	0	0	109.6	Y33 E34 V35 Y91 R95	D31-Y33 PolarHBondContact O-N 3.26Å; D31-Y33 VanDerWaalsContact OD1-CD2 3.31Å; D31-Y33 WeakPolarHBondContact OD1-CD2 3.34Å; D31-Y33 PolarHBondContact OD1-N 2.82Å; D31-E34 HydrophobicContact CB-CB 4.2Å; D31-E34 HydrophobicContact CB-CG 3.88Å; D31-E34 WeakPolarHBondContact O-CB 3.37Å; D31-E34 PolarHBondContact O-N 3.14Å; D31-E34 VanDerWaalsContact O-N 3.12Å; D31-V35 WeakPolarHBondContact O-CG2 3.17Å; D31-V35 PolarHBondContact O-N 3.45Å; D31-Y91 PolarHBondContact OD1-OH 3.45Å; D31-R95 IonicContact OD1-NE 3.28Å; D31-R95 IonicContact OD2-CZ 3.87Å; D31-R95 IonicContact OD2-NE 3.49Å; D31-R95 PolarHBondContact OD2-NE 3.21Å; D31-R95 IonicContact OD2-NH2 3.78Å; D31-R95 PolarHBondContact OD2-NH2 3.1Å
32	Y	95.1	Very high	79.8	Confident	34 Å²	34	92.8 Å²	92.8	13%	0.133	46%	0.46	C	S	.	.	H	α-helix	trans	-65.8	-27.4	-178.6	-67.3	-38.3	0	0	0	112.5	R30 E34 V35 L36 E77 A78 V81 Y91	R30-Y32 PolarHBondContact O-N 2.84Å; Y32-E34 VanDerWaalsContact C-N 3.35Å; Y32-V35 PolarHBondContact O-N 3.3Å; Y32-L36 PolarHBondContact O-N 2.9Å; Y32-L36 VanDerWaalsContact O-N 3.15Å; Y32-E77 HydrophobicContact CE1-CG 4.29Å; Y32-E77 PolarHBondContact OH-OE1 3.05Å; Y32-A78 HydrophobicContact CD1-CB 3.74Å; Y32-A78 HydrophobicContact CG-CB 4.01Å; Y32-V81 HydrophobicContact CD2-CB 3.91Å; Y32-V81 HydrophobicContact CD2-CG1 3.87Å; Y32-V81 HydrophobicContact CD2-CG2 4.24Å; Y32-V81 HydrophobicContact CE2-CB 3.86Å; Y32-V81 HydrophobicContact CE2-CG1 3.86Å; Y32-V81 HydrophobicContact CE2-CG2 3.67Å; Y32-Y91 HydrophobicContact CD2-CD1 4.38Å; Y32-Y91 AromaticContact CD2-CD2 3.62Å; Y32-Y91 HydrophobicContact CD2-CD2 3.62Å; Y32-Y91 HydrophobicContact CD2-CE1 4.02Å; Y32-Y91 AromaticContact CD2-CE2 3.2Å; Y32-Y91 HydrophobicContact CD2-CE2 3.2Å; Y32-Y91 HydrophobicContact CD2-CG 4.19Å; Y32-Y91 AromaticContact CD2-CZ 3.42Å; Y32-Y91 VanDerWaalsContact CD2-CZ 3.42Å; Y32-Y91 AromaticContact CE2-CD2 3.72Å; Y32-Y91 HydrophobicContact CE2-CD2 3.72Å; Y32-Y91 AromaticContact CE2-CE2 3.43Å; Y32-Y91 HydrophobicContact CE2-CE2 3.43Å; Y32-Y91 VanDerWaalsContact CE2-CE2 3.43Å; Y32-Y91 HydrophobicContact CG-CE2 4.14Å; Y32-Y91 AromaticContact CG-CZ 3.97Å; Y32-Y91 PolarHBondContact N-OH 3.47Å
33	Y	96.1	Very high	81.9	Confident	4 Å²	4	87 Å²	87	2%	0.016	44%	0.443	C	S	.	.	H	α-helix	trans	-67.7	-37.9	173.9	-66.5	-75.6	0	0	0	111.3	D31 L36 N37 V38 I47 L82 R88 Y91 D92	D31-Y33 PolarHBondContact O-N 3.26Å; D31-Y33 VanDerWaalsContact OD1-CD2 3.31Å; D31-Y33 WeakPolarHBondContact OD1-CD2 3.34Å; D31-Y33 PolarHBondContact OD1-N 2.82Å; Y33-L36 PolarHBondContact O-N 3.04Å; Y33-N37 PolarHBondContact O-N 3.1Å; Y33-V38 HydrophobicContact CD1-CG2 3.99Å; Y33-V38 PolarHBondContact O-N 2.91Å; Y33-I47 HydrophobicContact CE1-CD1 4.41Å; Y33-L82 HydrophobicContact CD1-CD1 3.82Å; Y33-L82 HydrophobicContact CD1-CD2 4.49Å; Y33-L82 HydrophobicContact CE1-CD1 3.96Å; Y33-L82 HydrophobicContact CE1-CD2 3.9Å; Y33-L82 HydrophobicContact CE2-CD2 3.92Å; Y33-L82 HydrophobicContact CG-CD1 4.13Å; Y33-R88 PolarHBondContact OH-NE 3.32Å; Y33-R88 PolarHBondContact OH-NH2 3.46Å; Y33-Y91 HydrophobicContact CD2-CE1 4.15Å; Y33-Y91 HydrophobicContact CE2-CD1 4.2Å; Y33-Y91 AromaticContact CE2-CE1 3.91Å; Y33-Y91 HydrophobicContact CE2-CE1 3.91Å; Y33-D92 WeakPolarHBondContact CE2-OD1 3.43Å; Y33-D92 PolarHBondContact OH-OD1 2.99Å; Y33-D92 PolarHBondContact OH-OD2 3.25Å
34	E	94.2	Very high	84	Confident	140 Å²	140	85.2 Å²	85.2	65%	0.654	45%	0.445	S	S	*	.	H	α-helix	trans	-68.8	-39.8	175.7	-66.6	176.2	177.2	0	0	111.7	D31 Y32 L36 N37	D31-E34 HydrophobicContact CB-CB 4.2Å; D31-E34 HydrophobicContact CB-CG 3.88Å; D31-E34 WeakPolarHBondContact O-CB 3.37Å; D31-E34 PolarHBondContact O-N 3.14Å; D31-E34 VanDerWaalsContact O-N 3.12Å; Y32-E34 VanDerWaalsContact C-N 3.35Å; E34-L36 VanDerWaalsContact C-N 3.28Å; E34-L36 PolarHBondContact O-N 3.49Å; E34-N37 PolarHBondContact O-N 3.28Å
35	V	94.5	Very high	85.9	Confident	28 Å²	28	88.2 Å²	88.2	17%	0.17	45%	0.448	C	S	.	.	H	α-helix	trans	-60.2	-38.9	175.9	173.5	0	0	0	0	111.7	R30 D31 Y32 N37 E74 V75 A78	R30-V35 HydrophobicContact CB-CG2 4.09Å; D31-V35 WeakPolarHBondContact O-CG2 3.17Å; D31-V35 PolarHBondContact O-N 3.45Å; Y32-V35 PolarHBondContact O-N 3.3Å; V35-N37 VanDerWaalsContact C-N 3.31Å; V35-E74 HydrophobicContact CG1-CB 3.91Å; V35-V75 HydrophobicContact CG1-CG2 4.05Å; V35-A78 HydrophobicContact CB-CB 4.16Å; V35-A78 HydrophobicContact CG1-CB 3.94Å
36	L	95.2	Very high	87.9	Confident	1 Å²	1	88.7 Å²	88.7	1%	0.005	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.9	175.5	-69.2	-178.5	0	0	0	113.6	Y32 Y33 E34 V38 I47 L54 V75 A78 L82	Y32-L36 PolarHBondContact O-N 2.9Å; Y32-L36 VanDerWaalsContact O-N 3.15Å; Y33-L36 PolarHBondContact O-N 3.04Å; E34-L36 VanDerWaalsContact C-N 3.28Å; E34-L36 PolarHBondContact O-N 3.49Å; L36-V38 VanDerWaalsContact C-N 3.25Å; L36-V38 HydrophobicContact CB-CG2 3.87Å; L36-V38 PolarHBondContact O-N 3.46Å; L36-I47 HydrophobicContact CD1-CG2 3.82Å; L36-L54 HydrophobicContact CD2-CD1 4.24Å; L36-V75 HydrophobicContact CD2-CG1 3.89Å; L36-A78 HydrophobicContact CD1-CB 4.26Å; L36-A78 HydrophobicContact CD2-CB 4.29Å; L36-A78 HydrophobicContact CG-CB 3.89Å; L36-L82 HydrophobicContact CD1-CD1 3.92Å
37	N	94.9	Very high	90	Very high	146 Å²	146	81.9 Å²	81.9	78%	0.781	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	40.3	-175.5	-165.5	42.7	0	0	0	113.4	Y33 E34 V35	Y33-N37 PolarHBondContact O-N 3.1Å; E34-N37 PolarHBondContact O-N 3.28Å; V35-N37 VanDerWaalsContact C-N 3.31Å
38	V	96.5	Very high	91.5	Very high	29 Å²	29	82.5 Å²	82.5	18%	0.176	41%	0.411	C	S	.	.			trans	-119.6	159.4	177.5	-67	0	0	0	0	110.8	Y33 L36 A42 I47 A50	Y33-V38 HydrophobicContact CD1-CG2 3.99Å; Y33-V38 PolarHBondContact O-N 2.91Å; L36-V38 VanDerWaalsContact C-N 3.25Å; L36-V38 HydrophobicContact CB-CG2 3.87Å; L36-V38 PolarHBondContact O-N 3.46Å; V38-A42 HydrophobicContact CB-CB 3.93Å; V38-A42 HydrophobicContact CG2-CB 4.3Å; V38-I47 HydrophobicContact CG2-CG1 4.37Å; V38-A50 HydrophobicContact CG1-CB 3.53Å
39	K	95.1	Very high	93	Very high	166 Å²	166	78 Å²	78	72%	0.722	40%	0.399	S	S	*	.			trans	-72.3	153	172.5	-65.8	178.3	-179.6	174.1	0	110.3	T41 A42	K39-T41 PolarHBondContact O-N 3.29Å; K39-A42 WeakPolarHBondContact O-CB 3.42Å; K39-A42 PolarHBondContact O-N 3.39Å
40	S	91.8	Very high	94.4	Very high	63 Å²	63	69.2 Å²	69.2	44%	0.441	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.7	173.9	55.6	0	0	0	0	113.5	A42 R88	S40-A42 VanDerWaalsContact C-N 3.31Å; S40-R88 PolarHBondContact O-NH2 3.19Å
41	T	92.2	Very high	95.1	Very high	119 Å²	119	66.8 Å²	66.8	73%	0.73	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.9	175.5	60.8	0	0	0	0	113.7	K39	K39-T41 PolarHBondContact O-N 3.29Å
42	A	93.6	Very high	95.4	Very high	3 Å²	3	69.7 Å²	69.7	3%	0.025	37%	0.37	C	S	.	.			trans	-60.4	144.5	-174.3	0	0	0	0	0	112.3	V38 K39 S40 E46 I47 R88	V38-A42 HydrophobicContact CB-CB 3.93Å; V38-A42 HydrophobicContact CG2-CB 4.3Å; K39-A42 WeakPolarHBondContact O-CB 3.42Å; K39-A42 PolarHBondContact O-N 3.39Å; S40-A42 VanDerWaalsContact C-N 3.31Å; A42-E46 WeakPolarHBondContact CA-OE2 3.47Å; A42-E46 HydrophobicContact CB-CB 4.19Å; A42-E46 WeakPolarHBondContact CB-OE2 3.32Å; A42-I47 HydrophobicContact CB-CG1 4.12Å; A42-R88 VanDerWaalsContact O-CZ 3.31Å; A42-R88 PolarHBondContact O-NH1 3.03Å; A42-R88 PolarHBondContact O-NH2 2.69Å
43	S	95.6	Very high	95.4	Very high	44 Å²	44	71.6 Å²	71.6	31%	0.308	38%	0.383	S	S	.	.			trans	-70.3	158.2	176.3	83.4	0	0	0	0	111	E45 E46 I47	S43-E45 PolarHBondContact O-N 2.67Å; S43-E45 PolarHBondContact OG-N 3.49Å; S43-E46 PolarHBondContact N-OE2 3.37Å; S43-E46 PolarHBondContact O-N 3Å; S43-E46 WeakPolarHBondContact OG-CG 3.14Å; S43-E46 PolarHBondContact OG-N 2.92Å; S43-E46 VanDerWaalsContact OG-N 3.16Å; S43-I47 WeakPolarHBondContact O-CG1 3.41Å; S43-I47 PolarHBondContact O-N 3.28Å; S43-I47 VanDerWaalsContact O-N 3.07Å
44	P	94.8	Very high	95.4	Very high	94 Å²	94	72.4 Å²	72.4	61%	0.61	39%	0.388	S	S	*	.	H	α-helix	trans	-56.6	-30.8	174.3	-24.3	34.5	0	0	0	113.2	K48	P44-K48 WeakPolarHBondContact O-CB 3.26Å; P44-K48 PolarHBondContact O-N 2.81Å; P44-K48 VanDerWaalsContact O-N 3.08Å
45	E	95.4	Very high	95.3	Very high	160 Å²	160	66.4 Å²	66.4	75%	0.748	36%	0.361	S	S	*	.	H	α-helix	trans	-71.7	-42.5	178.2	-60.8	-177.6	173	0	0	111.8	S43 K48 A49	S43-E45 PolarHBondContact O-N 2.67Å; S43-E45 PolarHBondContact OG-N 3.49Å; E45-K48 PolarHBondContact O-N 3.37Å; E45-A49 WeakPolarHBondContact O-CB 3.37Å; E45-A49 PolarHBondContact O-N 3.48Å
46	E	96.6	Very high	95.2	Very high	108 Å²	108	71.3 Å²	71.3	51%	0.505	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-42.3	175.2	-71.2	173.7	150.2	0	0	111.3	A42 S43 K48 A49 A50	A42-E46 WeakPolarHBondContact CA-OE2 3.47Å; A42-E46 HydrophobicContact CB-CB 4.19Å; A42-E46 WeakPolarHBondContact CB-OE2 3.32Å; S43-E46 PolarHBondContact N-OE2 3.37Å; S43-E46 PolarHBondContact O-N 3Å; S43-E46 WeakPolarHBondContact OG-CG 3.14Å; S43-E46 PolarHBondContact OG-N 2.92Å; S43-E46 VanDerWaalsContact OG-N 3.16Å; E46-K48 VanDerWaalsContact C-N 3.34Å; E46-K48 PolarHBondContact O-N 3.04Å; E46-A49 PolarHBondContact O-N 3.12Å; E46-A50 WeakPolarHBondContact O-CB 3.35Å; E46-A50 PolarHBondContact O-N 3.31Å
47	I	97.2	Very high	95.1	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-60.5	-45.2	175.9	-68.6	167.8	0	0	0	110.5	Y33 L36 V38 A42 S43 Y51 Y79 L82 R88	Y33-I47 HydrophobicContact CE1-CD1 4.41Å; L36-I47 HydrophobicContact CD1-CG2 3.82Å; V38-I47 HydrophobicContact CG2-CG1 4.37Å; A42-I47 HydrophobicContact CB-CG1 4.12Å; S43-I47 WeakPolarHBondContact O-CG1 3.41Å; S43-I47 PolarHBondContact O-N 3.28Å; S43-I47 VanDerWaalsContact O-N 3.07Å; I47-Y51 WeakPolarHBondContact O-CB 3.19Å; I47-Y51 PolarHBondContact O-N 3.03Å; I47-Y79 HydrophobicContact CG2-CD2 4.17Å; I47-Y79 HydrophobicContact CG2-CE2 4.47Å; I47-L82 HydrophobicContact CD1-CB 4.42Å; I47-L82 HydrophobicContact CG2-CB 4.05Å; I47-R88 VanDerWaalsContact CD1-NH1 3.28Å
48	K	96.2	Very high	95	Very high	117 Å²	117	73.4 Å²	73.4	51%	0.509	38%	0.381	S	S	.	.	H	α-helix	trans	-64.8	-42.8	176.9	-174	180	-179.1	-177.9	0	111.6	P44 E45 E46 Y51 L52 Y79	P44-K48 WeakPolarHBondContact O-CB 3.26Å; P44-K48 PolarHBondContact O-N 2.81Å; P44-K48 VanDerWaalsContact O-N 3.08Å; E45-K48 PolarHBondContact O-N 3.37Å; E46-K48 VanDerWaalsContact C-N 3.34Å; E46-K48 PolarHBondContact O-N 3.04Å; K48-Y51 PolarHBondContact O-N 2.77Å; K48-L52 HydrophobicContact CG-CD1 4.39Å; K48-L52 VanDerWaalsContact O-CG 3.29Å; K48-L52 WeakPolarHBondContact O-CG 3.15Å; K48-L52 PolarHBondContact O-N 2.77Å; K48-Y79 HydrophobicContact CB-CE2 4.3Å; K48-Y79 HydrophobicContact CG-CE2 4.47Å
49	A	97	Very high	94.6	Very high	57 Å²	57	75.3 Å²	75.3	47%	0.471	39%	0.387	S	S	.	.	H	α-helix	trans	-63.2	-45.4	178.4	0	0	0	0	0	111.7	E45 E46 L52 D53	E45-A49 WeakPolarHBondContact O-CB 3.37Å; E45-A49 PolarHBondContact O-N 3.48Å; E46-A49 PolarHBondContact O-N 3.12Å; A49-L52 PolarHBondContact O-N 3.19Å; A49-D53 PolarHBondContact O-N 3.25Å
50	A	97.3	Very high	94.3	Very high	19 Å²	19	70.7 Å²	70.7	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-44.4	176.7	0	0	0	0	0	112	V38 E46 L52 D53 L54	V38-A50 HydrophobicContact CG1-CB 3.53Å; E46-A50 WeakPolarHBondContact O-CB 3.35Å; E46-A50 PolarHBondContact O-N 3.31Å; A50-L52 VanDerWaalsContact C-N 3.33Å; A50-L52 PolarHBondContact O-N 2.72Å; A50-D53 PolarHBondContact O-N 3.48Å; A50-L54 WeakPolarHBondContact O-CB 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.34Å; A50-L54 PolarHBondContact O-N 2.88Å
51	Y	97.2	Very high	94.2	Very high	50 Å²	50	74.2 Å²	74.2	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-57.4	-44.9	174.1	170.1	-104.8	0	0	0	112.1	I47 K48 S55 V75 Y79	I47-Y51 WeakPolarHBondContact O-CB 3.19Å; I47-Y51 PolarHBondContact O-N 3.03Å; K48-Y51 PolarHBondContact O-N 2.77Å; Y51-S55 WeakPolarHBondContact CE2-OG 3.44Å; Y51-S55 WeakPolarHBondContact O-CB 3.43Å; Y51-S55 PolarHBondContact O-N 3.01Å; Y51-S55 PolarHBondContact O-OG 3.04Å; Y51-V75 HydrophobicContact CD2-CG1 3.57Å; Y51-V75 HydrophobicContact CE2-CG1 3.97Å; Y51-Y79 AromaticContact CD1-CD1 3.83Å; Y51-Y79 HydrophobicContact CD1-CD1 3.83Å; Y51-Y79 HydrophobicContact CD1-CD2 4.12Å; Y51-Y79 HydrophobicContact CD1-CE1 4.01Å; Y51-Y79 HydrophobicContact CD1-CE2 4.31Å; Y51-Y79 AromaticContact CD1-CG 3.89Å; Y51-Y79 HydrophobicContact CD1-CG 3.89Å; Y51-Y79 HydrophobicContact CD2-CD1 4.08Å; Y51-Y79 HydrophobicContact CD2-CD2 4.26Å; Y51-Y79 AromaticContact CD2-CG 3.64Å; Y51-Y79 HydrophobicContact CD2-CG 3.64Å; Y51-Y79 AromaticContact CE1-CD1 3.87Å; Y51-Y79 HydrophobicContact CE1-CD1 3.87Å; Y51-Y79 HydrophobicContact CE1-CE1 4.09Å; Y51-Y79 HydrophobicContact CE1-CG 4.33Å; Y51-Y79 HydrophobicContact CE2-CD1 4.13Å; Y51-Y79 HydrophobicContact CE2-CG 4.12Å; Y51-Y79 AromaticContact CG-CD1 3.93Å; Y51-Y79 HydrophobicContact CG-CD1 3.93Å; Y51-Y79 AromaticContact CG-CD2 3.73Å; Y51-Y79 HydrophobicContact CG-CD2 3.73Å; Y51-Y79 HydrophobicContact CG-CE1 4.48Å; Y51-Y79 HydrophobicContact CG-CE2 4.32Å; Y51-Y79 AromaticContact CG-CG 3.52Å; Y51-Y79 HydrophobicContact CG-CG 3.52Å
52	L	96.1	Very high	93.8	Very high	81 Å²	81	76 Å²	76	42%	0.424	39%	0.386	S	S	.	.	H	α-helix	trans	-66	-40.1	179.4	-70.2	173.8	0	0	0	112.4	K48 A49 A50 K56	K48-L52 HydrophobicContact CG-CD1 4.39Å; K48-L52 VanDerWaalsContact O-CG 3.29Å; K48-L52 WeakPolarHBondContact O-CG 3.15Å; K48-L52 PolarHBondContact O-N 2.77Å; A49-L52 PolarHBondContact O-N 3.19Å; A50-L52 VanDerWaalsContact C-N 3.33Å; A50-L52 PolarHBondContact O-N 2.72Å; L52-K56 WeakPolarHBondContact O-CB 3.44Å; L52-K56 WeakPolarHBondContact O-CD 3.08Å; L52-K56 WeakPolarHBondContact O-CG 3.39Å; L52-K56 PolarHBondContact O-N 2.78Å; L52-K56 VanDerWaalsContact O-N 3.11Å
53	D	95.9	Very high	93.1	Very high	75 Å²	75	78.2 Å²	78.2	40%	0.401	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-48.5	176.6	179.3	57.6	0	0	0	111.7	A49 A50 K56 K57	A49-D53 PolarHBondContact O-N 3.25Å; A50-D53 PolarHBondContact O-N 3.48Å; D53-K56 PolarHBondContact O-N 2.58Å; D53-K57 WeakPolarHBondContact O-CG 3.49Å; D53-K57 PolarHBondContact O-N 3.35Å; D53-K57 VanDerWaalsContact O-N 3.1Å; D53-K57 WeakPolarHBondContact OD1-CE 3.36Å; D53-K57 IonicContact OD1-NZ 3.54Å; D53-K57 VanDerWaalsContact OD2-CE 3.24Å; D53-K57 WeakPolarHBondContact OD2-CE 3.24Å; D53-K57 IonicContact OD2-NZ 3.56Å; D53-K57 PolarHBondContact OD2-NZ 2.97Å
54	L	95.2	Very high	92.4	Very high	21 Å²	21	84.2 Å²	84.2	11%	0.11	43%	0.429	C	S	.	.	H	α-helix	trans	-66.4	-39.6	178.8	-67.4	173.1	0	0	0	112.2	L36 A50 K56 K57 Y58 V75	L36-L54 HydrophobicContact CD2-CD1 4.24Å; A50-L54 WeakPolarHBondContact O-CB 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.34Å; A50-L54 PolarHBondContact O-N 2.88Å; L54-K56 VanDerWaalsContact C-N 3.3Å; L54-K56 PolarHBondContact O-N 3.22Å; L54-K57 PolarHBondContact O-N 3.13Å; L54-K57 VanDerWaalsContact O-N 3.12Å; L54-Y58 HydrophobicContact CB-CD2 4.44Å; L54-Y58 HydrophobicContact CD2-CE2 4.03Å; L54-Y58 WeakPolarHBondContact O-CD2 3.37Å; L54-Y58 PolarHBondContact O-N 3.41Å; L54-V75 HydrophobicContact CB-CG1 3.96Å; L54-V75 HydrophobicContact CB-CG2 4.13Å; L54-V75 HydrophobicContact CD1-CG1 4.5Å; L54-V75 HydrophobicContact CD1-CG2 4Å
55	S	93.7	Very high	92.1	Very high	14 Å²	14	84 Å²	84	10%	0.098	42%	0.423	C	S	.	.	H	α-helix	trans	-63.6	-36.9	176.1	-63.7	0	0	0	0	111.8	Y51 K57 H59	Y51-S55 WeakPolarHBondContact CE2-OG 3.44Å; Y51-S55 WeakPolarHBondContact O-CB 3.43Å; Y51-S55 PolarHBondContact O-N 3.01Å; Y51-S55 PolarHBondContact O-OG 3.04Å; S55-K57 VanDerWaalsContact C-N 3.32Å; S55-H59 WeakPolarHBondContact O-CA 3.18Å; S55-H59 VanDerWaalsContact O-CB 3.32Å; S55-H59 WeakPolarHBondContact O-CB 3.37Å; S55-H59 PolarHBondContact O-N 2.97Å
56	K	92.5	Very high	91.7	Very high	131 Å²	131	82.2 Å²	82.2	57%	0.57	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-28.7	174.2	-75.5	170.9	-175.6	179.2	0	112.9	L52 D53 L54 K62	L52-K56 WeakPolarHBondContact O-CB 3.44Å; L52-K56 WeakPolarHBondContact O-CD 3.08Å; L52-K56 WeakPolarHBondContact O-CG 3.39Å; L52-K56 PolarHBondContact O-N 2.78Å; L52-K56 VanDerWaalsContact O-N 3.11Å; D53-K56 PolarHBondContact O-N 2.58Å; L54-K56 VanDerWaalsContact C-N 3.3Å; L54-K56 PolarHBondContact O-N 3.22Å; K56-K62 WeakPolarHBondContact O-CD 3.29Å; K56-K62 PolarHBondContact O-NZ 3.16Å
57	K	91.3	Very high	91.2	Very high	117 Å²	117	83.5 Å²	83.5	51%	0.509	42%	0.422	S	S	.	.	H	α-helix	trans	-78.6	-42.6	177.9	-73.3	168.9	177	171.7	0	112.1	D53 L54 S55	D53-K57 WeakPolarHBondContact O-CG 3.49Å; D53-K57 PolarHBondContact O-N 3.35Å; D53-K57 VanDerWaalsContact O-N 3.1Å; D53-K57 WeakPolarHBondContact OD1-CE 3.36Å; D53-K57 IonicContact OD1-NZ 3.54Å; D53-K57 VanDerWaalsContact OD2-CE 3.24Å; D53-K57 WeakPolarHBondContact OD2-CE 3.24Å; D53-K57 IonicContact OD2-NZ 3.56Å; D53-K57 PolarHBondContact OD2-NZ 2.97Å; L54-K57 PolarHBondContact O-N 3.13Å; L54-K57 VanDerWaalsContact O-N 3.12Å; S55-K57 VanDerWaalsContact C-N 3.32Å
58	Y	92.9	Very high	90.8	Very high	74 Å²	74	83.7 Å²	83.7	29%	0.29	42%	0.423	S	S	.	.	S	Bend	trans	-100.3	14.5	-177.2	-58.8	-55.8	0	0	0	114.1	L54 A68 H71	L54-Y58 HydrophobicContact CB-CD2 4.44Å; L54-Y58 HydrophobicContact CD2-CE2 4.03Å; L54-Y58 WeakPolarHBondContact O-CD2 3.37Å; L54-Y58 PolarHBondContact O-N 3.41Å; Y58-A68 HydrophobicContact CD1-CB 4.08Å; Y58-H71 HydrophobicContact CD1-CB 4.24Å; Y58-H71 HydrophobicContact CD2-CB 3.96Å; Y58-H71 HydrophobicContact CE1-CB 4.28Å; Y58-H71 HydrophobicContact CE2-CB 3.98Å; Y58-H71 HydrophobicContact CG-CB 4.09Å
59	H	90	Very high	90.4	Very high	68 Å²	68	85.5 Å²	85.5	32%	0.315	43%	0.431	S	S	.	.			trans	-59.3	135.1	178.1	-163.2	-92.5	0	0	0	110.3	S55 D61 K62 C63	S55-H59 WeakPolarHBondContact O-CA 3.18Å; S55-H59 VanDerWaalsContact O-CB 3.32Å; S55-H59 WeakPolarHBondContact O-CB 3.37Å; S55-H59 PolarHBondContact O-N 2.97Å; H59-D61 IonicContact CE1-OD1 3.65Å; H59-D61 IonicContact CE1-OD2 3.37Å; H59-D61 PolarHBondContact CE1-OD2 3.36Å; H59-D61 VanDerWaalsContact ND1-CB 3.35Å; H59-D61 WeakPolarHBondContact ND1-CB 3.46Å; H59-D61 VanDerWaalsContact ND1-CG 3.3Å; H59-D61 PolarHBondContact ND1-N 3.04Å; H59-D61 IonicContact ND1-OD1 2.71Å; H59-D61 IonicContact ND1-OD2 2.83Å; H59-D61 PolarHBondContact ND1-OD2 2.87Å; H59-D61 PolarHBondContact O-N 3.42Å; H59-D61 VanDerWaalsContact O-N 3.09Å; H59-K62 PolarHBondContact O-N 2.88Å; H59-C63 PolarHBondContact O-N 3.47Å
60	P	88.2	Confident	90.1	Very high	70 Å²	70	89.4 Å²	89.4	46%	0.455	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.3	-178.7	21.4	-34.3	0	0	0	113.5	K62	P60-K62 VanDerWaalsContact C-N 3.32Å; P60-K62 PolarHBondContact O-N 3.35Å
61	D	88.7	Confident	89.8	Confident	136 Å²	136	90.9 Å²	90.9	73%	0.727	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.1	177.8	-59.5	-1.9	0	0	0	113.8	H59	H59-D61 IonicContact CE1-OD1 3.65Å; H59-D61 IonicContact CE1-OD2 3.37Å; H59-D61 PolarHBondContact CE1-OD2 3.36Å; H59-D61 VanDerWaalsContact ND1-CB 3.35Å; H59-D61 WeakPolarHBondContact ND1-CB 3.46Å; H59-D61 VanDerWaalsContact ND1-CG 3.3Å; H59-D61 PolarHBondContact ND1-N 3.04Å; H59-D61 IonicContact ND1-OD1 2.71Å; H59-D61 IonicContact ND1-OD2 2.83Å; H59-D61 PolarHBondContact ND1-OD2 2.87Å; H59-D61 PolarHBondContact O-N 3.42Å; H59-D61 VanDerWaalsContact O-N 3.09Å
62	K	84.3	Confident	89.6	Confident	157 Å²	157	91.4 Å²	91.4	68%	0.683	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-30.4	-175.9	-67.6	-166.7	-172.5	177.9	0	113.3	K56 H59 P60	K56-K62 WeakPolarHBondContact O-CD 3.29Å; K56-K62 PolarHBondContact O-NZ 3.16Å; H59-K62 PolarHBondContact O-N 2.88Å; P60-K62 VanDerWaalsContact C-N 3.32Å; P60-K62 PolarHBondContact O-N 3.35Å
63	C	79.8	Confident	89.3	Confident	49 Å²	49	90.2 Å²	90.2	33%	0.331	45%	0.447	S	S	.	.			trans	-135.2	106.2	-178.2	-166.8	0	0	0	0	109.2	H59 D65 A68	H59-C63 PolarHBondContact O-N 3.47Å; C63-D65 PolarHBondContact O-N 2.84Å; C63-A68 HydrophobicContact CB-CB 3.78Å; C63-A68 VanDerWaalsContact SG-CB 3.58Å
64	L	79.6	Confident	89.2	Confident	171 Å²	171	88.3 Å²	88.3	90%	0.895	44%	0.435	S	S	*	.			trans	-80.4	10.8	-179.1	-64.7	165.3	0	0	0	113
65	D	88.5	Confident	89.2	Confident	90 Å²	90	87.5 Å²	87.5	48%	0.481	43%	0.431	S	S	.	.			trans	-82.4	143.2	-177.4	-174.4	34.5	0	0	0	112.4	C63 K67 A68 K69	C63-D65 PolarHBondContact O-N 2.84Å; D65-K67 PolarHBondContact O-N 3.06Å; D65-K67 WeakPolarHBondContact OD2-CB 3.42Å; D65-K67 PolarHBondContact OD2-N 3.06Å; D65-A68 WeakPolarHBondContact O-CB 3.45Å; D65-A68 PolarHBondContact O-N 3.25Å; D65-A68 VanDerWaalsContact O-N 3.11Å; D65-K69 PolarHBondContact O-N 3.12Å
66	D	87.1	Confident	89.2	Confident	122 Å²	122	88.5 Å²	88.5	65%	0.652	44%	0.438	S	S	*	.	H	α-helix	trans	-62.7	-30.4	178.9	-81.6	-29.1	0	0	0	111.9	K69 K70	D66-K69 PolarHBondContact O-N 3.35Å; D66-K70 WeakPolarHBondContact O-CG 3.46Å; D66-K70 PolarHBondContact O-N 3.37Å; D66-K70 VanDerWaalsContact O-N 3.14Å
67	K	87	Confident	89.3	Confident	134 Å²	134	86 Å²	86	58%	0.583	43%	0.428	S	S	*	.	H	α-helix	trans	-67.7	-40.5	175.9	-166.3	-176.4	175	-177.8	0	111.5	D65 K69 K70 H71	D65-K67 PolarHBondContact O-N 3.06Å; D65-K67 WeakPolarHBondContact OD2-CB 3.42Å; D65-K67 PolarHBondContact OD2-N 3.06Å; K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.81Å; K67-K70 PolarHBondContact O-N 2.73Å; K67-H71 VanDerWaalsContact CE-NE2 3.26Å; K67-H71 WeakPolarHBondContact CE-NE2 3.48Å; K67-H71 PolarHBondContact O-CD2 3.03Å; K67-H71 VanDerWaalsContact O-CD2 3.24Å; K67-H71 PolarHBondContact O-N 3.43Å
68	A	88.3	Confident	89.5	Confident	4 Å²	4	80.4 Å²	80.4	3%	0.033	40%	0.404	C	S	.	.	H	α-helix	trans	-63.2	-40.2	176.6	0	0	0	0	0	111.1	Y58 C63 D65 K70 H71 F72	Y58-A68 HydrophobicContact CD1-CB 4.08Å; C63-A68 HydrophobicContact CB-CB 3.78Å; C63-A68 VanDerWaalsContact SG-CB 3.58Å; D65-A68 WeakPolarHBondContact O-CB 3.45Å; D65-A68 PolarHBondContact O-N 3.25Å; D65-A68 VanDerWaalsContact O-N 3.11Å; A68-K70 PolarHBondContact O-N 3.33Å; A68-H71 PolarHBondContact O-N 3.26Å; A68-F72 WeakPolarHBondContact O-CB 3.37Å; A68-F72 PolarHBondContact O-N 3.39Å
69	K	88.6	Confident	89.6	Confident	155 Å²	155	80 Å²	80	67%	0.674	40%	0.402	S	S	*	.	H	α-helix	trans	-61	-41.8	174.5	-173.4	176.7	-179.3	176.9	0	112.8	D65 D66 K67 A73	D65-K69 PolarHBondContact O-N 3.12Å; D66-K69 PolarHBondContact O-N 3.35Å; K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.81Å; K69-A73 PolarHBondContact O-N 2.95Å; K69-A73 VanDerWaalsContact O-N 3.1Å
70	K	89.8	Confident	89.8	Confident	140 Å²	140	79.8 Å²	79.8	61%	0.609	41%	0.409	S	S	*	.	H	α-helix	trans	-63.3	-48.2	175.1	-72	179.2	-178.7	180	0	111.4	D66 K67 A68 F72 A73 E74	D66-K70 WeakPolarHBondContact O-CG 3.46Å; D66-K70 PolarHBondContact O-N 3.37Å; D66-K70 VanDerWaalsContact O-N 3.14Å; K67-K70 PolarHBondContact O-N 2.73Å; A68-K70 PolarHBondContact O-N 3.33Å; K70-F72 PolarHBondContact O-N 3.44Å; K70-A73 PolarHBondContact O-N 3.13Å; K70-E74 VanDerWaalsContact O-CD 3.23Å; K70-E74 WeakPolarHBondContact O-CG 3.31Å; K70-E74 PolarHBondContact O-N 2.91Å
71	H	90.6	Very high	90.1	Very high	50 Å²	50	78 Å²	78	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-63.6	-39.3	177.9	-70.7	-44	0	0	0	113	Y58 K67 A68 A73 E74 V75	Y58-H71 HydrophobicContact CD1-CB 4.24Å; Y58-H71 HydrophobicContact CD2-CB 3.96Å; Y58-H71 HydrophobicContact CE1-CB 4.28Å; Y58-H71 HydrophobicContact CE2-CB 3.98Å; Y58-H71 HydrophobicContact CG-CB 4.09Å; K67-H71 VanDerWaalsContact CE-NE2 3.26Å; K67-H71 WeakPolarHBondContact CE-NE2 3.48Å; K67-H71 PolarHBondContact O-CD2 3.03Å; K67-H71 VanDerWaalsContact O-CD2 3.24Å; K67-H71 PolarHBondContact O-N 3.43Å; A68-H71 PolarHBondContact O-N 3.26Å; H71-A73 PolarHBondContact O-N 2.93Å; H71-E74 IonicContact CE1-OE2 3.17Å; H71-E74 IonicContact CG-OE2 2.64Å; H71-E74 IonicContact ND1-OE2 3.45Å; H71-E74 PolarHBondContact ND1-OE2 3.21Å; H71-E74 PolarHBondContact O-N 3.31Å; H71-V75 WeakPolarHBondContact O-CB 3.34Å; H71-V75 VanDerWaalsContact O-CG2 3.24Å; H71-V75 WeakPolarHBondContact O-CG2 3.45Å; H71-V75 PolarHBondContact O-N 3.47Å
72	F	92.9	Very high	90.4	Very high	61 Å²	61	71.8 Å²	71.8	27%	0.268	36%	0.363	S	S	.	.	H	α-helix	trans	-59.6	-47.6	174.8	-177.8	-96.9	0	0	0	111.3	A68 K70 E74 V75 S76	A68-F72 WeakPolarHBondContact O-CB 3.37Å; A68-F72 PolarHBondContact O-N 3.39Å; K70-F72 PolarHBondContact O-N 3.44Å; F72-E74 VanDerWaalsContact C-N 3.32Å; F72-E74 PolarHBondContact O-N 2.86Å; F72-V75 PolarHBondContact O-N 3.4Å; F72-S76 PolarHBondContact O-N 3.18Å; F72-S76 PolarHBondContact O-OG 3.3Å; F72-S76 VanDerWaalsContact O-OG 3.1Å
73	A	91.7	Very high	90.8	Very high	56 Å²	56	66 Å²	66	46%	0.463	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-42.3	177.5	0	0	0	0	0	112.2	K69 K70 H71 S76 E77	K69-A73 PolarHBondContact O-N 2.95Å; K69-A73 VanDerWaalsContact O-N 3.1Å; K70-A73 PolarHBondContact O-N 3.13Å; H71-A73 PolarHBondContact O-N 2.93Å; A73-S76 PolarHBondContact O-N 2.84Å; A73-E77 WeakPolarHBondContact O-CB 3.49Å; A73-E77 PolarHBondContact O-N 3.38Å
74	E	92.8	Very high	91.4	Very high	35 Å²	35	71 Å²	71	16%	0.164	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-43.4	177.7	-65.6	156.4	176.5	0	0	112.2	R30 V35 K70 H71 F72 E77 A78	R30-E74 IonicContact CZ-OE1 3.54Å; R30-E74 IonicContact CZ-OE2 3.68Å; R30-E74 IonicContact NH2-OE1 3.99Å; R30-E74 PolarHBondContact NH2-OE1 2.87Å; R30-E74 IonicContact NH2-OE2 3.78Å; R30-E74 PolarHBondContact NH2-OE2 2.97Å; V35-E74 HydrophobicContact CG1-CB 3.91Å; K70-E74 VanDerWaalsContact O-CD 3.23Å; K70-E74 WeakPolarHBondContact O-CG 3.31Å; K70-E74 PolarHBondContact O-N 2.91Å; H71-E74 IonicContact CE1-OE2 3.17Å; H71-E74 IonicContact CG-OE2 2.64Å; H71-E74 IonicContact ND1-OE2 3.45Å; H71-E74 PolarHBondContact ND1-OE2 3.21Å; H71-E74 PolarHBondContact O-N 3.31Å; F72-E74 VanDerWaalsContact C-N 3.32Å; F72-E74 PolarHBondContact O-N 2.86Å; E74-E77 PolarHBondContact O-N 3.2Å; E74-A78 WeakPolarHBondContact O-CB 3.19Å; E74-A78 PolarHBondContact O-N 2.92Å
75	V	95	Very high	92	Very high	4 Å²	4	67.9 Å²	67.9	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-41.7	177.6	165.2	0	0	0	0	111.2	V35 L36 Y51 L54 H71 F72 A78 Y79	V35-V75 HydrophobicContact CG1-CG2 4.05Å; L36-V75 HydrophobicContact CD2-CG1 3.89Å; Y51-V75 HydrophobicContact CD2-CG1 3.57Å; Y51-V75 HydrophobicContact CE2-CG1 3.97Å; L54-V75 HydrophobicContact CB-CG1 3.96Å; L54-V75 HydrophobicContact CB-CG2 4.13Å; L54-V75 HydrophobicContact CD1-CG1 4.5Å; L54-V75 HydrophobicContact CD1-CG2 4Å; H71-V75 WeakPolarHBondContact O-CB 3.34Å; H71-V75 VanDerWaalsContact O-CG2 3.24Å; H71-V75 WeakPolarHBondContact O-CG2 3.45Å; H71-V75 PolarHBondContact O-N 3.47Å; F72-V75 PolarHBondContact O-N 3.4Å; V75-A78 PolarHBondContact O-N 3.38Å; V75-Y79 WeakPolarHBondContact O-CB 3.31Å; V75-Y79 PolarHBondContact O-N 3.01Å
76	S	94.6	Very high	92.2	Very high	35 Å²	35	71.1 Å²	71.1	25%	0.245	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-41.4	175.2	-63	0	0	0	0	112.5	F72 A73 S80	F72-S76 PolarHBondContact O-N 3.18Å; F72-S76 PolarHBondContact O-OG 3.3Å; F72-S76 VanDerWaalsContact O-OG 3.1Å; A73-S76 PolarHBondContact O-N 2.84Å; S76-S80 WeakPolarHBondContact O-CB 3.43Å; S76-S80 PolarHBondContact O-N 3.49Å
77	E	93	Very high	92.4	Very high	77 Å²	77	67 Å²	67	36%	0.36	35%	0.346	S	S	.	.	H	α-helix	trans	-66.2	-46.9	177.1	-173.2	178	153.8	0	0	111.6	K27 Y32 A73 E74 Y79 S80 V81	K27-E77 IonicContact NZ-OE1 3.03Å; K27-E77 PolarHBondContact NZ-OE1 3.19Å; K27-E77 IonicContact NZ-OE2 3.76Å; K27-E77 PolarHBondContact NZ-OE2 3.39Å; Y32-E77 HydrophobicContact CE1-CG 4.29Å; Y32-E77 PolarHBondContact OH-OE1 3.05Å; A73-E77 WeakPolarHBondContact O-CB 3.49Å; A73-E77 PolarHBondContact O-N 3.38Å; E74-E77 PolarHBondContact O-N 3.2Å; E77-Y79 VanDerWaalsContact C-N 3.31Å; E77-Y79 PolarHBondContact O-N 3.18Å; E77-S80 WeakPolarHBondContact O-CB 3.47Å; E77-S80 PolarHBondContact O-N 3.5Å; E77-S80 VanDerWaalsContact O-N 3.13Å; E77-V81 PolarHBondContact O-N 2.79Å
78	A	95.4	Very high	92.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-44.4	176.4	0	0	0	0	0	111.6	Y32 V35 L36 E74 V75 V81 L82	Y32-A78 HydrophobicContact CD1-CB 3.74Å; Y32-A78 HydrophobicContact CG-CB 4.01Å; V35-A78 HydrophobicContact CB-CB 4.16Å; V35-A78 HydrophobicContact CG1-CB 3.94Å; L36-A78 HydrophobicContact CD1-CB 4.26Å; L36-A78 HydrophobicContact CD2-CB 4.29Å; L36-A78 HydrophobicContact CG-CB 3.89Å; E74-A78 WeakPolarHBondContact O-CB 3.19Å; E74-A78 PolarHBondContact O-N 2.92Å; V75-A78 PolarHBondContact O-N 3.38Å; A78-V81 PolarHBondContact O-N 3.35Å; A78-L82 WeakPolarHBondContact O-CB 3.29Å; A78-L82 WeakPolarHBondContact O-CG 3.47Å; A78-L82 PolarHBondContact O-N 3.3Å
79	Y	96.5	Very high	92.9	Very high	65 Å²	65	71.6 Å²	71.6	26%	0.255	36%	0.359	S	S	.	.	H	α-helix	trans	-68.3	-35.3	176.9	-176.9	-109.3	0	0	0	113.1	I47 K48 Y51 V75 E77 V81 G83	I47-Y79 HydrophobicContact CG2-CD2 4.17Å; I47-Y79 HydrophobicContact CG2-CE2 4.47Å; K48-Y79 HydrophobicContact CB-CE2 4.3Å; K48-Y79 HydrophobicContact CG-CE2 4.47Å; Y51-Y79 AromaticContact CD1-CD1 3.83Å; Y51-Y79 HydrophobicContact CD1-CD1 3.83Å; Y51-Y79 HydrophobicContact CD1-CD2 4.12Å; Y51-Y79 HydrophobicContact CD1-CE1 4.01Å; Y51-Y79 HydrophobicContact CD1-CE2 4.31Å; Y51-Y79 AromaticContact CD1-CG 3.89Å; Y51-Y79 HydrophobicContact CD1-CG 3.89Å; Y51-Y79 HydrophobicContact CD2-CD1 4.08Å; Y51-Y79 HydrophobicContact CD2-CD2 4.26Å; Y51-Y79 AromaticContact CD2-CG 3.64Å; Y51-Y79 HydrophobicContact CD2-CG 3.64Å; Y51-Y79 AromaticContact CE1-CD1 3.87Å; Y51-Y79 HydrophobicContact CE1-CD1 3.87Å; Y51-Y79 HydrophobicContact CE1-CE1 4.09Å; Y51-Y79 HydrophobicContact CE1-CG 4.33Å; Y51-Y79 HydrophobicContact CE2-CD1 4.13Å; Y51-Y79 HydrophobicContact CE2-CG 4.12Å; Y51-Y79 AromaticContact CG-CD1 3.93Å; Y51-Y79 HydrophobicContact CG-CD1 3.93Å; Y51-Y79 AromaticContact CG-CD2 3.73Å; Y51-Y79 HydrophobicContact CG-CD2 3.73Å; Y51-Y79 HydrophobicContact CG-CE1 4.48Å; Y51-Y79 HydrophobicContact CG-CE2 4.32Å; Y51-Y79 AromaticContact CG-CG 3.52Å; Y51-Y79 HydrophobicContact CG-CG 3.52Å; V75-Y79 WeakPolarHBondContact O-CB 3.31Å; V75-Y79 PolarHBondContact O-N 3.01Å; E77-Y79 VanDerWaalsContact C-N 3.31Å; E77-Y79 PolarHBondContact O-N 3.18Å; Y79-V81 PolarHBondContact O-N 2.88Å; Y79-G83 VanDerWaalsContact O-CA 3.29Å; Y79-G83 WeakPolarHBondContact O-CA 3.35Å; Y79-G83 PolarHBondContact O-N 2.88Å
80	S	93.9	Very high	92.9	Very high	64 Å²	64	71 Å²	71	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-32.3	176.2	-173.9	0	0	0	0	112.5	S76 E77 R84	S76-S80 WeakPolarHBondContact O-CB 3.43Å; S76-S80 PolarHBondContact O-N 3.49Å; E77-S80 WeakPolarHBondContact O-CB 3.47Å; E77-S80 PolarHBondContact O-N 3.5Å; E77-S80 VanDerWaalsContact O-N 3.13Å; S80-R84 PolarHBondContact O-NH1 3.16Å
81	V	94.3	Very high	93	Very high	34 Å²	34	66.3 Å²	66.3	21%	0.206	34%	0.337	C	S	.	.	H	α-helix	trans	-86.3	-49.4	177.7	179.2	0	0	0	0	111.8	Y32 E77 A78 Y79 S87 R88 Y91	Y32-V81 HydrophobicContact CD2-CB 3.91Å; Y32-V81 HydrophobicContact CD2-CG1 3.87Å; Y32-V81 HydrophobicContact CD2-CG2 4.24Å; Y32-V81 HydrophobicContact CE2-CB 3.86Å; Y32-V81 HydrophobicContact CE2-CG1 3.86Å; Y32-V81 HydrophobicContact CE2-CG2 3.67Å; E77-V81 PolarHBondContact O-N 2.79Å; A78-V81 PolarHBondContact O-N 3.35Å; Y79-V81 PolarHBondContact O-N 2.88Å; V81-S87 CarbonylContact O-C 3.56Å; V81-S87 WeakPolarHBondContact O-CB 3.38Å; V81-R88 PolarHBondContact O-N 3.12Å; V81-R88 VanDerWaalsContact O-N 3.16Å; V81-Y91 HydrophobicContact CG1-CD2 4.05Å; V81-Y91 HydrophobicContact CG1-CG 3.9Å
82	L	95.1	Very high	93.1	Very high	5 Å²	5	66 Å²	66	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-81	-20.1	-174.5	-64.9	-179.4	0	0	0	114	Y33 L36 I47 A78 R88 Y91	Y33-L82 HydrophobicContact CD1-CD1 3.82Å; Y33-L82 HydrophobicContact CD1-CD2 4.49Å; Y33-L82 HydrophobicContact CE1-CD1 3.96Å; Y33-L82 HydrophobicContact CE1-CD2 3.9Å; Y33-L82 HydrophobicContact CE2-CD2 3.92Å; Y33-L82 HydrophobicContact CG-CD1 4.13Å; L36-L82 HydrophobicContact CD1-CD1 3.92Å; I47-L82 HydrophobicContact CD1-CB 4.42Å; I47-L82 HydrophobicContact CG2-CB 4.05Å; A78-L82 WeakPolarHBondContact O-CB 3.29Å; A78-L82 WeakPolarHBondContact O-CG 3.47Å; A78-L82 PolarHBondContact O-N 3.3Å; L82-R88 HydrophobicContact CD2-CG 4.08Å; L82-Y91 HydrophobicContact CD2-CD1 3.84Å; L82-Y91 HydrophobicContact CD2-CE1 4.23Å
83	G	92.2	Very high	92.7	Very high	36 Å²	36	68.2 Å²	68.2	37%	0.371	35%	0.351	S	S	.	.	S	Bend	trans	-76	-23.3	-176.8	0	0	0	0	0	114.2	Y79	Y79-G83 VanDerWaalsContact O-CA 3.29Å; Y79-G83 WeakPolarHBondContact O-CA 3.35Å; Y79-G83 PolarHBondContact O-N 2.88Å
84	R	93.1	Very high	92.3	Very high	153 Å²	153	69.3 Å²	69.3	58%	0.577	35%	0.349	S	S	*	.	S	Bend	trans	-99.7	131.9	174.1	-65.9	-175.4	179.5	87.8	-1.8	109.7	S80 E86 S87 R88	S80-R84 PolarHBondContact O-NH1 3.16Å; R84-E86 VanDerWaalsContact C-N 3.32Å; R84-E86 PolarHBondContact O-N 3.42Å; R84-S87 PolarHBondContact O-N 2.7Å; R84-R88 VanDerWaalsContact O-CB 3.31Å; R84-R88 WeakPolarHBondContact O-CB 3.25Å; R84-R88 PolarHBondContact O-N 2.86Å
85	S	91.7	Very high	91.9	Very high	106 Å²	106	72.5 Å²	72.5	74%	0.741	36%	0.36	S	S	*	.	H	α-helix	trans	-58.6	-41.8	-178.3	52.8	0	0	0	0	113	R89	S85-R89 WeakPolarHBondContact O-CB 3.3Å; S85-R89 PolarHBondContact O-N 2.78Å
86	E	92.2	Very high	91.1	Very high	158 Å²	158	79.5 Å²	79.5	74%	0.738	39%	0.39	S	S	*	.	H	α-helix	trans	-65.5	-51.6	177.8	-176.7	173.5	-150.7	0	0	111.8	R84 R88 R89 E90	R84-E86 VanDerWaalsContact C-N 3.32Å; R84-E86 PolarHBondContact O-N 3.42Å; E86-R88 VanDerWaalsContact C-N 3.31Å; E86-R88 PolarHBondContact O-N 3.08Å; E86-R89 WeakPolarHBondContact O-CB 3.3Å; E86-R89 PolarHBondContact O-N 3.46Å; E86-R89 VanDerWaalsContact O-N 3.12Å; E86-E90 PolarHBondContact O-N 2.94Å
87	S	91.5	Very high	90	Very high	36 Å²	36	79.5 Å²	79.5	25%	0.252	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-37	178.6	-53.2	0	0	0	0	112.4	V81 R84 E90 Y91	V81-S87 CarbonylContact O-C 3.56Å; V81-S87 WeakPolarHBondContact O-CB 3.38Å; R84-S87 PolarHBondContact O-N 2.7Å; S87-E90 PolarHBondContact O-N 3.37Å; S87-Y91 WeakPolarHBondContact O-CB 3.37Å; S87-Y91 PolarHBondContact O-N 3.05Å
88	R	94.5	Very high	88.9	Confident	39 Å²	39	80 Å²	80	15%	0.147	39%	0.393	C	S	.	.	H	α-helix	trans	-63.3	-43.4	173.4	-178.7	177.1	178.7	178.6	3.6	111.5	Y33 S40 A42 I47 V81 L82 R84 E86 Y91 D92	Y33-R88 PolarHBondContact OH-NE 3.32Å; Y33-R88 PolarHBondContact OH-NH2 3.46Å; S40-R88 PolarHBondContact O-NH2 3.19Å; A42-R88 VanDerWaalsContact O-CZ 3.31Å; A42-R88 PolarHBondContact O-NH1 3.03Å; A42-R88 PolarHBondContact O-NH2 2.69Å; I47-R88 VanDerWaalsContact CD1-NH1 3.28Å; V81-R88 PolarHBondContact O-N 3.12Å; V81-R88 VanDerWaalsContact O-N 3.16Å; L82-R88 HydrophobicContact CD2-CG 4.08Å; R84-R88 VanDerWaalsContact O-CB 3.31Å; R84-R88 WeakPolarHBondContact O-CB 3.25Å; R84-R88 PolarHBondContact O-N 2.86Å; E86-R88 VanDerWaalsContact C-N 3.31Å; E86-R88 PolarHBondContact O-N 3.08Å; R88-Y91 PolarHBondContact O-N 3.33Å; R88-D92 IonicContact NE-OD2 3.91Å; R88-D92 WeakPolarHBondContact O-CB 3.42Å; R88-D92 PolarHBondContact O-N 3.08Å
89	R	92	Very high	87.5	Confident	195 Å²	195	84 Å²	84	74%	0.736	43%	0.427	S	S	*	.	H	α-helix	trans	-62.4	-44.4	178.4	-177.9	-176.7	179.4	-174.2	0.1	111.5	S85 E86 D92 L93	S85-R89 WeakPolarHBondContact O-CB 3.3Å; S85-R89 PolarHBondContact O-N 2.78Å; E86-R89 WeakPolarHBondContact O-CB 3.3Å; E86-R89 PolarHBondContact O-N 3.46Å; E86-R89 VanDerWaalsContact O-N 3.12Å; R89-D92 PolarHBondContact O-N 3.39Å; R89-L93 WeakPolarHBondContact O-CB 3.25Å; R89-L93 PolarHBondContact O-N 3.15Å
90	E	88.4	Confident	85.7	Confident	142 Å²	142	88.4 Å²	88.4	66%	0.664	45%	0.447	S	S	*	.	H	α-helix	trans	-62.8	-45.2	176.5	-174.8	178.4	-173.4	0	0	111.3	E86 S87 L93 N94	E86-E90 PolarHBondContact O-N 2.94Å; S87-E90 PolarHBondContact O-N 3.37Å; E90-L93 PolarHBondContact O-N 3.47Å; E90-N94 WeakPolarHBondContact O-CB 3.39Å; E90-N94 PolarHBondContact O-N 3.34Å
91	Y	91.2	Very high	83.7	Confident	41 Å²	41	85.8 Å²	85.8	16%	0.161	43%	0.43	C	S	.	.	H	α-helix	trans	-59.2	-48.5	175.1	179.5	-103.4	0	0	0	112.3	D31 Y32 Y33 V81 L82 S87 R88 L93 N94 R95	D31-Y91 PolarHBondContact OD1-OH 3.45Å; Y32-Y91 HydrophobicContact CD2-CD1 4.38Å; Y32-Y91 AromaticContact CD2-CD2 3.62Å; Y32-Y91 HydrophobicContact CD2-CD2 3.62Å; Y32-Y91 HydrophobicContact CD2-CE1 4.02Å; Y32-Y91 AromaticContact CD2-CE2 3.2Å; Y32-Y91 HydrophobicContact CD2-CE2 3.2Å; Y32-Y91 HydrophobicContact CD2-CG 4.19Å; Y32-Y91 AromaticContact CD2-CZ 3.42Å; Y32-Y91 VanDerWaalsContact CD2-CZ 3.42Å; Y32-Y91 AromaticContact CE2-CD2 3.72Å; Y32-Y91 HydrophobicContact CE2-CD2 3.72Å; Y32-Y91 AromaticContact CE2-CE2 3.43Å; Y32-Y91 HydrophobicContact CE2-CE2 3.43Å; Y32-Y91 VanDerWaalsContact CE2-CE2 3.43Å; Y32-Y91 HydrophobicContact CG-CE2 4.14Å; Y32-Y91 AromaticContact CG-CZ 3.97Å; Y32-Y91 PolarHBondContact N-OH 3.47Å; Y33-Y91 HydrophobicContact CD2-CE1 4.15Å; Y33-Y91 HydrophobicContact CE2-CD1 4.2Å; Y33-Y91 AromaticContact CE2-CE1 3.91Å; Y33-Y91 HydrophobicContact CE2-CE1 3.91Å; V81-Y91 HydrophobicContact CG1-CD2 4.05Å; V81-Y91 HydrophobicContact CG1-CG 3.9Å; L82-Y91 HydrophobicContact CD2-CD1 3.84Å; L82-Y91 HydrophobicContact CD2-CE1 4.23Å; S87-Y91 WeakPolarHBondContact O-CB 3.37Å; S87-Y91 PolarHBondContact O-N 3.05Å; R88-Y91 PolarHBondContact O-N 3.33Å; Y91-L93 VanDerWaalsContact C-N 3.29Å; Y91-L93 PolarHBondContact O-N 2.93Å; Y91-N94 PolarHBondContact O-N 3.24Å; Y91-R95 VanDerWaalsContact O-CB 3.25Å; Y91-R95 WeakPolarHBondContact O-CB 3.43Å; Y91-R95 PolarHBondContact O-N 3.2Å
92	D	92.3	Very high	81.5	Confident	43 Å²	43	89.3 Å²	89.3	23%	0.23	45%	0.447	C	S	.	.	H	α-helix	trans	-63.8	-35.8	179.6	-72.1	-18.3	0	0	0	111.7	Y33 R88 R89 K96	Y33-D92 WeakPolarHBondContact CE2-OD1 3.43Å; Y33-D92 PolarHBondContact OH-OD1 2.99Å; Y33-D92 PolarHBondContact OH-OD2 3.25Å; R88-D92 IonicContact NE-OD2 3.91Å; R88-D92 WeakPolarHBondContact O-CB 3.42Å; R88-D92 PolarHBondContact O-N 3.08Å; R89-D92 PolarHBondContact O-N 3.39Å; D92-K96 VanDerWaalsContact O-CG 3.29Å; D92-K96 WeakPolarHBondContact O-CG 3.34Å; D92-K96 PolarHBondContact O-N 3.44Å
93	L	86	Confident	79.3	Confident	108 Å²	108	92.4 Å²	92.4	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-65.6	-51.1	174	-174.6	148.9	0	0	0	110.4	R89 E90 Y91 R95 K96 V97	R89-L93 WeakPolarHBondContact O-CB 3.25Å; R89-L93 PolarHBondContact O-N 3.15Å; E90-L93 PolarHBondContact O-N 3.47Å; Y91-L93 VanDerWaalsContact C-N 3.29Å; Y91-L93 PolarHBondContact O-N 2.93Å; L93-R95 VanDerWaalsContact C-N 3.3Å; L93-R95 PolarHBondContact O-N 3.18Å; L93-K96 PolarHBondContact O-N 3.12Å; L93-K96 VanDerWaalsContact O-N 3.13Å; L93-V97 HydrophobicContact CD2-CG2 3.95Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.04Å; L93-V97 PolarHBondContact O-N 3.29Å
94	N	82.7	Confident	77.2	Confident	79 Å²	79	94.3 Å²	94.3	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-40.6	179	-168.1	19.6	0	0	0	111.5	E90 Y91 K96 V97 N98	E90-N94 WeakPolarHBondContact O-CB 3.39Å; E90-N94 PolarHBondContact O-N 3.34Å; Y91-N94 PolarHBondContact O-N 3.24Å; N94-K96 VanDerWaalsContact C-N 3.33Å; N94-K96 PolarHBondContact O-N 3.06Å; N94-V97 PolarHBondContact O-N 3.3Å; N94-N98 WeakPolarHBondContact O-CB 3.46Å; N94-N98 PolarHBondContact O-N 3.37Å; N94-N98 PolarHBondContact O-ND2 3.18Å; N94-N98 PolarHBondContact OD1-ND2 3.01Å
95	R	83.5	Confident	74.8	Confident	102 Å²	102	91.4 Å²	91.4	39%	0.385	48%	0.477	S	S	.	.	H	α-helix	trans	-58.6	-42.5	174.3	-173.3	179.3	-178.7	-77.9	-0.5	112	D31 Y91 L93 A99	D31-R95 IonicContact OD1-NE 3.28Å; D31-R95 IonicContact OD2-CZ 3.87Å; D31-R95 IonicContact OD2-NE 3.49Å; D31-R95 PolarHBondContact OD2-NE 3.21Å; D31-R95 IonicContact OD2-NH2 3.78Å; D31-R95 PolarHBondContact OD2-NH2 3.1Å; Y91-R95 VanDerWaalsContact O-CB 3.25Å; Y91-R95 WeakPolarHBondContact O-CB 3.43Å; Y91-R95 PolarHBondContact O-N 3.2Å; L93-R95 VanDerWaalsContact C-N 3.3Å; L93-R95 PolarHBondContact O-N 3.18Å; R95-A99 VanDerWaalsContact O-CB 3.3Å; R95-A99 WeakPolarHBondContact O-CB 3.27Å; R95-A99 PolarHBondContact O-N 3.29Å
96	K	79.3	Confident	72.7	Confident	152 Å²	152	88.5 Å²	88.5	66%	0.661	46%	0.459	S	S	*	.	H	α-helix	trans	-68.2	-40.1	174.9	-73.9	172.7	-176.3	178.3	0	112.5	D92 L93 N94 N98 A99 F100	D92-K96 VanDerWaalsContact O-CG 3.29Å; D92-K96 WeakPolarHBondContact O-CG 3.34Å; D92-K96 PolarHBondContact O-N 3.44Å; L93-K96 PolarHBondContact O-N 3.12Å; L93-K96 VanDerWaalsContact O-N 3.13Å; N94-K96 VanDerWaalsContact C-N 3.33Å; N94-K96 PolarHBondContact O-N 3.06Å; K96-N98 VanDerWaalsContact C-N 3.33Å; K96-A99 PolarHBondContact O-N 2.79Å; K96-F100 WeakPolarHBondContact O-CB 3.32Å; K96-F100 PolarHBondContact O-N 2.89Å
97	V	71.6	Confident	70.6	Confident	35 Å²	35	86.7 Å²	86.7	21%	0.212	45%	0.449	C	S	.	.	H	α-helix	trans	-63.6	-41.5	177.2	175.3	0	0	0	0	110.7	L93 N94 G101 I102 S103	L93-V97 HydrophobicContact CD2-CG2 3.95Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.04Å; L93-V97 PolarHBondContact O-N 3.29Å; N94-V97 PolarHBondContact O-N 3.3Å; V97-G101 PolarHBondContact O-N 2.99Å; V97-I102 HydrophobicContact CG1-CB 3.92Å; V97-I102 HydrophobicContact CG1-CG2 3.84Å; V97-I102 PolarHBondContact O-N 3.38Å; V97-S103 WeakPolarHBondContact CG1-OG 3.33Å
98	N	69.6	Low	68.5	Low	87 Å²	87	92.8 Å²	92.8	47%	0.465	47%	0.466	S	S	.	.	H	α-helix	trans	-66	-43	174	-66	-24.1	0	0	0	111.5	N94 K96 G101 S103	N94-N98 WeakPolarHBondContact O-CB 3.46Å; N94-N98 PolarHBondContact O-N 3.37Å; N94-N98 PolarHBondContact O-ND2 3.18Å; N94-N98 PolarHBondContact OD1-ND2 3.01Å; K96-N98 VanDerWaalsContact C-N 3.33Å; N98-G101 WeakPolarHBondContact O-CA 3.28Å; N98-G101 PolarHBondContact O-N 2.69Å; N98-S103 WeakPolarHBondContact OD1-CB 3.47Å
99	A	67	Low	66.4	Low	84 Å²	84	92.6 Å²	92.6	69%	0.694	47%	0.468	S	S	*	.	H	α-helix	trans	-67.4	-34.6	178.1	0	0	0	0	0	113.6	R95 K96 G101	R95-A99 VanDerWaalsContact O-CB 3.3Å; R95-A99 WeakPolarHBondContact O-CB 3.27Å; R95-A99 PolarHBondContact O-N 3.29Å; K96-A99 PolarHBondContact O-N 2.79Å; A99-G101 PolarHBondContact O-N 3.37Å
100	F	58.6	Low	64.6	Low	158 Å²	158	90 Å²	90	69%	0.693	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-8.5	172.3	-163.8	-86.1	0	0	0	111.6	K96 I102	K96-F100 WeakPolarHBondContact O-CB 3.32Å; K96-F100 PolarHBondContact O-N 2.89Å; F100-I102 HydrophobicContact CB-CD1 4.31Å; F100-I102 HydrophobicContact CD1-CB 4.43Å; F100-I102 HydrophobicContact CD1-CD1 3.12Å; F100-I102 HydrophobicContact CD1-CG1 3.44Å; F100-I102 VanDerWaalsContact CD1-CG1 3.44Å; F100-I102 HydrophobicContact CE1-CD1 3.51Å; F100-I102 HydrophobicContact CE1-CG1 3.89Å; F100-I102 HydrophobicContact CG-CD1 3.93Å; F100-I102 HydrophobicContact CG-CG1 4.49Å; F100-I102 PolarHBondContact O-N 2.84Å
101	G	51.5	Low	63.3	Low	8 Å²	8	86.9 Å²	86.9	8%	0.082	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-1.9	-177.9	0	0	0	0	0	114.2	V97 N98 A99 S103 A104 D105 A106	V97-G101 PolarHBondContact O-N 2.99Å; N98-G101 WeakPolarHBondContact O-CA 3.28Å; N98-G101 PolarHBondContact O-N 2.69Å; A99-G101 PolarHBondContact O-N 3.37Å; G101-S103 PolarHBondContact O-N 3.48Å; G101-S103 VanDerWaalsContact O-N 3.08Å; G101-A104 PolarHBondContact O-N 3.33Å; G101-A104 VanDerWaalsContact O-N 3.16Å; G101-D105 CarbonylContact O-C 3.46Å; G101-D105 PolarHBondContact O-N 2.82Å; G101-A106 VanDerWaalsContact C-N 3.33Å; G101-A106 VanDerWaalsContact O-CB 3.28Å; G101-A106 WeakPolarHBondContact O-CB 3.49Å; G101-A106 PolarHBondContact O-N 2.82Å
102	I	48.5	Very low	62.3	Low	109 Å²	109	87.4 Å²	87.4	56%	0.559	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-33.2	-175.8	-83.5	151.2	0	0	0	112.5	V97 F100	V97-I102 HydrophobicContact CG1-CB 3.92Å; V97-I102 HydrophobicContact CG1-CG2 3.84Å; V97-I102 PolarHBondContact O-N 3.38Å; F100-I102 HydrophobicContact CB-CD1 4.31Å; F100-I102 HydrophobicContact CD1-CB 4.43Å; F100-I102 HydrophobicContact CD1-CD1 3.12Å; F100-I102 HydrophobicContact CD1-CG1 3.44Å; F100-I102 VanDerWaalsContact CD1-CG1 3.44Å; F100-I102 HydrophobicContact CE1-CD1 3.51Å; F100-I102 HydrophobicContact CE1-CG1 3.89Å; F100-I102 HydrophobicContact CG-CD1 3.93Å; F100-I102 HydrophobicContact CG-CG1 4.49Å; F100-I102 PolarHBondContact O-N 2.84Å
103	S	47.5	Very low	61.4	Low	70 Å²	70	93.4 Å²	93.4	49%	0.49	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.6	-177	-81.8	0	0	0	0	115.9	V97 N98 G101	V97-S103 WeakPolarHBondContact CG1-OG 3.33Å; N98-S103 WeakPolarHBondContact OD1-CB 3.47Å; G101-S103 PolarHBondContact O-N 3.48Å; G101-S103 VanDerWaalsContact O-N 3.08Å
104	A	47.7	Very low	61.1	Low	75 Å²	75	90.7 Å²	90.7	62%	0.62	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.4	-35.4	171.8	0	0	0	0	0	114.1	G101	G101-A104 PolarHBondContact O-N 3.33Å; G101-A104 VanDerWaalsContact O-N 3.16Å
105	D	43.3	Very low	60.9	Low	93 Å²	93	90 Å²	90	50%	0.497	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-24.8	-163.8	-80.4	-32.9	0	0	0	116.7	G101 F107 R108	G101-D105 CarbonylContact O-C 3.46Å; G101-D105 PolarHBondContact O-N 2.82Å; D105-F107 PolarHBondContact O-N 3.42Å; D105-R108 WeakPolarHBondContact O-CB 3.43Å; D105-R108 PolarHBondContact O-N 3.4Å; D105-R108 VanDerWaalsContact OD1-CD 3.27Å; D105-R108 WeakPolarHBondContact OD1-CD 3.48Å; D105-R108 IonicContact OD1-CZ 3.82Å; D105-R108 IonicContact OD1-NE 2.69Å; D105-R108 PolarHBondContact OD1-NE 2.92Å
106	A	47.8	Very low	60.8	Low	44 Å²	44	91.8 Å²	91.8	36%	0.364	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.6	-179.9	0	0	0	0	0	111.8	G101	G101-A106 VanDerWaalsContact C-N 3.33Å; G101-A106 VanDerWaalsContact O-CB 3.28Å; G101-A106 WeakPolarHBondContact O-CB 3.49Å; G101-A106 PolarHBondContact O-N 2.82Å
107	F	47.4	Very low	61.2	Low	121 Å²	121	91.2 Å²	91.2	53%	0.531	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	26.5	167.4	-69.7	-80.3	0	0	0	112.9	D105 M109 W141	D105-F107 PolarHBondContact O-N 3.42Å; F107-M109 PolarHBondContact O-N 3.36Å; F107-W141 HydrophobicContact CE1-CB 4.35Å; F107-W141 AromaticContact CE1-CD1 3.85Å; F107-W141 HydrophobicContact CE1-CD2 4.5Å; F107-W141 AromaticContact CE1-CG 3.95Å; F107-W141 HydrophobicContact CE1-CG 3.95Å; F107-W141 AromaticContact CZ-CD1 3.44Å; F107-W141 VanDerWaalsContact CZ-CD1 3.44Å; F107-W141 HydrophobicContact CZ-CD2 4.15Å; F107-W141 AromaticContact CZ-CE2 3.9Å; F107-W141 AromaticContact CZ-CG 3.86Å; F107-W141 HydrophobicContact CZ-CG 3.86Å; F107-W141 AromaticContact CZ-NE1 3.46Å
108	R	48	Very low	61.7	Low	163 Å²	163	92.5 Å²	92.5	62%	0.615	50%	0.504	S	S	*	.			trans	-70.3	77.4	161.2	-164.2	175.2	77.8	159.3	6.8	107.3	D105 H110	D105-R108 WeakPolarHBondContact O-CB 3.43Å; D105-R108 PolarHBondContact O-N 3.4Å; D105-R108 VanDerWaalsContact OD1-CD 3.27Å; D105-R108 WeakPolarHBondContact OD1-CD 3.48Å; D105-R108 IonicContact OD1-CZ 3.82Å; D105-R108 IonicContact OD1-NE 2.69Å; D105-R108 PolarHBondContact OD1-NE 2.92Å; R108-H110 VanDerWaalsContact C-N 3.3Å; R108-H110 PolarHBondContact O-N 2.87Å
109	M	49.6	Very low	62.7	Low	36 Å²	36	93 Å²	93	18%	0.177	51%	0.506	C	S	.	.			trans	-46.7	111.7	144.7	-104.4	-62.8	-162.6	0	0	104.1	F107 Y111 R133 K137	F107-M109 PolarHBondContact O-N 3.36Å; M109-Y111 HydrophobicContact CB-CD2 3.65Å; M109-Y111 HydrophobicContact CB-CE2 3.36Å; M109-Y111 HydrophobicContact CB-CG 4.49Å; M109-Y111 HydrophobicContact CG-CE2 4.23Å; M109-Y111 VanDerWaalsContact O-CD2 3.26Å; M109-Y111 WeakPolarHBondContact O-CD2 3.48Å; M109-Y111 PolarHBondContact O-N 2.94Å; M109-R133 HydrophobicContact CE-CB 3.78Å; M109-R133 WeakPolarHBondContact CE-O 3.49Å; M109-K137 HydrophobicContact CE-CB 3.69Å; M109-K137 HydrophobicContact CE-CD 3.66Å; M109-K137 HydrophobicContact CE-CG 4.32Å; M109-K137 HydrophobicContact CG-CD 3.82Å; M109-K137 HydrophobicContact SD-CD 3.82Å
110	H	56	Low	63.6	Low	140 Å²	140	97.4 Å²	97.4	65%	0.648	51%	0.51	S	S	*	.			trans	-62.8	97.6	165	-175.3	70.8	0	0	0	104.7	R108 P112	R108-H110 VanDerWaalsContact C-N 3.3Å; R108-H110 PolarHBondContact O-N 2.87Å; H110-P112 WeakPolarHBondContact O-CD 3.32Å
111	Y	60.1	Low	65.1	Low	77 Å²	77	94.7 Å²	94.7	30%	0.302	51%	0.506	S	S	.	.			trans	-81.6	100.1	166.8	-74.1	-90.2	0	0	0	104.8	M109 M130 P168	M109-Y111 HydrophobicContact CB-CD2 3.65Å; M109-Y111 HydrophobicContact CB-CE2 3.36Å; M109-Y111 HydrophobicContact CB-CG 4.49Å; M109-Y111 HydrophobicContact CG-CE2 4.23Å; M109-Y111 VanDerWaalsContact O-CD2 3.26Å; M109-Y111 WeakPolarHBondContact O-CD2 3.48Å; M109-Y111 PolarHBondContact O-N 2.94Å; Y111-M130 VanDerWaalsContact CA-CE 3.49Å; Y111-M130 HydrophobicContact CD1-CE 3.31Å; Y111-M130 HydrophobicContact CD1-SD 3.69Å; Y111-M130 HydrophobicContact CE1-CE 4.24Å; Y111-M130 HydrophobicContact CE1-SD 4.39Å; Y111-M130 HydrophobicContact CG-CE 3.93Å; Y111-P168 HydrophobicContact CE1-CB 4.16Å; Y111-P168 HydrophobicContact CE1-CG 4.31Å; Y111-P168 HydrophobicContact CE2-CB 4.48Å
112	P	69.7	Low	66.8	Low	51 Å²	51	95 Å²	95	33%	0.331	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-51.4	152.5	164	16.2	-25.3	0	0	0	108.7	H110 Y126 M130	H110-P112 WeakPolarHBondContact O-CD 3.32Å; P112-Y126 WeakPolarHBondContact CG-OH 3.34Å; P112-Y126 PolarHBondContact O-OH 2.84Å; P112-M130 HydrophobicContact CG-CE 4.05Å
113	H	73.6	Confident	68.6	Low	170 Å²	170	93 Å²	93	79%	0.787	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-76.3	140.5	166.4	-69.5	76.1	0	0	0	107.1
114	P	79.5	Confident	70.4	Confident	51 Å²	51	95.2 Å²	95.2	33%	0.331	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-54.9	138.7	171.5	21.8	-30.1	0	0	0	109.2	L118 L123 Y126	P114-L118 HydrophobicContact CB-CD1 3.67Å; P114-L123 HydrophobicContact CB-CD1 4.01Å; P114-L123 HydrophobicContact CG-CD1 4.22Å; P114-Y126 HydrophobicContact CB-CD1 3.74Å; P114-Y126 HydrophobicContact CB-CE1 3.67Å; P114-Y126 HydrophobicContact CB-CG 4.26Å; P114-Y126 HydrophobicContact CG-CD1 4.46Å; P114-Y126 HydrophobicContact CG-CE1 4.12Å
115	P	79	Confident	72.3	Confident	64 Å²	64	94.5 Å²	94.5	42%	0.416	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-47.1	133.6	167	-25.7	26.7	0	0	0	111	D117 L118	P115-D117 VanDerWaalsContact CB-OD1 3.27Å; P115-D117 WeakPolarHBondContact CB-OD1 3.26Å; P115-D117 PolarHBondContact O-N 3.37Å; P115-D117 VanDerWaalsContact O-N 3.15Å; P115-L118 HydrophobicContact CB-CD1 4.17Å; P115-L118 HydrophobicContact CB-CG 4.09Å; P115-L118 HydrophobicContact CG-CD1 4.08Å; P115-L118 HydrophobicContact CG-CG 4.35Å; P115-L118 WeakPolarHBondContact O-CD1 3.45Å; P115-L118 PolarHBondContact O-N 3.09Å
116	P	81.6	Confident	74.3	Confident	140 Å²	140	92 Å²	92	91%	0.909	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.3	-172.4	27	-34.8	0	0	0	113.6
117	D	87.8	Confident	75.8	Confident	140 Å²	140	94.6 Å²	94.6	75%	0.749	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	7.9	-176.8	61.1	-37.7	0	0	0	114.1	P115 D119	P115-D117 VanDerWaalsContact CB-OD1 3.27Å; P115-D117 WeakPolarHBondContact CB-OD1 3.26Å; P115-D117 PolarHBondContact O-N 3.37Å; P115-D117 VanDerWaalsContact O-N 3.15Å; D117-D119 PolarHBondContact O-N 2.76Å
118	L	82	Confident	77.7	Confident	61 Å²	61	92.7 Å²	92.7	32%	0.319	48%	0.48	S	S	.	.			trans	-65.7	130.6	175.7	-76	163	0	0	0	111.6	P114 P115 Y126	P114-L118 HydrophobicContact CB-CD1 3.67Å; P115-L118 HydrophobicContact CB-CD1 4.17Å; P115-L118 HydrophobicContact CB-CG 4.09Å; P115-L118 HydrophobicContact CG-CD1 4.08Å; P115-L118 HydrophobicContact CG-CG 4.35Å; P115-L118 WeakPolarHBondContact O-CD1 3.45Å; P115-L118 PolarHBondContact O-N 3.09Å; L118-Y126 HydrophobicContact CD1-CG 4.41Å
119	D	89.9	Confident	79.4	Confident	97 Å²	97	88.1 Å²	88.1	52%	0.519	47%	0.466	S	S	.	.			trans	-71.8	174.9	166.5	74.8	-48.9	0	0	0	110.7	D117 V121 G122 L123	D117-D119 PolarHBondContact O-N 2.76Å; D119-V121 VanDerWaalsContact C-N 3.28Å; D119-V121 PolarHBondContact O-N 2.92Å; D119-V121 WeakPolarHBondContact OD2-CB 3.4Å; D119-V121 PolarHBondContact OD2-N 3.29Å; D119-G122 PolarHBondContact O-N 2.85Å; D119-G122 VanDerWaalsContact OD1-CA 3.31Å; D119-G122 WeakPolarHBondContact OD1-CA 3.31Å; D119-G122 PolarHBondContact OD1-N 2.93Å; D119-L123 WeakPolarHBondContact O-CB 2.94Å; D119-L123 PolarHBondContact O-N 3.32Å
120	K	86.6	Confident	80.9	Confident	177 Å²	177	88 Å²	88	77%	0.77	47%	0.465	S	S	*	.	H	α-helix	trans	-58.7	-40.5	-179	-65.8	-176	-178.9	-178	0	112.3	L123 E124	K120-L123 PolarHBondContact O-N 2.95Å; K120-E124 WeakPolarHBondContact O-CG 3.39Å; K120-E124 PolarHBondContact O-N 2.85Å
121	V	90.7	Very high	81.9	Confident	102 Å²	102	86 Å²	86	62%	0.618	45%	0.452	S	S	*	.	H	α-helix	trans	-70.2	-41.8	-180	-176.1	0	0	0	0	110.3	D119 L123 E124 A125	D119-V121 VanDerWaalsContact C-N 3.28Å; D119-V121 PolarHBondContact O-N 2.92Å; D119-V121 WeakPolarHBondContact OD2-CB 3.4Å; D119-V121 PolarHBondContact OD2-N 3.29Å; V121-L123 VanDerWaalsContact C-N 3.34Å; V121-L123 PolarHBondContact O-N 3.47Å; V121-E124 PolarHBondContact O-N 2.82Å; V121-A125 WeakPolarHBondContact O-CB 3.33Å; V121-A125 PolarHBondContact O-N 3.47Å
122	G	87.1	Confident	82.9	Confident	15 Å²	15	87.4 Å²	87.4	16%	0.155	46%	0.456	C	S	.	.	H	α-helix	trans	-60.9	-40.5	173.2	0	0	0	0	0	113.1	D119 A125 Y126	D119-G122 PolarHBondContact O-N 2.85Å; D119-G122 VanDerWaalsContact OD1-CA 3.31Å; D119-G122 WeakPolarHBondContact OD1-CA 3.31Å; D119-G122 PolarHBondContact OD1-N 2.93Å; G122-A125 PolarHBondContact O-N 3.48Å; G122-Y126 WeakPolarHBondContact O-CB 3.45Å; G122-Y126 PolarHBondContact O-N 3.22Å
123	L	84.7	Confident	83.5	Confident	67 Å²	67	91.2 Å²	91.2	35%	0.351	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-44.2	176.5	-173.2	65.9	0	0	0	111.4	P114 D119 K120 V121 A125 Y126 E127	P114-L123 HydrophobicContact CB-CD1 4.01Å; P114-L123 HydrophobicContact CG-CD1 4.22Å; D119-L123 WeakPolarHBondContact O-CB 2.94Å; D119-L123 PolarHBondContact O-N 3.32Å; K120-L123 PolarHBondContact O-N 2.95Å; V121-L123 VanDerWaalsContact C-N 3.34Å; V121-L123 PolarHBondContact O-N 3.47Å; L123-A125 PolarHBondContact O-N 2.86Å; L123-Y126 WeakPolarHBondContact O-CB 3.42Å; L123-Y126 PolarHBondContact O-N 3.08Å; L123-E127 WeakPolarHBondContact O-CB 3.46Å; L123-E127 WeakPolarHBondContact O-CG 3.39Å; L123-E127 PolarHBondContact O-N 3.39Å
124	E	85.5	Confident	83.6	Confident	116 Å²	116	85.4 Å²	85.4	54%	0.542	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-42.3	175	-74.6	176.2	-168.7	0	0	112	K120 V121 Y126 E127 N128	K120-E124 WeakPolarHBondContact O-CG 3.39Å; K120-E124 PolarHBondContact O-N 2.85Å; V121-E124 PolarHBondContact O-N 2.82Å; E124-Y126 VanDerWaalsContact C-N 3.35Å; E124-E127 PolarHBondContact O-N 3.04Å; E124-N128 VanDerWaalsContact O-CB 3.31Å; E124-N128 WeakPolarHBondContact O-CB 3.29Å; E124-N128 PolarHBondContact O-N 3.36Å; E124-N128 PolarHBondContact O-ND2 3.31Å; E124-N128 VanDerWaalsContact O-ND2 3.07Å
125	A	87.4	Confident	83.6	Confident	59 Å²	59	86.8 Å²	86.8	49%	0.488	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176	0	0	0	0	0	111.7	V121 G122 L123 N128 E129	V121-A125 WeakPolarHBondContact O-CB 3.33Å; V121-A125 PolarHBondContact O-N 3.47Å; G122-A125 PolarHBondContact O-N 3.48Å; L123-A125 PolarHBondContact O-N 2.86Å; A125-N128 PolarHBondContact O-N 3.43Å; A125-E129 WeakPolarHBondContact O-CB 3.43Å; A125-E129 PolarHBondContact O-N 3.35Å
126	Y	85.4	Confident	83.6	Confident	42 Å²	42	88 Å²	88	17%	0.165	44%	0.44	C	S	.	.	H	α-helix	trans	-60.3	-50.8	174.2	178.8	-97.8	0	0	0	111.7	P112 P114 L118 G122 L123 E124 N128 E129 M130	P112-Y126 WeakPolarHBondContact CG-OH 3.34Å; P112-Y126 PolarHBondContact O-OH 2.84Å; P114-Y126 HydrophobicContact CB-CD1 3.74Å; P114-Y126 HydrophobicContact CB-CE1 3.67Å; P114-Y126 HydrophobicContact CB-CG 4.26Å; P114-Y126 HydrophobicContact CG-CD1 4.46Å; P114-Y126 HydrophobicContact CG-CE1 4.12Å; L118-Y126 HydrophobicContact CD1-CG 4.41Å; G122-Y126 WeakPolarHBondContact O-CB 3.45Å; G122-Y126 PolarHBondContact O-N 3.22Å; L123-Y126 WeakPolarHBondContact O-CB 3.42Å; L123-Y126 PolarHBondContact O-N 3.08Å; E124-Y126 VanDerWaalsContact C-N 3.35Å; Y126-N128 VanDerWaalsContact C-N 3.32Å; Y126-N128 PolarHBondContact O-N 3.33Å; Y126-E129 PolarHBondContact O-N 3.42Å; Y126-M130 HydrophobicContact CD1-CG 4.17Å; Y126-M130 HydrophobicContact CD1-SD 4.1Å; Y126-M130 HydrophobicContact CE1-CE 4.3Å; Y126-M130 HydrophobicContact CE1-CG 3.8Å; Y126-M130 HydrophobicContact CE1-SD 3.23Å; Y126-M130 WeakPolarHBondContact CE1-SD 3.24Å; Y126-M130 HydrophobicContact CE2-CG 4.36Å; Y126-M130 HydrophobicContact CE2-SD 4.39Å; Y126-M130 VanDerWaalsContact O-CG 3.26Å; Y126-M130 WeakPolarHBondContact O-CG 3.27Å; Y126-M130 PolarHBondContact O-N 3.47Å; Y126-M130 VanDerWaalsContact OH-CE 3.24Å; Y126-M130 WeakPolarHBondContact OH-CE 3.23Å; Y126-M130 PolarHBondContact OH-SD 3.37Å
127	E	80.7	Confident	83.3	Confident	97 Å²	97	84.7 Å²	84.7	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-59.2	-41.3	177.8	-74.8	-179.5	-179.6	0	0	112.4	L123 E124 M130 R131	L123-E127 WeakPolarHBondContact O-CB 3.46Å; L123-E127 WeakPolarHBondContact O-CG 3.39Å; L123-E127 PolarHBondContact O-N 3.39Å; E124-E127 PolarHBondContact O-N 3.04Å; E127-M130 PolarHBondContact O-N 2.87Å; E127-R131 WeakPolarHBondContact O-CB 3.43Å; E127-R131 PolarHBondContact O-N 3.5Å
128	N	86.3	Confident	82.5	Confident	82 Å²	82	80.1 Å²	80.1	44%	0.439	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-41.2	176.7	-73.3	-31.3	0	0	0	111.9	E124 A125 Y126 R131 R132	E124-N128 VanDerWaalsContact O-CB 3.31Å; E124-N128 WeakPolarHBondContact O-CB 3.29Å; E124-N128 PolarHBondContact O-N 3.36Å; E124-N128 PolarHBondContact O-ND2 3.31Å; E124-N128 VanDerWaalsContact O-ND2 3.07Å; A125-N128 PolarHBondContact O-N 3.43Å; Y126-N128 VanDerWaalsContact C-N 3.32Å; Y126-N128 PolarHBondContact O-N 3.33Å; N128-R131 WeakPolarHBondContact O-CB 3.47Å; N128-R131 PolarHBondContact O-N 3.14Å; N128-R131 PolarHBondContact OD1-NH1 2.83Å; N128-R132 PolarHBondContact O-N 2.55Å
129	E	83.2	Confident	82.2	Confident	66 Å²	66	80.6 Å²	80.6	31%	0.308	39%	0.391	S	S	.	.	H	α-helix	trans	-65.5	-41.7	175.1	173.5	57.8	-164.4	0	0	111.6	A125 Y126 R131 R132 R133	A125-E129 WeakPolarHBondContact O-CB 3.43Å; A125-E129 PolarHBondContact O-N 3.35Å; Y126-E129 PolarHBondContact O-N 3.42Å; E129-R131 VanDerWaalsContact C-N 3.34Å; E129-R131 PolarHBondContact O-N 2.71Å; E129-R132 WeakPolarHBondContact O-CB 3.5Å; E129-R132 PolarHBondContact O-N 3.31Å; E129-R132 IonicContact OE1-CZ 2.9Å; E129-R132 IonicContact OE1-NE 2.85Å; E129-R132 IonicContact OE1-NH2 2.62Å; E129-R132 PolarHBondContact OE1-NH2 3Å; E129-R132 IonicContact OE2-CZ 2.77Å; E129-R132 IonicContact OE2-NE 3.42Å; E129-R132 PolarHBondContact OE2-NE 3.44Å; E129-R132 IonicContact OE2-NH2 2.78Å; E129-R132 PolarHBondContact OE2-NH2 2.86Å; E129-R133 WeakPolarHBondContact O-CG 3.38Å; E129-R133 PolarHBondContact O-N 3.47Å; E129-R133 IonicContact OE1-CZ 2.67Å; E129-R133 IonicContact OE1-NE 3.2Å; E129-R133 PolarHBondContact OE1-NE 3.26Å; E129-R133 IonicContact OE1-NH2 2.77Å; E129-R133 PolarHBondContact OE1-NH2 3.42Å
130	M	83	Confident	81.5	Confident	33 Å²	33	82.2 Å²	82.2	16%	0.163	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-41.6	174	-61.9	-150.7	102.1	0	0	111.9	Y111 P112 Y126 E127 R132 R133 W134	Y111-M130 VanDerWaalsContact CA-CE 3.49Å; Y111-M130 HydrophobicContact CD1-CE 3.31Å; Y111-M130 HydrophobicContact CD1-SD 3.69Å; Y111-M130 HydrophobicContact CE1-CE 4.24Å; Y111-M130 HydrophobicContact CE1-SD 4.39Å; Y111-M130 HydrophobicContact CG-CE 3.93Å; P112-M130 HydrophobicContact CG-CE 4.05Å; Y126-M130 HydrophobicContact CD1-CG 4.17Å; Y126-M130 HydrophobicContact CD1-SD 4.1Å; Y126-M130 HydrophobicContact CE1-CE 4.3Å; Y126-M130 HydrophobicContact CE1-CG 3.8Å; Y126-M130 HydrophobicContact CE1-SD 3.23Å; Y126-M130 WeakPolarHBondContact CE1-SD 3.24Å; Y126-M130 HydrophobicContact CE2-CG 4.36Å; Y126-M130 HydrophobicContact CE2-SD 4.39Å; Y126-M130 VanDerWaalsContact O-CG 3.26Å; Y126-M130 WeakPolarHBondContact O-CG 3.27Å; Y126-M130 PolarHBondContact O-N 3.47Å; Y126-M130 VanDerWaalsContact OH-CE 3.24Å; Y126-M130 WeakPolarHBondContact OH-CE 3.23Å; Y126-M130 PolarHBondContact OH-SD 3.37Å; E127-M130 PolarHBondContact O-N 2.87Å; M130-R132 VanDerWaalsContact C-N 3.34Å; M130-R132 PolarHBondContact O-N 3.29Å; M130-R133 PolarHBondContact O-N 3.43Å; M130-W134 WeakPolarHBondContact O-CB 3.44Å; M130-W134 PolarHBondContact O-N 3.28Å
131	R	75.7	Confident	80.7	Confident	100 Å²	100	78.2 Å²	78.2	38%	0.377	38%	0.376	S	S	.	.	H	α-helix	trans	-60.2	-44.5	175.8	-173.2	-173.7	-60.3	135.1	7.4	111.1	E127 N128 E129 W134 L135 F165	E127-R131 WeakPolarHBondContact O-CB 3.43Å; E127-R131 PolarHBondContact O-N 3.5Å; N128-R131 WeakPolarHBondContact O-CB 3.47Å; N128-R131 PolarHBondContact O-N 3.14Å; N128-R131 PolarHBondContact OD1-NH1 2.83Å; E129-R131 VanDerWaalsContact C-N 3.34Å; E129-R131 PolarHBondContact O-N 2.71Å; R131-W134 PolarHBondContact O-N 2.9Å; R131-L135 HydrophobicContact CG-CD1 4.27Å; R131-L135 WeakPolarHBondContact O-CG 3.26Å; R131-L135 PolarHBondContact O-N 2.74Å; R131-F165 HydrophobicContact CB-CE2 4.33Å; R131-F165 HydrophobicContact CG-CD2 4.42Å; R131-F165 HydrophobicContact CG-CE2 3.91Å
132	R	82.3	Confident	79.7	Confident	105 Å²	105	75.1 Å²	75.1	40%	0.396	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-50.9	176.1	-172.9	-169.2	67.1	76.7	2.9	111.1	N128 E129 M130 W134 L135 E136	N128-R132 PolarHBondContact O-N 2.55Å; E129-R132 WeakPolarHBondContact O-CB 3.5Å; E129-R132 PolarHBondContact O-N 3.31Å; E129-R132 IonicContact OE1-CZ 2.9Å; E129-R132 IonicContact OE1-NE 2.85Å; E129-R132 IonicContact OE1-NH2 2.62Å; E129-R132 PolarHBondContact OE1-NH2 3Å; E129-R132 IonicContact OE2-CZ 2.77Å; E129-R132 IonicContact OE2-NE 3.42Å; E129-R132 PolarHBondContact OE2-NE 3.44Å; E129-R132 IonicContact OE2-NH2 2.78Å; E129-R132 PolarHBondContact OE2-NH2 2.86Å; M130-R132 VanDerWaalsContact C-N 3.34Å; M130-R132 PolarHBondContact O-N 3.29Å; R132-W134 VanDerWaalsContact C-N 3.3Å; R132-W134 PolarHBondContact O-N 2.62Å; R132-L135 PolarHBondContact O-N 3.23Å; R132-E136 IonicContact CZ-OE1 3.9Å; R132-E136 IonicContact CZ-OE2 3.92Å; R132-E136 IonicContact NH1-OE1 3.89Å; R132-E136 PolarHBondContact NH1-OE1 3.34Å; R132-E136 IonicContact NH1-OE2 2.58Å; R132-E136 PolarHBondContact NH1-OE2 3.49Å; R132-E136 WeakPolarHBondContact O-CG 3.42Å; R132-E136 PolarHBondContact O-N 3.02Å
133	R	80.9	Confident	79.1	Confident	131 Å²	131	81.2 Å²	81.2	49%	0.494	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-40.8	177.2	-70.2	-177.9	-178.1	-154.8	-1	112.1	M109 E129 M130 E136 K137	M109-R133 HydrophobicContact CE-CB 3.78Å; M109-R133 WeakPolarHBondContact CE-O 3.49Å; E129-R133 WeakPolarHBondContact O-CG 3.38Å; E129-R133 PolarHBondContact O-N 3.47Å; E129-R133 IonicContact OE1-CZ 2.67Å; E129-R133 IonicContact OE1-NE 3.2Å; E129-R133 PolarHBondContact OE1-NE 3.26Å; E129-R133 IonicContact OE1-NH2 2.77Å; E129-R133 PolarHBondContact OE1-NH2 3.42Å; M130-R133 PolarHBondContact O-N 3.43Å; R133-E136 PolarHBondContact O-N 2.94Å; R133-K137 PolarHBondContact O-N 3.28Å
134	W	77.4	Confident	78.5	Confident	49 Å²	49	80.5 Å²	80.5	19%	0.186	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-48.3	177.8	-177.8	83.8	0	0	0	111.6	M130 R131 R132 E136 K137 M138 F165	M130-W134 WeakPolarHBondContact O-CB 3.44Å; M130-W134 PolarHBondContact O-N 3.28Å; R131-W134 PolarHBondContact O-N 2.9Å; R132-W134 VanDerWaalsContact C-N 3.3Å; R132-W134 PolarHBondContact O-N 2.62Å; W134-E136 VanDerWaalsContact C-N 3.32Å; W134-E136 PolarHBondContact O-N 2.85Å; W134-K137 PolarHBondContact O-N 2.98Å; W134-M138 HydrophobicContact CD2-CG 3.84Å; W134-M138 HydrophobicContact CE3-CG 4.07Å; W134-M138 HydrophobicContact CH2-CE 4.44Å; W134-M138 HydrophobicContact CH2-CG 3.84Å; W134-M138 HydrophobicContact CZ2-CE 4.32Å; W134-M138 HydrophobicContact CZ2-CG 3.59Å; W134-M138 HydrophobicContact CZ2-SD 3.95Å; W134-M138 HydrophobicContact CZ3-CG 4.07Å; W134-M138 WeakPolarHBondContact O-CB 3.42Å; W134-M138 WeakPolarHBondContact O-CG 3.05Å; W134-M138 PolarHBondContact O-N 2.86Å; W134-F165 HydrophobicContact CE3-CD2 4.46Å
135	L	78.1	Confident	77.7	Confident	80 Å²	80	77.2 Å²	77.2	42%	0.419	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-40.7	177.3	-72.6	170.9	0	0	0	112.1	R131 R132 M138 T139	R131-L135 HydrophobicContact CG-CD1 4.27Å; R131-L135 WeakPolarHBondContact O-CG 3.26Å; R131-L135 PolarHBondContact O-N 2.74Å; R132-L135 PolarHBondContact O-N 3.23Å; L135-M138 PolarHBondContact O-N 3.46Å; L135-T139 WeakPolarHBondContact O-CB 3.38Å; L135-T139 PolarHBondContact O-N 2.86Å; L135-T139 PolarHBondContact O-OG1 3.4Å
136	E	79	Confident	76.8	Confident	88 Å²	88	75.1 Å²	75.1	41%	0.411	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-46.2	176	-77.4	173.8	-179.7	0	0	111.9	R132 R133 W134 T139 Q140	R132-E136 IonicContact CZ-OE1 3.9Å; R132-E136 IonicContact CZ-OE2 3.92Å; R132-E136 IonicContact NH1-OE1 3.89Å; R132-E136 PolarHBondContact NH1-OE1 3.34Å; R132-E136 IonicContact NH1-OE2 2.58Å; R132-E136 PolarHBondContact NH1-OE2 3.49Å; R132-E136 WeakPolarHBondContact O-CG 3.42Å; R132-E136 PolarHBondContact O-N 3.02Å; R133-E136 PolarHBondContact O-N 2.94Å; W134-E136 VanDerWaalsContact C-N 3.32Å; W134-E136 PolarHBondContact O-N 2.85Å; E136-T139 WeakPolarHBondContact O-CB 3.35Å; E136-T139 PolarHBondContact O-N 3.3Å; E136-Q140 WeakPolarHBondContact O-CG 3.31Å; E136-Q140 PolarHBondContact O-N 3.43Å
137	K	75.6	Confident	75.7	Confident	71 Å²	71	79.3 Å²	79.3	31%	0.309	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-38.6	178.8	-161.7	173.8	-175.6	-179.6	0	112	M109 R133 W134 T139 Q140 W141	M109-K137 HydrophobicContact CE-CB 3.69Å; M109-K137 HydrophobicContact CE-CD 3.66Å; M109-K137 HydrophobicContact CE-CG 4.32Å; M109-K137 HydrophobicContact CG-CD 3.82Å; M109-K137 HydrophobicContact SD-CD 3.82Å; R133-K137 PolarHBondContact O-N 3.28Å; W134-K137 PolarHBondContact O-N 2.98Å; K137-T139 VanDerWaalsContact C-N 3.3Å; K137-T139 PolarHBondContact O-N 2.9Å; K137-Q140 PolarHBondContact O-N 3Å; K137-W141 WeakPolarHBondContact O-CB 3.48Å; K137-W141 PolarHBondContact O-N 3Å
138	M	71.3	Confident	75	Confident	44 Å²	44	80.2 Å²	80.2	22%	0.217	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-39.9	172.1	-77.3	-62.5	-65.8	0	0	111.6	W134 L135 W141 A142	W134-M138 HydrophobicContact CD2-CG 3.84Å; W134-M138 HydrophobicContact CE3-CG 4.07Å; W134-M138 HydrophobicContact CH2-CE 4.44Å; W134-M138 HydrophobicContact CH2-CG 3.84Å; W134-M138 HydrophobicContact CZ2-CE 4.32Å; W134-M138 HydrophobicContact CZ2-CG 3.59Å; W134-M138 HydrophobicContact CZ2-SD 3.95Å; W134-M138 HydrophobicContact CZ3-CG 4.07Å; W134-M138 WeakPolarHBondContact O-CB 3.42Å; W134-M138 WeakPolarHBondContact O-CG 3.05Å; W134-M138 PolarHBondContact O-N 2.86Å; L135-M138 PolarHBondContact O-N 3.46Å; M138-W141 HydrophobicContact CE-CE3 4.42Å; M138-W141 PolarHBondContact O-N 2.65Å; M138-A142 VanDerWaalsContact O-CB 3.31Å; M138-A142 WeakPolarHBondContact O-CB 3.45Å; M138-A142 PolarHBondContact O-N 3.32Å
139	T	74.5	Confident	74	Confident	72 Å²	72	78.3 Å²	78.3	44%	0.442	37%	0.366	S	S	.	.	H	α-helix	trans	-66.7	-43	176.3	-57.3	0	0	0	0	111.3	L135 E136 K137 W141 A142 K143	L135-T139 WeakPolarHBondContact O-CB 3.38Å; L135-T139 PolarHBondContact O-N 2.86Å; L135-T139 PolarHBondContact O-OG1 3.4Å; E136-T139 WeakPolarHBondContact O-CB 3.35Å; E136-T139 PolarHBondContact O-N 3.3Å; K137-T139 VanDerWaalsContact C-N 3.3Å; K137-T139 PolarHBondContact O-N 2.9Å; T139-W141 VanDerWaalsContact C-N 3.35Å; T139-A142 PolarHBondContact O-N 3.45Å; T139-K143 HydrophobicContact CG2-CD 4.48Å; T139-K143 WeakPolarHBondContact O-CB 3.46Å; T139-K143 VanDerWaalsContact O-CG 3.31Å; T139-K143 WeakPolarHBondContact O-CG 3.36Å; T139-K143 PolarHBondContact O-N 3.39Å
140	Q	75.4	Confident	73.2	Confident	130 Å²	130	80.9 Å²	80.9	61%	0.607	38%	0.381	S	S	*	.	H	α-helix	trans	-60.9	-44.9	173.9	-72.1	172.3	16.8	0	0	111.3	E136 K137 K143 A144	E136-Q140 WeakPolarHBondContact O-CG 3.31Å; E136-Q140 PolarHBondContact O-N 3.43Å; K137-Q140 PolarHBondContact O-N 3Å; Q140-K143 PolarHBondContact O-N 3.33Å; Q140-A144 WeakPolarHBondContact O-CB 3.33Å; Q140-A144 PolarHBondContact O-N 3.38Å
141	W	69.6	Low	72.6	Confident	93 Å²	93	86.9 Å²	86.9	35%	0.352	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-48.7	176.1	175.9	77.1	0	0	0	111.4	F107 K137 M138 T139 K143 A144 Q145	F107-W141 HydrophobicContact CE1-CB 4.35Å; F107-W141 AromaticContact CE1-CD1 3.85Å; F107-W141 HydrophobicContact CE1-CD2 4.5Å; F107-W141 AromaticContact CE1-CG 3.95Å; F107-W141 HydrophobicContact CE1-CG 3.95Å; F107-W141 AromaticContact CZ-CD1 3.44Å; F107-W141 VanDerWaalsContact CZ-CD1 3.44Å; F107-W141 HydrophobicContact CZ-CD2 4.15Å; F107-W141 AromaticContact CZ-CE2 3.9Å; F107-W141 AromaticContact CZ-CG 3.86Å; F107-W141 HydrophobicContact CZ-CG 3.86Å; F107-W141 AromaticContact CZ-NE1 3.46Å; K137-W141 WeakPolarHBondContact O-CB 3.48Å; K137-W141 PolarHBondContact O-N 3Å; M138-W141 HydrophobicContact CE-CE3 4.42Å; M138-W141 PolarHBondContact O-N 2.65Å; T139-W141 VanDerWaalsContact C-N 3.35Å; W141-K143 VanDerWaalsContact C-N 3.27Å; W141-K143 PolarHBondContact O-N 3.15Å; W141-A144 CarbonylContact O-C 3.13Å; W141-A144 PolarHBondContact O-N 3.12Å; W141-A144 VanDerWaalsContact O-N 3.09Å; W141-Q145 HydrophobicContact CH2-CG 4.16Å; W141-Q145 VanDerWaalsContact CH2-OE1 3.3Å; W141-Q145 HydrophobicContact CZ2-CB 4.36Å; W141-Q145 HydrophobicContact CZ2-CG 3.68Å; W141-Q145 WeakPolarHBondContact O-CB 3.48Å; W141-Q145 PolarHBondContact O-N 3.41Å
142	A	70.8	Confident	72.6	Confident	38 Å²	38	89 Å²	89	31%	0.314	42%	0.417	S	S	.	.	H	α-helix	trans	-60.2	-38.1	178.3	0	0	0	0	0	111.8	M138 T139 G146	M138-A142 VanDerWaalsContact O-CB 3.31Å; M138-A142 WeakPolarHBondContact O-CB 3.45Å; M138-A142 PolarHBondContact O-N 3.32Å; T139-A142 PolarHBondContact O-N 3.45Å; A142-G146 PolarHBondContact O-N 2.86Å
143	K	73.6	Confident	72	Confident	142 Å²	142	87.4 Å²	87.4	62%	0.617	43%	0.433	S	S	*	.	H	α-helix	trans	-62.7	-47.8	172.1	-75.8	176.3	179.3	-177.9	0	111.7	T139 Q140 W141 G146 Q147	T139-K143 HydrophobicContact CG2-CD 4.48Å; T139-K143 WeakPolarHBondContact O-CB 3.46Å; T139-K143 VanDerWaalsContact O-CG 3.31Å; T139-K143 WeakPolarHBondContact O-CG 3.36Å; T139-K143 PolarHBondContact O-N 3.39Å; Q140-K143 PolarHBondContact O-N 3.33Å; W141-K143 VanDerWaalsContact C-N 3.27Å; W141-K143 PolarHBondContact O-N 3.15Å; K143-G146 PolarHBondContact O-N 2.92Å; K143-Q147 WeakPolarHBondContact O-CB 3.48Å; K143-Q147 WeakPolarHBondContact O-CG 3.37Å; K143-Q147 PolarHBondContact O-N 3.2Å
144	A	72.9	Confident	71	Confident	53 Å²	53	88.2 Å²	88.2	44%	0.438	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-41.9	177.5	0	0	0	0	0	112	Q140 W141 Q147 Y148	Q140-A144 WeakPolarHBondContact O-CB 3.33Å; Q140-A144 PolarHBondContact O-N 3.38Å; W141-A144 CarbonylContact O-C 3.13Å; W141-A144 PolarHBondContact O-N 3.12Å; W141-A144 VanDerWaalsContact O-N 3.09Å; A144-Q147 PolarHBondContact O-N 2.91Å; A144-Y148 VanDerWaalsContact O-CB 3.32Å; A144-Y148 WeakPolarHBondContact O-CB 3.43Å; A144-Y148 PolarHBondContact O-N 3.29Å
145	Q	68.2	Low	69.9	Low	46 Å²	46	90 Å²	90	22%	0.215	46%	0.461	C	S	.	.	H	α-helix	trans	-67.1	-40.8	177.8	-130.8	-112.9	-90.9	0	0	111.2	W141 Y148 E149	W141-Q145 HydrophobicContact CH2-CG 4.16Å; W141-Q145 VanDerWaalsContact CH2-OE1 3.3Å; W141-Q145 HydrophobicContact CZ2-CB 4.36Å; W141-Q145 HydrophobicContact CZ2-CG 3.68Å; W141-Q145 WeakPolarHBondContact O-CB 3.48Å; W141-Q145 PolarHBondContact O-N 3.41Å; Q145-Y148 WeakPolarHBondContact O-CB 3.36Å; Q145-Y148 PolarHBondContact O-N 3.44Å; Q145-E149 PolarHBondContact NE2-OE1 3.4Å; Q145-E149 WeakPolarHBondContact O-CG 3.41Å; Q145-E149 PolarHBondContact O-N 3.34Å
146	G	68.6	Low	68.6	Low	15 Å²	15	89.2 Å²	89.2	16%	0.155	46%	0.456	C	S	.	.	H	α-helix	trans	-65.7	-43.1	174.5	0	0	0	0	0	112.8	A142 K143 Y148 E149 L150	A142-G146 PolarHBondContact O-N 2.86Å; K143-G146 PolarHBondContact O-N 2.92Å; G146-Y148 VanDerWaalsContact C-N 3.32Å; G146-Y148 PolarHBondContact O-N 3.38Å; G146-E149 PolarHBondContact O-N 2.89Å; G146-L150 WeakPolarHBondContact O-CB 3.38Å; G146-L150 VanDerWaalsContact O-CG 3.29Å; G146-L150 WeakPolarHBondContact O-CG 3.47Å; G146-L150 PolarHBondContact O-N 3.2Å
147	Q	63.5	Low	67.4	Low	131 Å²	131	93.5 Å²	93.5	61%	0.612	47%	0.473	S	S	*	.	H	α-helix	trans	-58.8	-44.8	172.4	-76.3	179.5	-51.3	0	0	111.2	K143 A144 E149 L150 E151	K143-Q147 WeakPolarHBondContact O-CB 3.48Å; K143-Q147 WeakPolarHBondContact O-CG 3.37Å; K143-Q147 PolarHBondContact O-N 3.2Å; A144-Q147 PolarHBondContact O-N 2.91Å; Q147-E149 PolarHBondContact O-N 2.88Å; Q147-L150 PolarHBondContact O-N 3.39Å; Q147-E151 WeakPolarHBondContact O-CG 3.31Å; Q147-E151 PolarHBondContact O-N 2.99Å
148	Y	65.9	Low	66.1	Low	115 Å²	115	95.2 Å²	95.2	45%	0.451	49%	0.492	S	S	.	.	H	α-helix	trans	-63	-37.8	176.4	-176	-99.9	0	0	0	113.6	A144 Q145 G146 R152	A144-Y148 VanDerWaalsContact O-CB 3.32Å; A144-Y148 WeakPolarHBondContact O-CB 3.43Å; A144-Y148 PolarHBondContact O-N 3.29Å; Q145-Y148 WeakPolarHBondContact O-CB 3.36Å; Q145-Y148 PolarHBondContact O-N 3.44Å; G146-Y148 VanDerWaalsContact C-N 3.32Å; G146-Y148 PolarHBondContact O-N 3.38Å; Y148-R152 PolarHBondContact OH-NH2 2.95Å
149	E	63.6	Low	65.4	Low	42 Å²	42	97.5 Å²	97.5	20%	0.196	50%	0.504	C	S	.	.	H	α-helix	trans	-73.3	-35.8	176.4	-72.7	-165.5	-179.5	0	0	112.6	Q145 G146 Q147 R152 G153 R154 M156	Q145-E149 PolarHBondContact NE2-OE1 3.4Å; Q145-E149 WeakPolarHBondContact O-CG 3.41Å; Q145-E149 PolarHBondContact O-N 3.34Å; G146-E149 PolarHBondContact O-N 2.89Å; Q147-E149 PolarHBondContact O-N 2.88Å; E149-R152 CarbonylContact O-C 3.58Å; E149-R152 WeakPolarHBondContact O-CA 3.38Å; E149-R152 PolarHBondContact O-N 2.87Å; E149-R152 VanDerWaalsContact O-N 3.08Å; E149-G153 PolarHBondContact O-N 2.99Å; E149-R154 CarbonylContact C-O 3.39Å; E149-R154 WeakPolarHBondContact CB-O 3.18Å; E149-R154 PolarHBondContact O-N 2.98Å; E149-M156 WeakPolarHBondContact OE2-CA 3.27Å; E149-M156 WeakPolarHBondContact OE2-CB 3.41Å
150	L	67.9	Low	63.9	Low	120 Å²	120	100.1 Å²	100.1	63%	0.628	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-40.9	173.7	-74.5	170.5	0	0	0	112	G146 Q147 R152 G153	G146-L150 WeakPolarHBondContact O-CB 3.38Å; G146-L150 VanDerWaalsContact O-CG 3.29Å; G146-L150 WeakPolarHBondContact O-CG 3.47Å; G146-L150 PolarHBondContact O-N 3.2Å; Q147-L150 PolarHBondContact O-N 3.39Å; L150-R152 PolarHBondContact O-N 3.05Å; L150-G153 PolarHBondContact O-N 2.79Å
151	E	69.9	Low	62.6	Low	160 Å²	160	97.2 Å²	97.2	75%	0.748	53%	0.525	S	S	*	.	H	α-helix	trans	-58	-28.5	172.6	-75.1	178	178.9	0	0	112.7	Q147	Q147-E151 WeakPolarHBondContact O-CG 3.31Å; Q147-E151 PolarHBondContact O-N 2.99Å
152	R	75.1	Confident	61.4	Low	145 Å²	145	98.1 Å²	98.1	55%	0.547	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.8	175.2	-69.5	-172.6	177	-169.3	-2.7	114	Y148 E149 L150 R154	Y148-R152 PolarHBondContact OH-NH2 2.95Å; E149-R152 CarbonylContact O-C 3.58Å; E149-R152 WeakPolarHBondContact O-CA 3.38Å; E149-R152 PolarHBondContact O-N 2.87Å; E149-R152 VanDerWaalsContact O-N 3.08Å; L150-R152 PolarHBondContact O-N 3.05Å; R152-R154 VanDerWaalsContact C-N 3.29Å; R152-R154 PolarHBondContact O-N 2.87Å
153	G	69.7	Low	60.1	Low	71 Å²	71	103.3 Å²	103.3	73%	0.732	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.2	21.8	-179.8	0	0	0	0	0	114.5	E149 L150	E149-G153 PolarHBondContact O-N 2.99Å; L150-G153 PolarHBondContact O-N 2.79Å
154	R	60.4	Low	58.6	Low	147 Å²	147	104.8 Å²	104.8	56%	0.555	56%	0.562	S	S	*	*			trans	-111.7	126.3	174	-68.2	-165.8	-68.2	-128.6	6	109.9	E149 R152 M156	E149-R154 CarbonylContact C-O 3.39Å; E149-R154 WeakPolarHBondContact CB-O 3.18Å; E149-R154 PolarHBondContact O-N 2.98Å; R152-R154 VanDerWaalsContact C-N 3.29Å; R152-R154 PolarHBondContact O-N 2.87Å; R154-M156 PolarHBondContact O-N 3.5Å
155	A	53.8	Low	57.3	Low	86 Å²	86	106 Å²	106	71%	0.711	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-78.6	119.4	172.4	0	0	0	0	0	109.5	K157	A155-K157 PolarHBondContact O-N 2.99Å
156	M	50.3	Low	56.2	Low	65 Å²	65	109.4 Å²	109.4	32%	0.32	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-65.4	122.2	171.8	-175.4	118.8	-169.2	0	0	109.1	E149 R154 I159	E149-M156 WeakPolarHBondContact OE2-CA 3.27Å; E149-M156 WeakPolarHBondContact OE2-CB 3.41Å; R154-M156 PolarHBondContact O-N 3.5Å; M156-I159 HydrophobicContact CE-CD1 4.05Å; M156-I159 HydrophobicContact CE-CG1 4.33Å
157	K	54.1	Low	54.9	Low	178 Å²	178	115.7 Å²	115.7	77%	0.774	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-72.4	131.6	167.7	-65.6	-178.4	-178.3	179.7	0	108	A155 I159	A155-K157 PolarHBondContact O-N 2.99Å; K157-I159 PolarHBondContact O-N 3.31Å
158	P	49.3	Very low	53.8	Low	107 Å²	107	111.2 Å²	111.2	70%	0.695	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-58.1	127.4	172	25.6	-32.8	0	0	0	108.3	T160	P158-T160 VanDerWaalsContact C-N 3.27Å; P158-T160 PolarHBondContact O-N 3.48Å
159	I	56.5	Low	52.6	Low	91 Å²	91	113.9 Å²	113.9	47%	0.467	61%	0.609	S	S	.	*			trans	-71.4	89.5	175	-59.6	170.6	0	0	0	106.8	M156 K157 G161 V162	M156-I159 HydrophobicContact CE-CD1 4.05Å; M156-I159 HydrophobicContact CE-CG1 4.33Å; K157-I159 PolarHBondContact O-N 3.31Å; I159-G161 PolarHBondContact O-N 3.14Å; I159-V162 HydrophobicContact CG2-CB 3.86Å; I159-V162 HydrophobicContact CG2-CG2 3.58Å
160	T	43.7	Very low	51.7	Low	128 Å²	128	116.5 Å²	116.5	79%	0.785	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	105.7	173.8	52.1	0	0	0	0	108.3	P158	P158-T160 VanDerWaalsContact C-N 3.27Å; P158-T160 PolarHBondContact O-N 3.48Å
161	G	48.3	Very low	50.2	Low	69 Å²	69	113.4 Å²	113.4	71%	0.711	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	125.2	-1.8	165	0	0	0	0	0	118.1	I159	I159-G161 PolarHBondContact O-N 3.14Å
162	V	43.5	Very low	48.9	Very low	111 Å²	111	116.1 Å²	116.1	67%	0.673	63%	0.63	S	S	*	*			trans	-107.5	9.7	-175.9	-165.5	0	0	0	0	113.4	I159 Q164	I159-V162 HydrophobicContact CG2-CB 3.86Å; I159-V162 HydrophobicContact CG2-CG2 3.58Å; V162-Q164 PolarHBondContact O-N 3.36Å
163	Y	44.1	Very low	47	Very low	147 Å²	147	114.9 Å²	114.9	58%	0.576	64%	0.638	S	S	*	*			trans	-79.8	42.8	170.5	-62.6	-76.2	0	0	0	112.2	F165	Y163-F165 PolarHBondContact O-N 3.45Å
164	Q	42.1	Very low	45.9	Very low	173 Å²	173	117.5 Å²	117.5	81%	0.808	63%	0.631	S	S	*	*	S	Bend	trans	-80.7	104.5	155.9	-100.1	173.6	-48.8	0	0	106	V162 V166	V162-Q164 PolarHBondContact O-N 3.36Å; Q164-V166 PolarHBondContact O-N 3.38Å
165	F	45.9	Very low	45.1	Very low	80 Å²	80	116.1 Å²	116.1	35%	0.351	64%	0.639	S	S	.	*			trans	-36.8	101.1	174.2	-169.3	-99.2	0	0	0	110.4	R131 W134 Y163 H167	R131-F165 HydrophobicContact CB-CE2 4.33Å; R131-F165 HydrophobicContact CG-CD2 4.42Å; R131-F165 HydrophobicContact CG-CE2 3.91Å; W134-F165 HydrophobicContact CE3-CD2 4.46Å; Y163-F165 PolarHBondContact O-N 3.45Å; F165-H167 PolarHBondContact O-N 3.28Å
166	V	44.6	Very low	44.7	Very low	117 Å²	117	116.4 Å²	116.4	71%	0.709	63%	0.629	S	S	*	*			trans	-61.9	109.8	164.5	-177.8	0	0	0	0	103.6	Q164 P168	Q164-V166 PolarHBondContact O-N 3.38Å; V166-P168 VanDerWaalsContact O-N 3.17Å
167	H	41.4	Very low	44.5	Very low	147 Å²	147	115.2 Å²	115.2	68%	0.681	63%	0.627	S	S	*	*			trans	-51	129.1	176.3	-13	-74	0	0	0	106.3	F165 I169	F165-H167 PolarHBondContact O-N 3.28Å; H167-I169 PolarHBondContact O-N 2.99Å; H167-I169 VanDerWaalsContact O-N 3.12Å
168	P	39.8	Very low	44.6	Very low	37 Å²	37	113.6 Å²	113.6	24%	0.24	62%	0.62	C	S	.	*			trans	-51.4	130.1	166.1	20.9	-28.1	0	0	0	105.6	Y111 V166 T170	Y111-P168 HydrophobicContact CE1-CB 4.16Å; Y111-P168 HydrophobicContact CE1-CG 4.31Å; Y111-P168 HydrophobicContact CE2-CB 4.48Å; V166-P168 VanDerWaalsContact O-N 3.17Å; P168-T170 HydrophobicContact CB-CG2 4.31Å; P168-T170 HydrophobicContact CG-CG2 4.17Å; P168-T170 PolarHBondContact O-N 3.23Å
169	I	40.5	Very low	45.1	Very low	170 Å²	170	113.8 Å²	113.8	87%	0.872	62%	0.615	S	S	*	*			trans	-66.3	75.9	166.9	-55.6	173.2	0	0	0	104.7	H167 G171	H167-I169 PolarHBondContact O-N 2.99Å; H167-I169 VanDerWaalsContact O-N 3.12Å; I169-G171 PolarHBondContact O-N 2.85Å; I169-G171 VanDerWaalsContact O-N 3.14Å
170	T	44.1	Very low	45.5	Very low	97 Å²	97	116.9 Å²	116.9	60%	0.595	63%	0.625	S	S	*	*			trans	-60.7	114.3	160.1	49.7	0	0	0	0	102.9	P168 Y172	P168-T170 HydrophobicContact CB-CG2 4.31Å; P168-T170 HydrophobicContact CG-CG2 4.17Å; P168-T170 PolarHBondContact O-N 3.23Å; T170-Y172 PolarHBondContact O-N 3.3Å
171	G	36.8	Very low	47.1	Very low	55 Å²	55	114.6 Å²	114.6	57%	0.567	61%	0.607	S	S	*	*	S	Bend	trans	-47.8	141	-174.3	0	0	0	0	0	110.6	I169	I169-G171 PolarHBondContact O-N 2.85Å; I169-G171 VanDerWaalsContact O-N 3.14Å
172	Y	42.9	Very low	48.4	Very low	218 Å²	218	116.9 Å²	116.9	86%	0.855	60%	0.601	S	S	*	*			trans	70.4	72.5	170.7	-73	-97.1	0	0	0	117.4	T170	T170-Y172 PolarHBondContact O-N 3.3Å
173	T	35.7	Very low	49.8	Very low	118 Å²	118	116 Å²	116	72%	0.724	60%	0.596	S	S	*	*	S	Bend	trans	-134.3	109	142.3	56.7	0	0	0	0	111.9	T175	T173-T175 PolarHBondContact O-N 3.3Å
174	H	45.6	Very low	51.6	Low	126 Å²	126	116.2 Å²	116.2	58%	0.583	60%	0.6	S	S	*	*	S	Bend	trans	73.5	-13.7	152.3	-98.5	-87.5	0	0	0	125.7	S177	H174-S177 WeakPolarHBondContact ND1-CB 3.43Å; H174-S177 PolarHBondContact O-N 3.38Å
175	T	44.8	Very low	53.6	Low	119 Å²	119	112.3 Å²	112.3	73%	0.73	58%	0.584	S	S	*	*	H	α-helix	trans	-74.3	-38	174.6	56.9	0	0	0	0	112.8	T173 S177 F178	T173-T175 PolarHBondContact O-N 3.3Å; T175-S177 VanDerWaalsContact C-N 3.33Å; T175-F178 PolarHBondContact O-N 3.03Å
176	N	44.6	Very low	55.3	Low	92 Å²	92	111 Å²	111	49%	0.492	59%	0.588	S	S	.	*	H	α-helix	trans	-74.3	-22.2	172.3	-82.6	-25.1	0	0	0	113.2	F178 L179 F180	N176-F178 PolarHBondContact O-N 2.83Å; N176-L179 PolarHBondContact O-N 3.48Å; N176-L179 VanDerWaalsContact O-N 3.14Å; N176-F180 WeakPolarHBondContact O-CD2 3.47Å; N176-F180 PolarHBondContact O-N 3.49Å
177	S	45.8	Very low	56.9	Low	39 Å²	39	107.2 Å²	107.2	27%	0.273	57%	0.573	S	S	.	*	H	α-helix	trans	-62.3	-32.9	172.3	-60.7	0	0	0	0	111.3	H174 T175 F180 I181	H174-S177 WeakPolarHBondContact ND1-CB 3.43Å; H174-S177 PolarHBondContact O-N 3.38Å; T175-S177 VanDerWaalsContact C-N 3.33Å; S177-F180 PolarHBondContact O-N 3.42Å; S177-I181 WeakPolarHBondContact O-CB 3.45Å; S177-I181 WeakPolarHBondContact O-CD1 3.39Å; S177-I181 WeakPolarHBondContact O-CG1 3.48Å; S177-I181 PolarHBondContact O-N 2.77Å
178	F	56.3	Low	58.9	Low	145 Å²	145	103.2 Å²	103.2	64%	0.636	56%	0.559	S	S	*	*	H	α-helix	trans	-62.1	-44	172.9	-107.6	-84.5	0	0	0	111.7	T175 N176 F180 I181 M182	T175-F178 PolarHBondContact O-N 3.03Å; N176-F178 PolarHBondContact O-N 2.83Å; F178-F180 PolarHBondContact O-N 2.95Å; F178-I181 PolarHBondContact O-N 3.07Å; F178-M182 VanDerWaalsContact O-CB 3.32Å; F178-M182 WeakPolarHBondContact O-CB 3.48Å; F178-M182 WeakPolarHBondContact O-CG 3.32Å; F178-M182 PolarHBondContact O-N 2.97Å
179	L	59.4	Low	60.9	Low	111 Å²	111	106 Å²	106	58%	0.581	58%	0.575	S	S	*	*	H	α-helix	trans	-65.4	-38.1	175.9	-68.6	173.7	0	0	0	112	N176 T183	N176-L179 PolarHBondContact O-N 3.48Å; N176-L179 VanDerWaalsContact O-N 3.14Å; L179-T183 WeakPolarHBondContact O-CB 3.45Å; L179-T183 VanDerWaalsContact O-CG2 3.27Å; L179-T183 WeakPolarHBondContact O-CG2 3.44Å; L179-T183 PolarHBondContact O-N 3.33Å; L179-T183 PolarHBondContact O-OG1 3.39Å
180	F	64.9	Low	62.8	Low	155 Å²	155	104 Å²	104	68%	0.68	57%	0.565	S	S	*	*	H	α-helix	trans	-67.2	-41.4	173.8	-87.1	-76.1	0	0	0	113	N176 S177 F178 T183 F184	N176-F180 WeakPolarHBondContact O-CD2 3.47Å; N176-F180 PolarHBondContact O-N 3.49Å; S177-F180 PolarHBondContact O-N 3.42Å; F178-F180 PolarHBondContact O-N 2.95Å; F180-T183 WeakPolarHBondContact CA-OG1 3.34Å; F180-T183 PolarHBondContact O-OG1 2.86Å; F180-F184 WeakPolarHBondContact O-CB 3.32Å; F180-F184 PolarHBondContact O-N 3.34Å
181	I	77.4	Confident	64.4	Low	81 Å²	81	103 Å²	103	42%	0.415	56%	0.561	S	S	.	*	H	α-helix	trans	-68.2	-42.2	177.4	-67.3	162.8	0	0	0	110	S177 F178 T183 F184 L185	S177-I181 WeakPolarHBondContact O-CB 3.45Å; S177-I181 WeakPolarHBondContact O-CD1 3.39Å; S177-I181 WeakPolarHBondContact O-CG1 3.48Å; S177-I181 PolarHBondContact O-N 2.77Å; F178-I181 PolarHBondContact O-N 3.07Å; I181-T183 PolarHBondContact O-N 3.04Å; I181-F184 PolarHBondContact O-N 3.49Å; I181-L185 HydrophobicContact CG2-CD1 3.7Å; I181-L185 HydrophobicContact CG2-CG 4.05Å; I181-L185 WeakPolarHBondContact O-CB 3.41Å; I181-L185 VanDerWaalsContact O-CG 3.27Å; I181-L185 WeakPolarHBondContact O-CG 3.31Å; I181-L185 PolarHBondContact O-N 3.43Å
182	M	75.5	Confident	66.4	Low	116 Å²	116	104.6 Å²	104.6	57%	0.571	56%	0.56	S	S	*	*	H	α-helix	trans	-65.7	-40.4	178.3	-69.3	-60.6	-76.8	0	0	111.9	F178 A186	F178-M182 VanDerWaalsContact O-CB 3.32Å; F178-M182 WeakPolarHBondContact O-CB 3.48Å; F178-M182 WeakPolarHBondContact O-CG 3.32Å; F178-M182 PolarHBondContact O-N 2.97Å; M182-A186 VanDerWaalsContact O-CB 3.25Å; M182-A186 WeakPolarHBondContact O-CB 3.27Å; M182-A186 PolarHBondContact O-N 2.9Å
183	T	73.4	Confident	67.7	Low	93 Å²	93	102.3 Å²	102.3	57%	0.571	55%	0.554	S	S	*	*	H	α-helix	trans	-68.9	-36	174.1	51.8	0	0	0	0	112.2	L179 F180 I181 G187	L179-T183 WeakPolarHBondContact O-CB 3.45Å; L179-T183 VanDerWaalsContact O-CG2 3.27Å; L179-T183 WeakPolarHBondContact O-CG2 3.44Å; L179-T183 PolarHBondContact O-N 3.33Å; L179-T183 PolarHBondContact O-OG1 3.39Å; F180-T183 WeakPolarHBondContact CA-OG1 3.34Å; F180-T183 PolarHBondContact O-OG1 2.86Å; I181-T183 PolarHBondContact O-N 3.04Å; T183-G187 PolarHBondContact O-N 3.03Å
184	F	82.3	Confident	69.4	Low	152 Å²	152	101.3 Å²	101.3	67%	0.667	55%	0.552	S	S	*	*	H	α-helix	trans	-68.4	-47	175.5	-170.6	-96.3	0	0	0	112.3	F180 I181 A186 G187 V188	F180-F184 WeakPolarHBondContact O-CB 3.32Å; F180-F184 PolarHBondContact O-N 3.34Å; I181-F184 PolarHBondContact O-N 3.49Å; F184-A186 PolarHBondContact O-N 3.08Å; F184-G187 CarbonylContact O-C 3.59Å; F184-G187 WeakPolarHBondContact O-CA 3.33Å; F184-G187 PolarHBondContact O-N 3.39Å; F184-G187 VanDerWaalsContact O-N 3.09Å; F184-V188 HydrophobicContact CD1-CG2 4.07Å; F184-V188 HydrophobicContact CE1-CG2 3.78Å; F184-V188 HydrophobicContact CZ-CG2 4.28Å; F184-V188 WeakPolarHBondContact O-CG2 3.32Å; F184-V188 PolarHBondContact O-N 3.49Å
185	L	84.2	Confident	70.5	Confident	90 Å²	90	102.5 Å²	102.5	47%	0.471	56%	0.562	S	S	.	*	H	α-helix	trans	-63	-41.5	176.7	-71.7	176.2	0	0	0	111.5	I181 G187 V188 V189	I181-L185 HydrophobicContact CG2-CD1 3.7Å; I181-L185 HydrophobicContact CG2-CG 4.05Å; I181-L185 WeakPolarHBondContact O-CB 3.41Å; I181-L185 VanDerWaalsContact O-CG 3.27Å; I181-L185 WeakPolarHBondContact O-CG 3.31Å; I181-L185 PolarHBondContact O-N 3.43Å; L185-G187 VanDerWaalsContact C-N 3.27Å; L185-G187 PolarHBondContact O-N 3.09Å; L185-V188 PolarHBondContact O-N 2.98Å; L185-V189 WeakPolarHBondContact O-CG2 3.25Å; L185-V189 PolarHBondContact O-N 3.22Å
186	A	80.5	Confident	71	Confident	53 Å²	53	104.2 Å²	104.2	44%	0.438	58%	0.579	S	S	.	*	H	α-helix	trans	-59.4	-39.7	172.2	0	0	0	0	0	111.8	M182 F184 L190	M182-A186 VanDerWaalsContact O-CB 3.25Å; M182-A186 WeakPolarHBondContact O-CB 3.27Å; M182-A186 PolarHBondContact O-N 2.9Å; F184-A186 PolarHBondContact O-N 3.08Å; A186-L190 VanDerWaalsContact O-CG 3.32Å; A186-L190 WeakPolarHBondContact O-CG 3.43Å; A186-L190 PolarHBondContact O-N 2.78Å; A186-L190 VanDerWaalsContact O-N 3.08Å
187	G	78.4	Confident	72.3	Confident	38 Å²	38	104.9 Å²	104.9	39%	0.392	58%	0.583	S	S	.	*	H	α-helix	trans	-64.1	-41.4	174	0	0	0	0	0	113.8	T183 F184 L185 L190 C191	T183-G187 PolarHBondContact O-N 3.03Å; F184-G187 CarbonylContact O-C 3.59Å; F184-G187 WeakPolarHBondContact O-CA 3.33Å; F184-G187 PolarHBondContact O-N 3.39Å; F184-G187 VanDerWaalsContact O-N 3.09Å; L185-G187 VanDerWaalsContact C-N 3.27Å; L185-G187 PolarHBondContact O-N 3.09Å; G187-L190 PolarHBondContact O-N 2.93Å; G187-C191 WeakPolarHBondContact O-CB 3.34Å; G187-C191 PolarHBondContact O-N 2.83Å
188	V	83.3	Confident	73.7	Confident	63 Å²	63	108.3 Å²	108.3	38%	0.382	60%	0.6	S	S	.	*	H	α-helix	trans	-67.8	-43.5	177.6	174.4	0	0	0	0	111.2	F184 L185 L190 C191 V192	F184-V188 HydrophobicContact CD1-CG2 4.07Å; F184-V188 HydrophobicContact CE1-CG2 3.78Å; F184-V188 HydrophobicContact CZ-CG2 4.28Å; F184-V188 WeakPolarHBondContact O-CG2 3.32Å; F184-V188 PolarHBondContact O-N 3.49Å; L185-V188 PolarHBondContact O-N 2.98Å; V188-L190 VanDerWaalsContact C-N 3.33Å; V188-L190 PolarHBondContact O-N 3.27Å; V188-C191 WeakPolarHBondContact O-CA 3.15Å; V188-C191 WeakPolarHBondContact O-CB 3.15Å; V188-C191 PolarHBondContact O-N 2.77Å; V188-V192 HydrophobicContact CG1-CG2 4.4Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 3.01Å
189	V	83	Confident	74.7	Confident	95 Å²	95	106.3 Å²	106.3	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-60.7	-42.8	176.5	172.1	0	0	0	0	111	L185 C191 V192 K193	L185-V189 WeakPolarHBondContact O-CG2 3.25Å; L185-V189 PolarHBondContact O-N 3.22Å; V189-C191 VanDerWaalsContact C-N 3.26Å; V189-C191 PolarHBondContact O-N 3.36Å; V189-V192 PolarHBondContact O-N 3.41Å; V189-K193 WeakPolarHBondContact O-CB 3.34Å; V189-K193 PolarHBondContact O-N 3.31Å
190	L	80.2	Confident	75.6	Confident	127 Å²	127	106 Å²	106	67%	0.665	60%	0.599	S	S	*	*	H	α-helix	trans	-63.4	-32.1	173.8	-73.5	171.5	0	0	0	112.6	A186 G187 V188 S194	A186-L190 VanDerWaalsContact O-CG 3.32Å; A186-L190 WeakPolarHBondContact O-CG 3.43Å; A186-L190 PolarHBondContact O-N 2.78Å; A186-L190 VanDerWaalsContact O-N 3.08Å; G187-L190 PolarHBondContact O-N 2.93Å; V188-L190 VanDerWaalsContact C-N 3.33Å; V188-L190 PolarHBondContact O-N 3.27Å; L190-S194 PolarHBondContact O-N 3.41Å
191	C	76.9	Confident	76.2	Confident	76 Å²	76	102.9 Å²	102.9	51%	0.514	59%	0.594	S	S	.	*	H	α-helix	trans	-73.7	-42.5	177.9	-155.8	0	0	0	0	112.3	G187 V188 V189 S194 L195	G187-C191 WeakPolarHBondContact O-CB 3.34Å; G187-C191 PolarHBondContact O-N 2.83Å; V188-C191 WeakPolarHBondContact O-CA 3.15Å; V188-C191 WeakPolarHBondContact O-CB 3.15Å; V188-C191 PolarHBondContact O-N 2.77Å; V189-C191 VanDerWaalsContact C-N 3.26Å; V189-C191 PolarHBondContact O-N 3.36Å; C191-S194 PolarHBondContact O-N 3.22Å; C191-L195 WeakPolarHBondContact O-CD1 3.5Å; C191-L195 PolarHBondContact O-N 2.91Å
192	V	79.4	Confident	76.1	Confident	89 Å²	89	104.4 Å²	104.4	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-66	-42.2	177.2	174.4	0	0	0	0	110.8	V188 V189 S194 L195 S196	V188-V192 HydrophobicContact CG1-CG2 4.4Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 3.01Å; V189-V192 PolarHBondContact O-N 3.41Å; V192-S194 PolarHBondContact O-N 3.03Å; V192-S194 VanDerWaalsContact O-N 3.16Å; V192-L195 PolarHBondContact O-N 3.44Å; V192-S196 PolarHBondContact O-N 3.16Å
193	K	71	Confident	76.2	Confident	170 Å²	170	103.6 Å²	103.6	74%	0.739	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-9.8	178.7	-147.7	176	-174.4	174.8	0	114.1	V189	V189-K193 WeakPolarHBondContact O-CB 3.34Å; V189-K193 PolarHBondContact O-N 3.31Å
194	S	71.4	Confident	76.4	Confident	98 Å²	98	104.4 Å²	104.4	69%	0.685	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-10.5	172.6	175.1	0	0	0	0	112.8	L190 C191 V192	L190-S194 PolarHBondContact O-N 3.41Å; C191-S194 PolarHBondContact O-N 3.22Å; V192-S194 PolarHBondContact O-N 3.03Å; V192-S194 VanDerWaalsContact O-N 3.16Å
195	L	67.5	Low	75.9	Confident	151 Å²	151	100.4 Å²	100.4	79%	0.791	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-23.3	179.2	-101.4	125.7	0	0	0	112.7	C191 V192	C191-L195 WeakPolarHBondContact O-CD1 3.5Å; C191-L195 PolarHBondContact O-N 2.91Å; V192-L195 PolarHBondContact O-N 3.44Å
196	S	55.4	Low	75.2	Confident	155 Å²	155	101.4 Å²	101.4	100%	1.084	62%	0.619	S	S	*	*			trans	-87.6	0	160.4	-72.7	0	0	0	0	110.6	V192	V192-S196 PolarHBondContact O-N 3.16Å

Retrieved 196 of 196 residues in 156.6 ms (Link to these results)

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