A0A077Z9X7_TRITR Loading...

WW domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9X7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 254 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	43.2	Very low	45.7	Very low	233 Å²	233	155.5 Å²	155.5	100%	1.148	84%	0.84	S	S	*	*				0	87.3	0	-162.6	168.8	-169.5	0	0	107.5
2	V	43.4	Very low	45.6	Very low	137 Å²	137	152.3 Å²	152.3	83%	0.83	84%	0.838	S	S	*	*			trans	-134.3	108.4	168.5	178.6	0	0	0	0	105.3	I4	V2-I4 HydrophobicContact CG1-CG1 4.47Å
3	V	39.6	Very low	45.5	Very low	112 Å²	112	150.2 Å²	150.2	68%	0.679	83%	0.833	S	S	*	*			trans	-101.5	112.6	-176.8	-174.7	0	0	0	0	105.5
4	I	52.9	Low	45.5	Very low	159 Å²	159	154.2 Å²	154.2	82%	0.815	84%	0.838	S	S	*	*			trans	-93	109.5	173	-60.8	-179.1	0	0	0	107	V2	V2-I4 HydrophobicContact CG1-CG1 4.47Å
5	L	44.4	Very low	45.6	Very low	155 Å²	155	151.4 Å²	151.4	81%	0.812	83%	0.827	S	S	*	*			trans	-70.1	136.1	175	-68	169.9	0	0	0	110.1
6	G	40.3	Very low	45.5	Very low	73 Å²	73	151.3 Å²	151.3	75%	0.753	82%	0.824	S	S	*	*			trans	-72.7	146.6	-175.4	0	0	0	0	0	114
7	T	44.9	Very low	45.4	Very low	141 Å²	141	150 Å²	150	87%	0.865	82%	0.823	S	S	*	*			trans	-132.6	125.4	143.6	57.2	0	0	0	0	105.9
8	N	47.5	Very low	45.5	Very low	136 Å²	136	150 Å²	150	73%	0.727	82%	0.821	S	S	*	*				168.7	107.4	129	-164.6	-83.5	0	0	0	108.7	E10	N8-E10 PolarHBondContact O-N 3.15Å
9	T	49.9	Very low	45.3	Very low	139 Å²	139	146.6 Å²	146.6	85%	0.853	81%	0.814	S	S	*	*			trans	-72.5	90.1	173.8	-55.6	0	0	0	0	108.6
10	E	50.4	Low	45.6	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	82%	0.818	S	S	*	*			trans	-171.8	82.4	163.5	-109.9	169.1	-148	0	0	110.5	N8	N8-E10 PolarHBondContact O-N 3.15Å
11	R	45.9	Very low	45.6	Very low	253 Å²	253	149.3 Å²	149.3	96%	0.955	82%	0.816	S	S	*	*			trans	-134.3	75.8	169.6	-73.6	-170.7	173	-162.9	-1.9	109.6
12	S	44.9	Very low	46	Very low	116 Å²	116	141.2 Å²	141.2	81%	0.811	79%	0.786	S	S	*	*			trans	-137.3	47.4	170.5	-171.8	0	0	0	0	111.6
13	T	44.8	Very low	46.6	Very low	125 Å²	125	143.9 Å²	143.9	77%	0.767	79%	0.787	S	S	*	*			trans	-150.7	80.2	163.3	49.1	0	0	0	0	108.4	V15	T13-V15 PolarHBondContact O-N 3.42Å
14	F	44.6	Very low	47.3	Very low	207 Å²	207	145.9 Å²	145.9	91%	0.908	78%	0.782	S	S	*	*			trans	-71.9	87.5	168.7	-132.6	-94.3	0	0	0	107.4	L16	F14-L16 PolarHBondContact O-N 3.26Å; F14-L16 VanDerWaalsContact O-N 3.13Å
15	V	46.8	Very low	47.5	Very low	112 Å²	112	143.7 Å²	143.7	68%	0.679	77%	0.768	S	S	*	*			trans	-59.8	106.8	172	-87.7	0	0	0	0	109.4	T13 T17	T13-V15 PolarHBondContact O-N 3.42Å; V15-T17 PolarHBondContact O-N 3.41Å; V15-T17 PolarHBondContact O-OG1 3.37Å
16	L	44.1	Very low	48.2	Very low	149 Å²	149	139.5 Å²	139.5	78%	0.78	75%	0.749	S	S	*	*			trans	-64.3	88	162.1	-90	97.5	0	0	0	108.5	F14 L18	F14-L16 PolarHBondContact O-N 3.26Å; F14-L16 VanDerWaalsContact O-N 3.13Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 HydrophobicContact CD2-CD1 4.16Å; L16-L18 PolarHBondContact O-N 3.43Å; L16-L18 VanDerWaalsContact O-N 3.14Å
17	T	44.9	Very low	48.7	Very low	130 Å²	130	138 Å²	138	80%	0.798	73%	0.727	S	S	*	*			trans	-82.5	78.5	170.7	-52	0	0	0	0	107.6	V15	V15-T17 PolarHBondContact O-N 3.41Å; V15-T17 PolarHBondContact O-OG1 3.37Å
18	L	46.7	Very low	49.4	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	72%	0.723	S	S	*	*			trans	-89.2	124.5	170.9	-97	157.4	0	0	0	109.6	L16 K20	L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 HydrophobicContact CD2-CD1 4.16Å; L16-L18 PolarHBondContact O-N 3.43Å; L16-L18 VanDerWaalsContact O-N 3.14Å; L18-K20 PolarHBondContact O-N 2.85Å
19	A	40.7	Very low	50.3	Low	85 Å²	85	140.4 Å²	140.4	70%	0.702	73%	0.727	S	S	*	*			trans	-55	118.1	-168.4	0	0	0	0	0	114.1	L21	A19-L21 PolarHBondContact O-N 3.12Å
20	K	52.9	Low	51	Low	203 Å²	203	139.9 Å²	139.9	88%	0.883	72%	0.715	S	S	*	*			trans	-83.9	98.8	155.3	-73.4	179.4	179.1	174.7	0	107.5	L18 A22	L18-K20 PolarHBondContact O-N 2.85Å; K20-A22 VanDerWaalsContact C-N 3.28Å; K20-A22 PolarHBondContact O-N 3.1Å
21	L	44	Very low	51.4	Low	148 Å²	148	141.1 Å²	141.1	78%	0.775	72%	0.718	S	S	*	*			trans	-63.4	96.2	160.9	-88.8	100.5	0	0	0	107.8	A19	A19-L21 PolarHBondContact O-N 3.12Å
22	A	52.6	Low	51.8	Low	63 Å²	63	132.5 Å²	132.5	52%	0.521	69%	0.693	S	S	.	*			trans	-84.1	111.6	171.4	0	0	0	0	0	108.5	K20 R24	K20-A22 VanDerWaalsContact C-N 3.28Å; K20-A22 PolarHBondContact O-N 3.1Å; A22-R24 PolarHBondContact O-N 3.01Å; A22-R24 VanDerWaalsContact O-N 3.14Å
23	F	55.6	Low	52.1	Low	193 Å²	193	130 Å²	130	85%	0.846	67%	0.673	S	S	*	*			trans	-65.2	111.3	170	-75.7	-90.2	0	0	0	108.8	Q25	F23-Q25 PolarHBondContact O-N 3.3Å
24	R	55.2	Low	52.7	Low	153 Å²	153	126 Å²	126	58%	0.577	65%	0.648	S	S	*	*			trans	-71.5	112.3	172.7	179.2	171.6	178.7	-116.7	3	108.7	A22 T33 W35	A22-R24 PolarHBondContact O-N 3.01Å; A22-R24 VanDerWaalsContact O-N 3.14Å; R24-T33 PolarHBondContact NE-OG1 3.46Å; R24-T33 VanDerWaalsContact NE-OG1 3.15Å; R24-W35 HydrophobicContact CB-CZ3 4.18Å; R24-W35 HydrophobicContact CG-CZ3 4.45Å
25	Q	56.4	Low	53.4	Low	114 Å²	114	124.9 Å²	124.9	53%	0.533	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	128.8	173.4	-167.1	166.6	-19.5	0	0	110.1	F23 P38	F23-Q25 PolarHBondContact O-N 3.3Å; Q25-P38 VanDerWaalsContact OE1-CD 3.26Å
26	V	58.7	Low	53.9	Low	67 Å²	67	125.8 Å²	125.8	41%	0.406	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	114.9	175.9	178.2	0	0	0	0	107.5	H28	V26-H28 PolarHBondContact O-N 3.41Å
27	S	51.6	Low	54.6	Low	40 Å²	40	121.2 Å²	121.2	28%	0.28	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.8	113.1	167.6	176.1	0	0	0	0	108.7	I29 E30 K31	S27-I29 PolarHBondContact O-N 3.12Å; S27-I29 PolarHBondContact OG-N 3.35Å; S27-E30 PolarHBondContact OG-N 3.5Å; S27-K31 PolarHBondContact O-N 3.11Å
28	H	60.4	Low	55.3	Low	169 Å²	169	117.6 Å²	117.6	78%	0.782	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-12.3	174.4	-67	-68.7	0	0	0	113.1	V26	V26-H28 PolarHBondContact O-N 3.41Å
29	I	66.3	Low	55.7	Low	160 Å²	160	120.7 Å²	120.7	82%	0.821	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-39.9	-178.6	-57.1	169.3	0	0	0	110.5	S27	S27-I29 PolarHBondContact O-N 3.12Å; S27-I29 PolarHBondContact OG-N 3.35Å
30	E	63	Low	56.5	Low	128 Å²	128	124.7 Å²	124.7	60%	0.598	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	5.1	-173	-63.3	-179.4	170.1	0	0	113.5	S27 T32	S27-E30 PolarHBondContact OG-N 3.5Å; E30-T32 PolarHBondContact O-N 3Å; E30-T32 PolarHBondContact O-OG1 3.14Å
31	K	59.8	Low	56.6	Low	199 Å²	199	121.1 Å²	121.1	87%	0.865	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.3	33.3	-176.1	-61.9	-178.5	-179	175.4	0	113.3	S27	S27-K31 PolarHBondContact O-N 3.11Å
32	T	53.1	Low	57	Low	71 Å²	71	118 Å²	118	44%	0.436	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.4	137	-173.2	-62.4	0	0	0	0	110	E30	E30-T32 PolarHBondContact O-N 3Å; E30-T32 PolarHBondContact O-OG1 3.14Å
33	T	52.9	Low	56.9	Low	64 Å²	64	118.4 Å²	118.4	39%	0.393	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	124	176.6	-175.2	0	0	0	0	108.2	R24	R24-T33 PolarHBondContact NE-OG1 3.46Å; R24-T33 VanDerWaalsContact NE-OG1 3.15Å
34	T	57.1	Low	56.6	Low	40 Å²	40	118.6 Å²	118.6	25%	0.245	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.6	141.2	178.4	-47.6	0	0	0	0	108.9	E36 R41	T34-E36 HydrophobicContact CG2-CB 3.98Å; T34-E36 HydrophobicContact CG2-CG 4.39Å; T34-E36 PolarHBondContact O-N 3.21Å; T34-R41 PolarHBondContact OG1-NH2 3.15Å
35	W	58.7	Low	56.5	Low	185 Å²	185	113.7 Å²	113.7	70%	0.701	55%	0.553	S	S	*	*	S	Bend	trans	-86.5	6.3	179.4	-61.3	108.3	0	0	0	113.3	R24	R24-W35 HydrophobicContact CB-CZ3 4.18Å; R24-W35 HydrophobicContact CG-CZ3 4.45Å
36	E	58	Low	56.4	Low	130 Å²	130	110.4 Å²	110.4	61%	0.607	54%	0.539	S	S	*	.	S	Bend	trans	-103.7	132.3	-178.5	-71.7	174.8	153.1	0	0	110.6	T34	T34-E36 HydrophobicContact CG2-CB 3.98Å; T34-E36 HydrophobicContact CG2-CG 4.39Å; T34-E36 PolarHBondContact O-N 3.21Å
37	D	58.2	Low	56.2	Low	54 Å²	54	112 Å²	112	29%	0.289	56%	0.559	S	S	.	*			trans	-58.3	122.1	172.3	-171.3	-34.3	0	0	0	108.9	R39 K40 R41	D37-R39 PolarHBondContact O-N 3.46Å; D37-R39 VanDerWaalsContact O-N 3.08Å; D37-R39 WeakPolarHBondContact OD1-CB 3.4Å; D37-R39 WeakPolarHBondContact OD1-CG 3.48Å; D37-R39 IonicContact OD1-CZ 2.76Å; D37-R39 PolarHBondContact OD1-N 3.41Å; D37-R39 IonicContact OD1-NE 3.91Å; D37-R39 PolarHBondContact OD1-NE 3.11Å; D37-R39 IonicContact OD1-NH2 3.08Å; D37-R39 IonicContact OD2-CZ 3.23Å; D37-R39 IonicContact OD2-NE 3.47Å; D37-R39 PolarHBondContact OD2-NE 3.14Å; D37-R39 IonicContact OD2-NH2 3.67Å; D37-R39 PolarHBondContact OD2-NH2 3Å; D37-K40 HydrophobicContact CB-CB 4.23Å; D37-K40 HydrophobicContact CB-CD 4.42Å; D37-K40 HydrophobicContact CB-CG 4.13Å; D37-K40 CarbonylContact O-C 3.59Å; D37-K40 WeakPolarHBondContact O-CA 3.28Å; D37-K40 WeakPolarHBondContact O-CB 3.42Å; D37-K40 PolarHBondContact O-N 3.38Å; D37-R41 PolarHBondContact O-N 3.46Å
38	P	60.8	Low	56.7	Low	54 Å²	54	117.8 Å²	117.8	35%	0.351	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-17.4	179.1	25.5	-34	0	0	0	113.1	Q25 K40 R41	Q25-P38 VanDerWaalsContact OE1-CD 3.26Å; P38-K40 VanDerWaalsContact C-N 3.29Å; P38-R41 PolarHBondContact O-N 3.39Å
39	R	55.1	Low	57	Low	214 Å²	214	112.8 Å²	112.8	81%	0.808	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-14.4	172.1	-55.7	172.2	-68.9	176.9	1.3	112.8	D37	D37-R39 PolarHBondContact O-N 3.46Å; D37-R39 VanDerWaalsContact O-N 3.08Å; D37-R39 WeakPolarHBondContact OD1-CB 3.4Å; D37-R39 WeakPolarHBondContact OD1-CG 3.48Å; D37-R39 IonicContact OD1-CZ 2.76Å; D37-R39 PolarHBondContact OD1-N 3.41Å; D37-R39 IonicContact OD1-NE 3.91Å; D37-R39 PolarHBondContact OD1-NE 3.11Å; D37-R39 IonicContact OD1-NH2 3.08Å; D37-R39 IonicContact OD2-CZ 3.23Å; D37-R39 IonicContact OD2-NE 3.47Å; D37-R39 PolarHBondContact OD2-NE 3.14Å; D37-R39 IonicContact OD2-NH2 3.67Å; D37-R39 PolarHBondContact OD2-NH2 3Å
40	K	55.7	Low	57.5	Low	169 Å²	169	109 Å²	109	74%	0.735	55%	0.551	S	S	*	*	S	Bend	trans	-100.8	-2.4	171.9	-69.2	-168.5	177.7	-166.9	0	113.4	D37 P38 V42	D37-K40 HydrophobicContact CB-CB 4.23Å; D37-K40 HydrophobicContact CB-CD 4.42Å; D37-K40 HydrophobicContact CB-CG 4.13Å; D37-K40 CarbonylContact O-C 3.59Å; D37-K40 WeakPolarHBondContact O-CA 3.28Å; D37-K40 WeakPolarHBondContact O-CB 3.42Å; D37-K40 PolarHBondContact O-N 3.38Å; P38-K40 VanDerWaalsContact C-N 3.29Å; K40-V42 PolarHBondContact O-N 3.41Å
41	R	55.1	Low	58.4	Low	128 Å²	128	108.5 Å²	108.5	48%	0.483	56%	0.559	S	S	.	*	S	Bend	trans	-64.2	94.2	157.2	-67.6	-174.3	-155.5	-137	2.9	104.7	T34 D37 P38 A43	T34-R41 PolarHBondContact OG1-NH2 3.15Å; D37-R41 PolarHBondContact O-N 3.46Å; P38-R41 PolarHBondContact O-N 3.39Å; R41-A43 PolarHBondContact O-N 2.91Å
42	V	53.6	Low	59.5	Low	83 Å²	83	101.3 Å²	101.3	50%	0.503	53%	0.53	S	S	.	.			trans	-40.8	106.7	152.1	173.8	0	0	0	0	103.1	K40 K44	K40-V42 PolarHBondContact O-N 3.41Å; V42-K44 PolarHBondContact O-N 3.01Å
43	A	49.5	Very low	61	Low	72 Å²	72	100.5 Å²	100.5	60%	0.595	53%	0.526	S	S	*	.			trans	-44.7	121	177.3	0	0	0	0	0	104.2	R41 P45 R66	R41-A43 PolarHBondContact O-N 2.91Å; A43-P45 WeakPolarHBondContact O-CD 3.41Å; A43-R66 PolarHBondContact O-NH1 3.28Å
44	K	50.8	Low	62.6	Low	197 Å²	197	103.8 Å²	103.8	86%	0.857	55%	0.546	S	S	*	.			trans	-44	105	166.4	-101.1	-179.3	174.4	177.7	0	103.1	V42	V42-K44 PolarHBondContact O-N 3.01Å
45	P	52.1	Low	64.1	Low	49 Å²	49	103 Å²	103	32%	0.318	55%	0.545	S	S	.	.			trans	-65.9	149.4	167.7	38.9	-32.9	0	0	0	101.6	A43	A43-P45 WeakPolarHBondContact O-CD 3.41Å
46	D	53.6	Low	65.7	Low	45 Å²	45	97.2 Å²	97.2	24%	0.241	52%	0.524	C	S	.	.			trans	88.6	27.5	153.7	-41.9	-21.3	0	0	0	118.2	N48 L49 R82	D46-N48 PolarHBondContact O-N 2.86Å; D46-L49 HydrophobicContact CB-CB 3.67Å; D46-L49 HydrophobicContact CB-CG 4.16Å; D46-L49 VanDerWaalsContact CG-CD1 3.5Å; D46-L49 WeakPolarHBondContact OD1-CB 3.29Å; D46-L49 WeakPolarHBondContact OD1-CD1 3.48Å; D46-L49 WeakPolarHBondContact OD1-CG 3.42Å; D46-R82 VanDerWaalsContact CG-NH1 3.34Å; D46-R82 IonicContact OD2-CZ 3.7Å; D46-R82 IonicContact OD2-NH1 2.67Å; D46-R82 PolarHBondContact OD2-NH1 2.87Å; D46-R82 IonicContact OD2-NH2 3.69Å; D46-R82 PolarHBondContact OD2-NH2 3.12Å
47	A	54.3	Low	67.2	Low	101 Å²	101	94.7 Å²	94.7	84%	0.835	51%	0.512	S	S	*	.	S	Bend	trans	-63.2	-17.3	147	0	0	0	0	0	111.6
48	N	62.1	Low	68.7	Low	162 Å²	162	95 Å²	95	87%	0.866	51%	0.512	S	S	*	.	S	Bend	trans	-114	-6.2	-179	-75.7	-35.4	0	0	0	114.9	D46	D46-N48 PolarHBondContact O-N 2.86Å
49	L	67.8	Low	70.1	Confident	64 Å²	64	95.7 Å²	95.7	34%	0.335	51%	0.509	S	S	.	.	S	Bend	trans	-96.1	149	174.2	-62.7	-170.2	0	0	0	110	D46 I83	D46-L49 HydrophobicContact CB-CB 3.67Å; D46-L49 HydrophobicContact CB-CG 4.16Å; D46-L49 VanDerWaalsContact CG-CD1 3.5Å; D46-L49 WeakPolarHBondContact OD1-CB 3.29Å; D46-L49 WeakPolarHBondContact OD1-CD1 3.48Å; D46-L49 WeakPolarHBondContact OD1-CG 3.42Å; L49-I83 HydrophobicContact CD1-CD1 4.22Å; L49-I83 HydrophobicContact CD1-CG1 4.45Å
50	P	76.2	Confident	71.7	Confident	80 Å²	80	89.2 Å²	89.2	52%	0.519	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-56.2	155.9	172.2	24.7	-34.5	0	0	0	111	R82	P50-R82 HydrophobicContact CG-CG 4.46Å; P50-R82 WeakPolarHBondContact O-CD 3.5Å; P50-R82 PolarHBondContact O-NH1 3.2Å
51	P	81.3	Confident	73.2	Confident	117 Å²	117	82.2 Å²	82.2	76%	0.76	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-54.7	148.8	171.9	25.5	-34.4	0	0	0	110.2
52	L	84.3	Confident	74.7	Confident	48 Å²	48	82.5 Å²	82.5	25%	0.251	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-55.6	143	175.5	-81.6	85	0	0	0	110.1	W56 E58 F68	L52-W56 HydrophobicContact CB-CB 4.08Å; L52-W56 HydrophobicContact CD2-CB 3.96Å; L52-E58 HydrophobicContact CD2-CB 4.06Å; L52-F68 HydrophobicContact CD2-CD1 4Å; L52-F68 HydrophobicContact CD2-CE1 4.42Å
53	P	84.7	Confident	76.4	Confident	54 Å²	54	85.6 Å²	85.6	35%	0.351	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-58.6	155.3	177.1	-19.2	30.4	0	0	0	111.4	G55 W56 P81	P53-G55 PolarHBondContact O-N 2.89Å; P53-W56 HydrophobicContact CB-CG 4.41Å; P53-W56 WeakPolarHBondContact O-CB 3.36Å; P53-W56 PolarHBondContact O-N 3.11Å; P53-P81 HydrophobicContact CG-CB 4.1Å; P53-P81 HydrophobicContact CG-CG 4.08Å
54	T	86.3	Confident	78.1	Confident	134 Å²	134	84.3 Å²	84.3	82%	0.822	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	129.7	-179.4	-52.5	0	0	0	0	111.3	N72	T54-N72 PolarHBondContact O-ND2 3.41Å
55	G	89	Confident	79.8	Confident	22 Å²	22	78.7 Å²	78.7	23%	0.227	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-3.3	-175.4	0	0	0	0	0	114.1	P53 N70 H71	P53-G55 PolarHBondContact O-N 2.89Å; G55-N70 CarbonylContact O-C 3.59Å; G55-H71 WeakPolarHBondContact O-CB 3.47Å; G55-H71 PolarHBondContact O-CD2 3.16Å; G55-H71 VanDerWaalsContact O-CD2 3.29Å; G55-H71 PolarHBondContact O-N 3.3Å
56	W	91	Very high	81.5	Confident	65 Å²	65	79.8 Å²	79.8	25%	0.246	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.2	176.9	-68.8	78.8	0	0	0	112.9	L52 P53 F68 V69 N70 P81	L52-W56 HydrophobicContact CB-CB 4.08Å; L52-W56 HydrophobicContact CD2-CB 3.96Å; P53-W56 HydrophobicContact CB-CG 4.41Å; P53-W56 WeakPolarHBondContact O-CB 3.36Å; P53-W56 PolarHBondContact O-N 3.11Å; W56-F68 HydrophobicContact CE3-CB 3.89Å; W56-F68 HydrophobicContact CZ3-CB 3.9Å; W56-V69 CarbonylContact C-O 3.49Å; W56-V69 VanDerWaalsContact CA-O 3.26Å; W56-V69 WeakPolarHBondContact CA-O 3.28Å; W56-N70 HydrophobicContact CD2-CB 3.93Å; W56-N70 HydrophobicContact CE3-CB 3.97Å; W56-N70 HydrophobicContact CH2-CB 3.93Å; W56-N70 HydrophobicContact CZ2-CB 3.84Å; W56-N70 HydrophobicContact CZ3-CB 3.98Å; W56-P81 HydrophobicContact CB-CG 4.34Å; W56-P81 HydrophobicContact CD2-CB 3.83Å; W56-P81 HydrophobicContact CD2-CG 3.5Å; W56-P81 VanDerWaalsContact CD2-CG 3.5Å; W56-P81 HydrophobicContact CE3-CB 4.04Å; W56-P81 HydrophobicContact CE3-CG 3.54Å; W56-P81 HydrophobicContact CG-CB 4.43Å; W56-P81 HydrophobicContact CG-CG 3.88Å; W56-P81 HydrophobicContact CH2-CB 3.95Å; W56-P81 HydrophobicContact CH2-CG 4.35Å; W56-P81 HydrophobicContact CZ2-CB 3.77Å; W56-P81 HydrophobicContact CZ2-CG 4.35Å; W56-P81 HydrophobicContact CZ3-CB 4.09Å; W56-P81 HydrophobicContact CZ3-CG 3.97Å
57	E	89.7	Confident	83.3	Confident	77 Å²	77	80.4 Å²	80.4	36%	0.36	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.4	177.5	-174.2	-174.9	-179.4	0	0	110.1	K59 F68 V69 H71	E57-K59 HydrophobicContact CG-CG 4.27Å; E57-K59 WeakPolarHBondContact OE1-CE 3.33Å; E57-K59 IonicContact OE1-NZ 3.32Å; E57-K59 WeakPolarHBondContact OE2-CE 3.46Å; E57-K59 IonicContact OE2-NZ 3.03Å; E57-K59 PolarHBondContact OE2-NZ 3.22Å; E57-K59 VanDerWaalsContact OE2-NZ 3.08Å; E57-F68 CarbonylContact O-C 3.54Å; E57-F68 WeakPolarHBondContact O-CA 3.22Å; E57-V69 HydrophobicContact CB-CB 4.34Å; E57-V69 PolarHBondContact N-O 2.91Å; E57-V69 PolarHBondContact O-N 3.45Å; E57-H71 WeakPolarHBondContact CB-NE2 3.25Å; E57-H71 IonicContact OE2-CE1 2.8Å; E57-H71 PolarHBondContact OE2-CE1 3.41Å; E57-H71 VanDerWaalsContact OE2-CE1 3.23Å; E57-H71 IonicContact OE2-NE2 2.85Å; E57-H71 PolarHBondContact OE2-NE2 2.96Å
58	E	89.4	Confident	85	Confident	60 Å²	60	76.2 Å²	76.2	28%	0.28	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.4	171.5	-175.2	-174.4	163.4	0	0	109.7	L52 R66 F68	L52-E58 HydrophobicContact CD2-CB 4.06Å; E58-R66 WeakPolarHBondContact OE1-CD 3.41Å; E58-F68 HydrophobicContact CB-CD1 4.24Å; E58-F68 HydrophobicContact CB-CE1 4.16Å; E58-F68 HydrophobicContact CG-CD1 4.37Å; E58-F68 HydrophobicContact CG-CE1 3.96Å
59	K	90.5	Very high	86.4	Confident	68 Å²	68	69.1 Å²	69.1	30%	0.296	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	162.5	175.8	-69.4	-171.3	-175.8	170.6	0	111.1	E57 R66 Y67 V69	E57-K59 HydrophobicContact CG-CG 4.27Å; E57-K59 WeakPolarHBondContact OE1-CE 3.33Å; E57-K59 IonicContact OE1-NZ 3.32Å; E57-K59 WeakPolarHBondContact OE2-CE 3.46Å; E57-K59 IonicContact OE2-NZ 3.03Å; E57-K59 PolarHBondContact OE2-NZ 3.22Å; E57-K59 VanDerWaalsContact OE2-NZ 3.08Å; K59-R66 WeakPolarHBondContact O-CA 3.19Å; K59-Y67 HydrophobicContact CB-CD1 3.92Å; K59-Y67 HydrophobicContact CB-CD2 4.17Å; K59-Y67 HydrophobicContact CB-CE1 3.34Å; K59-Y67 HydrophobicContact CB-CE2 3.64Å; K59-Y67 HydrophobicContact CB-CG 4.31Å; K59-Y67 WeakPolarHBondContact CB-OH 3.49Å; K59-Y67 HydrophobicContact CD-CE2 3.99Å; K59-Y67 VanDerWaalsContact CD-OH 3.25Å; K59-Y67 WeakPolarHBondContact CD-OH 3.47Å; K59-Y67 HydrophobicContact CG-CE2 4.3Å; K59-Y67 PolarHBondContact N-O 3.21Å; K59-Y67 WeakPolarHBondContact O-CD1 3.49Å; K59-Y67 PolarHBondContact O-N 3.47Å; K59-Y67 VanDerWaalsContact O-O 3.13Å; K59-V69 HydrophobicContact CD-CG2 3.88Å; K59-V69 HydrophobicContact CG-CG2 4.24Å
60	V	89.1	Confident	87.6	Confident	78 Å²	78	66.5 Å²	66.5	47%	0.473	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.5	178.4	-171.6	0	0	0	0	109	E65 R66	V60-E65 CarbonylContact C-O 3.5Å; V60-E65 VanDerWaalsContact CA-O 3.27Å; V60-E65 WeakPolarHBondContact CA-O 3.4Å; V60-R66 HydrophobicContact CG2-CG 4.08Å
61	T	87.9	Confident	88.3	Confident	23 Å²	23	67.3 Å²	67.3	14%	0.141	37%	0.368	C	S	.	.			trans	-71.6	160.4	175.1	67.4	0	0	0	0	110.5	Q63 G64 E65 Y67 W78	T61-Q63 VanDerWaalsContact CB-OE1 3.28Å; T61-Q63 PolarHBondContact O-N 3.43Å; T61-Q63 VanDerWaalsContact O-N 3.07Å; T61-Q63 PolarHBondContact OG1-N 2.94Å; T61-Q63 PolarHBondContact OG1-OE1 2.9Å; T61-G64 PolarHBondContact O-N 3.22Å; T61-E65 HydrophobicContact CG2-CB 4.36Å; T61-E65 PolarHBondContact N-O 3.26Å; T61-E65 WeakPolarHBondContact OG1-CB 3.49Å; T61-E65 PolarHBondContact OG1-N 2.94Å; T61-E65 VanDerWaalsContact OG1-N 3.08Å; T61-E65 PolarHBondContact OG1-O 3.45Å; T61-Y67 HydrophobicContact CG2-CD1 3.55Å; T61-Y67 HydrophobicContact CG2-CE1 3.72Å; T61-W78 HydrophobicContact CG2-CH2 3.95Å; T61-W78 HydrophobicContact CG2-CZ3 4.27Å
62	P	86.4	Confident	88.6	Confident	134 Å²	134	66.9 Å²	66.9	87%	0.87	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.5	171.5	-25.6	34.6	0	0	0	114	G64	P62-G64 VanDerWaalsContact C-N 3.26Å
63	Q	87.7	Confident	88.8	Confident	147 Å²	147	70 Å²	70	69%	0.687	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-11.6	175.5	-63.4	74.8	11.7	0	0	112.6	T61 E65	T61-Q63 VanDerWaalsContact CB-OE1 3.28Å; T61-Q63 PolarHBondContact O-N 3.43Å; T61-Q63 VanDerWaalsContact O-N 3.07Å; T61-Q63 PolarHBondContact OG1-N 2.94Å; T61-Q63 PolarHBondContact OG1-OE1 2.9Å; Q63-E65 HydrophobicContact CB-CG 4.35Å
64	G	86	Confident	89.1	Confident	45 Å²	45	75.9 Å²	75.9	46%	0.464	40%	0.399	S	S	.	.	S	Bend	trans	90.1	12.2	-178.5	0	0	0	0	0	114.2	T61 P62	T61-G64 PolarHBondContact O-N 3.22Å; P62-G64 VanDerWaalsContact C-N 3.26Å
65	E	86.1	Confident	89.2	Confident	79 Å²	79	72.8 Å²	72.8	37%	0.369	38%	0.38	S	S	.	.			trans	-88.1	139.6	179.3	-56.5	175.2	130.3	0	0	110.3	V60 T61 Q63 W78	V60-E65 CarbonylContact C-O 3.5Å; V60-E65 VanDerWaalsContact CA-O 3.27Å; V60-E65 WeakPolarHBondContact CA-O 3.4Å; T61-E65 HydrophobicContact CG2-CB 4.36Å; T61-E65 PolarHBondContact N-O 3.26Å; T61-E65 WeakPolarHBondContact OG1-CB 3.49Å; T61-E65 PolarHBondContact OG1-N 2.94Å; T61-E65 VanDerWaalsContact OG1-N 3.08Å; T61-E65 PolarHBondContact OG1-O 3.45Å; Q63-E65 HydrophobicContact CB-CG 4.35Å; E65-W78 HydrophobicContact CB-CH2 4.38Å; E65-W78 HydrophobicContact CB-CZ3 3.83Å
66	R	88.1	Confident	89.4	Confident	72 Å²	72	76.7 Å²	76.7	27%	0.272	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.9	178	-79.1	179.7	-87.3	-145.5	0.5	110.1	A43 E58 K59 V60 Y91	A43-R66 PolarHBondContact O-NH1 3.28Å; E58-R66 WeakPolarHBondContact OE1-CD 3.41Å; K59-R66 WeakPolarHBondContact O-CA 3.19Å; V60-R66 HydrophobicContact CG2-CG 4.08Å; R66-Y91 PolarHBondContact N-OH 2.75Å
67	Y	90.5	Very high	89.3	Confident	59 Å²	59	75.1 Å²	75.1	23%	0.231	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156	175.1	69.9	-81.5	0	0	0	110.5	K59 T61 V69	K59-Y67 HydrophobicContact CB-CD1 3.92Å; K59-Y67 HydrophobicContact CB-CD2 4.17Å; K59-Y67 HydrophobicContact CB-CE1 3.34Å; K59-Y67 HydrophobicContact CB-CE2 3.64Å; K59-Y67 HydrophobicContact CB-CG 4.31Å; K59-Y67 WeakPolarHBondContact CB-OH 3.49Å; K59-Y67 HydrophobicContact CD-CE2 3.99Å; K59-Y67 VanDerWaalsContact CD-OH 3.25Å; K59-Y67 WeakPolarHBondContact CD-OH 3.47Å; K59-Y67 HydrophobicContact CG-CE2 4.3Å; K59-Y67 PolarHBondContact N-O 3.21Å; K59-Y67 WeakPolarHBondContact O-CD1 3.49Å; K59-Y67 PolarHBondContact O-N 3.47Å; K59-Y67 VanDerWaalsContact O-O 3.13Å; T61-Y67 HydrophobicContact CG2-CD1 3.55Å; T61-Y67 HydrophobicContact CG2-CE1 3.72Å; Y67-V69 HydrophobicContact CD2-CG2 3.84Å; Y67-V69 HydrophobicContact CE2-CG2 3.52Å
68	F	91.7	Very high	89.3	Confident	13 Å²	13	76.7 Å²	76.7	6%	0.057	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.4	-175.1	-58.8	-88.7	0	0	0	109.6	L52 W56 E57 E58 T76 S77 F79 D80	L52-F68 HydrophobicContact CD2-CD1 4Å; L52-F68 HydrophobicContact CD2-CE1 4.42Å; W56-F68 HydrophobicContact CE3-CB 3.89Å; W56-F68 HydrophobicContact CZ3-CB 3.9Å; E57-F68 CarbonylContact O-C 3.54Å; E57-F68 WeakPolarHBondContact O-CA 3.22Å; E58-F68 HydrophobicContact CB-CD1 4.24Å; E58-F68 HydrophobicContact CB-CE1 4.16Å; E58-F68 HydrophobicContact CG-CD1 4.37Å; E58-F68 HydrophobicContact CG-CE1 3.96Å; F68-T76 WeakPolarHBondContact O-CA 3.3Å; F68-S77 PolarHBondContact N-O 3.48Å; F68-S77 PolarHBondContact O-N 2.94Å; F68-F79 VanDerWaalsContact CD2-C 3.49Å; F68-F79 WeakPolarHBondContact CD2-O 3.46Å; F68-D80 VanDerWaalsContact CD2-CA 3.48Å; F68-D80 HydrophobicContact CD2-CB 4.12Å; F68-D80 HydrophobicContact CE1-CB 3.98Å; F68-D80 WeakPolarHBondContact CE1-OD2 3.31Å; F68-D80 VanDerWaalsContact CE2-CA 3.4Å; F68-D80 HydrophobicContact CE2-CB 3.48Å; F68-D80 VanDerWaalsContact CE2-CB 3.48Å; F68-D80 HydrophobicContact CZ-CB 3.4Å; F68-D80 VanDerWaalsContact CZ-OD2 3.22Å; F68-D80 WeakPolarHBondContact CZ-OD2 3.32Å
69	V	91.3	Very high	89.2	Confident	13 Å²	13	76 Å²	76	8%	0.079	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.1	-179.6	-175.4	0	0	0	0	108.3	W56 E57 K59 Y67 T76	W56-V69 CarbonylContact C-O 3.49Å; W56-V69 VanDerWaalsContact CA-O 3.26Å; W56-V69 WeakPolarHBondContact CA-O 3.28Å; E57-V69 HydrophobicContact CB-CB 4.34Å; E57-V69 PolarHBondContact N-O 2.91Å; E57-V69 PolarHBondContact O-N 3.45Å; K59-V69 HydrophobicContact CD-CG2 3.88Å; K59-V69 HydrophobicContact CG-CG2 4.24Å; Y67-V69 HydrophobicContact CD2-CG2 3.84Å; Y67-V69 HydrophobicContact CE2-CG2 3.52Å; V69-T76 HydrophobicContact CG1-CG2 4.31Å; V69-T76 HydrophobicContact CG2-CG2 4.09Å
70	N	91.6	Very high	89.1	Confident	9 Å²	9	73.3 Å²	73.3	5%	0.048	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	106.6	172.3	177.2	1.8	0	0	0	108.9	G55 W56 N72 D73 E74 T75	G55-N70 CarbonylContact O-C 3.59Å; W56-N70 HydrophobicContact CD2-CB 3.93Å; W56-N70 HydrophobicContact CE3-CB 3.97Å; W56-N70 HydrophobicContact CH2-CB 3.93Å; W56-N70 HydrophobicContact CZ2-CB 3.84Å; W56-N70 HydrophobicContact CZ3-CB 3.98Å; N70-N72 VanDerWaalsContact C-N 3.28Å; N70-N72 PolarHBondContact O-N 2.81Å; N70-N72 VanDerWaalsContact OD1-CB 3.27Å; N70-N72 WeakPolarHBondContact OD1-CB 3.42Å; N70-N72 PolarHBondContact OD1-N 3.38Å; N70-D73 PolarHBondContact ND2-OD2 3.4Å; N70-E74 CarbonylContact O-C 3.58Å; N70-E74 VanDerWaalsContact O-CA 3.24Å; N70-E74 WeakPolarHBondContact O-CA 3.28Å; N70-E74 PolarHBondContact O-N 3.07Å; N70-T75 PolarHBondContact N-O 3.5Å; N70-T75 PolarHBondContact O-N 3.28Å
71	H	90.8	Very high	88.8	Confident	97 Å²	97	71.8 Å²	71.8	45%	0.449	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-13.8	178.2	-65.4	-69.9	0	0	0	113.8	G55 E57	G55-H71 WeakPolarHBondContact O-CB 3.47Å; G55-H71 PolarHBondContact O-CD2 3.16Å; G55-H71 VanDerWaalsContact O-CD2 3.29Å; G55-H71 PolarHBondContact O-N 3.3Å; E57-H71 WeakPolarHBondContact CB-NE2 3.25Å; E57-H71 IonicContact OE2-CE1 2.8Å; E57-H71 PolarHBondContact OE2-CE1 3.41Å; E57-H71 VanDerWaalsContact OE2-CE1 3.23Å; E57-H71 IonicContact OE2-NE2 2.85Å; E57-H71 PolarHBondContact OE2-NE2 2.96Å
72	N	88.3	Confident	88.4	Confident	108 Å²	108	72.7 Å²	72.7	58%	0.578	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-38.8	176.6	-54.9	-34	0	0	0	110.8	T54 N70	T54-N72 PolarHBondContact O-ND2 3.41Å; N70-N72 VanDerWaalsContact C-N 3.28Å; N70-N72 PolarHBondContact O-N 2.81Å; N70-N72 VanDerWaalsContact OD1-CB 3.27Å; N70-N72 WeakPolarHBondContact OD1-CB 3.42Å; N70-N72 PolarHBondContact OD1-N 3.38Å
73	D	89.1	Confident	88.2	Confident	112 Å²	112	69 Å²	69	60%	0.599	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	1	-178.4	-58.1	-54.7	0	0	0	112.8	N70 T75	N70-D73 PolarHBondContact ND2-OD2 3.4Å; D73-T75 HydrophobicContact CB-CG2 4.01Å; D73-T75 WeakPolarHBondContact O-CG2 3.2Å; D73-T75 PolarHBondContact O-N 3.19Å
74	E	90.9	Very high	87.8	Confident	179 Å²	179	65.9 Å²	65.9	84%	0.836	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	35.2	-172	-57.7	-174.2	149.2	0	0	113.1	N70	N70-E74 CarbonylContact O-C 3.58Å; N70-E74 VanDerWaalsContact O-CA 3.24Å; N70-E74 WeakPolarHBondContact O-CA 3.28Å; N70-E74 PolarHBondContact O-N 3.07Å
75	T	88.4	Confident	87.3	Confident	68 Å²	68	69.3 Å²	69.3	42%	0.417	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	152.9	-177.5	52.4	0	0	0	0	111.9	N70 D73	N70-T75 PolarHBondContact N-O 3.5Å; N70-T75 PolarHBondContact O-N 3.28Å; D73-T75 HydrophobicContact CB-CG2 4.01Å; D73-T75 WeakPolarHBondContact O-CG2 3.2Å; D73-T75 PolarHBondContact O-N 3.19Å
76	T	92.1	Very high	86.6	Confident	104 Å²	104	73.1 Å²	73.1	64%	0.638	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	140.3	172.3	58.8	0	0	0	0	109.7	F68 V69	F68-T76 WeakPolarHBondContact O-CA 3.3Å; V69-T76 HydrophobicContact CG1-CG2 4.31Å; V69-T76 HydrophobicContact CG2-CG2 4.09Å
77	S	89.2	Confident	85.8	Confident	33 Å²	33	75.9 Å²	75.9	23%	0.231	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.5	-177.2	-177.2	0	0	0	0	110.3	F68 F79	F68-S77 PolarHBondContact N-O 3.48Å; F68-S77 PolarHBondContact O-N 2.94Å; S77-F79 PolarHBondContact OG-N 2.93Å; S77-F79 PolarHBondContact OG-O 3.45Å
78	W	89.5	Confident	84.9	Confident	109 Å²	109	74.1 Å²	74.1	41%	0.413	38%	0.379	S	S	.	.	S	Bend	trans	-80.2	-7.7	168.7	-64.1	107.5	0	0	0	112.6	T61 E65 V92	T61-W78 HydrophobicContact CG2-CH2 3.95Å; T61-W78 HydrophobicContact CG2-CZ3 4.27Å; E65-W78 HydrophobicContact CB-CH2 4.38Å; E65-W78 HydrophobicContact CB-CZ3 3.83Å; W78-V92 HydrophobicContact CB-CG1 3.53Å; W78-V92 HydrophobicContact CG-CG1 4.26Å
79	F	88.5	Confident	83.7	Confident	47 Å²	47	80.3 Å²	80.3	21%	0.206	40%	0.402	C	S	.	.	S	Bend	trans	-100.3	129.5	-179	-52.8	-73.6	0	0	0	111	F68 S77 Q85 Q88 V92	F68-F79 VanDerWaalsContact CD2-C 3.49Å; F68-F79 WeakPolarHBondContact CD2-O 3.46Å; S77-F79 PolarHBondContact OG-N 2.93Å; S77-F79 PolarHBondContact OG-O 3.45Å; F79-Q85 HydrophobicContact CD1-CG 3.91Å; F79-Q85 HydrophobicContact CD2-CG 4.47Å; F79-Q85 HydrophobicContact CE1-CG 3.88Å; F79-Q85 HydrophobicContact CE2-CG 4.46Å; F79-Q85 HydrophobicContact CG-CG 4.19Å; F79-Q85 HydrophobicContact CZ-CG 4.16Å; F79-Q88 HydrophobicContact CD1-CB 3.84Å; F79-Q88 HydrophobicContact CE1-CB 4.47Å; F79-V92 HydrophobicContact CE1-CG1 4.1Å; F79-V92 HydrophobicContact CE1-CG2 3.66Å; F79-V92 HydrophobicContact CZ-CG1 4.3Å; F79-V92 HydrophobicContact CZ-CG2 3.65Å
80	D	87.3	Confident	82.3	Confident	10 Å²	10	85.1 Å²	85.1	5%	0.053	43%	0.434	C	S	.	.			trans	-66.8	120.3	172.2	-167.3	-34.6	0	0	0	110.5	F68 R82 I83 Q88	F68-D80 VanDerWaalsContact CD2-CA 3.48Å; F68-D80 HydrophobicContact CD2-CB 4.12Å; F68-D80 HydrophobicContact CE1-CB 3.98Å; F68-D80 WeakPolarHBondContact CE1-OD2 3.31Å; F68-D80 VanDerWaalsContact CE2-CA 3.4Å; F68-D80 HydrophobicContact CE2-CB 3.48Å; F68-D80 VanDerWaalsContact CE2-CB 3.48Å; F68-D80 HydrophobicContact CZ-CB 3.4Å; F68-D80 VanDerWaalsContact CZ-OD2 3.22Å; F68-D80 WeakPolarHBondContact CZ-OD2 3.32Å; D80-R82 PolarHBondContact O-N 3.24Å; D80-R82 WeakPolarHBondContact OD1-CB 3.46Å; D80-R82 WeakPolarHBondContact OD1-CG 3.21Å; D80-R82 IonicContact OD1-CZ 3.3Å; D80-R82 PolarHBondContact OD1-N 3.28Å; D80-R82 IonicContact OD1-NE 3.18Å; D80-R82 PolarHBondContact OD1-NE 3.01Å; D80-R82 IonicContact OD1-NH2 2.68Å; D80-R82 IonicContact OD2-CZ 3.63Å; D80-R82 VanDerWaalsContact OD2-CZ 3.3Å; D80-R82 IonicContact OD2-NE 2.74Å; D80-R82 PolarHBondContact OD2-NE 3.41Å; D80-R82 IonicContact OD2-NH2 3.06Å; D80-R82 PolarHBondContact OD2-NH2 3.24Å; D80-I83 HydrophobicContact CB-CB 4.42Å; D80-I83 HydrophobicContact CB-CD1 4.15Å; D80-I83 HydrophobicContact CB-CG1 4.25Å; D80-I83 PolarHBondContact O-N 3.44Å; D80-I83 VanDerWaalsContact O-N 3.15Å; D80-I83 VanDerWaalsContact O-O 3.12Å; D80-Q88 PolarHBondContact O-NE2 3.35Å
81	P	82.6	Confident	80.5	Confident	46 Å²	46	90.4 Å²	90.4	30%	0.299	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.1	178.5	31.3	-41.4	0	0	0	114	P53 W56	P53-P81 HydrophobicContact CG-CB 4.1Å; P53-P81 HydrophobicContact CG-CG 4.08Å; W56-P81 HydrophobicContact CB-CG 4.34Å; W56-P81 HydrophobicContact CD2-CB 3.83Å; W56-P81 HydrophobicContact CD2-CG 3.5Å; W56-P81 VanDerWaalsContact CD2-CG 3.5Å; W56-P81 HydrophobicContact CE3-CB 4.04Å; W56-P81 HydrophobicContact CE3-CG 3.54Å; W56-P81 HydrophobicContact CG-CB 4.43Å; W56-P81 HydrophobicContact CG-CG 3.88Å; W56-P81 HydrophobicContact CH2-CB 3.95Å; W56-P81 HydrophobicContact CH2-CG 4.35Å; W56-P81 HydrophobicContact CZ2-CB 3.77Å; W56-P81 HydrophobicContact CZ2-CG 4.35Å; W56-P81 HydrophobicContact CZ3-CB 4.09Å; W56-P81 HydrophobicContact CZ3-CG 3.97Å
82	R	81.1	Confident	78.9	Confident	43 Å²	43	86.5 Å²	86.5	16%	0.162	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-15.7	180	-59.5	169.1	-71.4	179.1	2.4	113.1	D46 P50 D80	D46-R82 VanDerWaalsContact CG-NH1 3.34Å; D46-R82 IonicContact OD2-CZ 3.7Å; D46-R82 IonicContact OD2-NH1 2.67Å; D46-R82 PolarHBondContact OD2-NH1 2.87Å; D46-R82 IonicContact OD2-NH2 3.69Å; D46-R82 PolarHBondContact OD2-NH2 3.12Å; P50-R82 HydrophobicContact CG-CG 4.46Å; P50-R82 WeakPolarHBondContact O-CD 3.5Å; P50-R82 PolarHBondContact O-NH1 3.2Å; D80-R82 PolarHBondContact O-N 3.24Å; D80-R82 WeakPolarHBondContact OD1-CB 3.46Å; D80-R82 WeakPolarHBondContact OD1-CG 3.21Å; D80-R82 IonicContact OD1-CZ 3.3Å; D80-R82 PolarHBondContact OD1-N 3.28Å; D80-R82 IonicContact OD1-NE 3.18Å; D80-R82 PolarHBondContact OD1-NE 3.01Å; D80-R82 IonicContact OD1-NH2 2.68Å; D80-R82 IonicContact OD2-CZ 3.63Å; D80-R82 VanDerWaalsContact OD2-CZ 3.3Å; D80-R82 IonicContact OD2-NE 2.74Å; D80-R82 PolarHBondContact OD2-NE 3.41Å; D80-R82 IonicContact OD2-NH2 3.06Å; D80-R82 PolarHBondContact OD2-NH2 3.24Å
83	I	81.7	Confident	77.3	Confident	56 Å²	56	85 Å²	85	29%	0.287	44%	0.439	S	S	.	.	S	Bend	trans	-117.2	133	-174.3	-54.4	173.4	0	0	0	108.1	L49 D80 Q85 L87 Q88	L49-I83 HydrophobicContact CD1-CD1 4.22Å; L49-I83 HydrophobicContact CD1-CG1 4.45Å; D80-I83 HydrophobicContact CB-CB 4.42Å; D80-I83 HydrophobicContact CB-CD1 4.15Å; D80-I83 HydrophobicContact CB-CG1 4.25Å; D80-I83 PolarHBondContact O-N 3.44Å; D80-I83 VanDerWaalsContact O-N 3.15Å; D80-I83 VanDerWaalsContact O-O 3.12Å; I83-Q85 PolarHBondContact O-N 2.91Å; I83-L87 HydrophobicContact CG2-CB 3.76Å; I83-L87 HydrophobicContact CG2-CD1 4.27Å; I83-Q88 HydrophobicContact CB-CG 3.84Å; I83-Q88 HydrophobicContact CG2-CG 3.57Å; I83-Q88 PolarHBondContact O-NE2 3.09Å
84	P	78.6	Confident	75.5	Confident	82 Å²	82	84.5 Å²	84.5	53%	0.532	45%	0.45	S	S	.	.			trans	-52.7	132.9	170.4	-27.2	33.6	0	0	0	111.8	E86 L87	P84-E86 PolarHBondContact O-N 3.47Å; P84-L87 HydrophobicContact CG-CD1 4.31Å; P84-L87 PolarHBondContact O-N 2.86Å
85	Q	76.1	Confident	73.7	Confident	116 Å²	116	79.9 Å²	79.9	54%	0.542	44%	0.443	S	S	.	.	H	α-helix	trans	-54.1	-31.1	-176.5	-173	-179.9	-8.7	0	0	112.9	F79 I83 L87 Q88 R89	F79-Q85 HydrophobicContact CD1-CG 3.91Å; F79-Q85 HydrophobicContact CD2-CG 4.47Å; F79-Q85 HydrophobicContact CE1-CG 3.88Å; F79-Q85 HydrophobicContact CE2-CG 4.46Å; F79-Q85 HydrophobicContact CG-CG 4.19Å; F79-Q85 HydrophobicContact CZ-CG 4.16Å; I83-Q85 PolarHBondContact O-N 2.91Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 2.74Å; Q85-Q88 PolarHBondContact O-N 3.45Å; Q85-R89 PolarHBondContact O-N 3.45Å; Q85-R89 VanDerWaalsContact O-N 3.1Å
86	E	71	Confident	72	Confident	160 Å²	160	83.3 Å²	83.3	75%	0.748	45%	0.454	S	S	*	.	H	α-helix	trans	-58.3	-39.1	175.5	-63.7	-179.7	178	0	0	112.8	P84 Q88	P84-E86 PolarHBondContact O-N 3.47Å; E86-Q88 VanDerWaalsContact C-N 3.27Å; E86-Q88 PolarHBondContact O-N 3.5Å
87	L	72.3	Confident	69.8	Low	130 Å²	130	89.9 Å²	89.9	68%	0.681	47%	0.467	S	S	*	.	H	α-helix	trans	-77.2	-15.6	177.4	-63	177.9	0	0	0	112.6	I83 P84 Q85 P90	I83-L87 HydrophobicContact CG2-CB 3.76Å; I83-L87 HydrophobicContact CG2-CD1 4.27Å; P84-L87 HydrophobicContact CG-CD1 4.31Å; P84-L87 PolarHBondContact O-N 2.86Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 2.74Å; L87-P90 WeakPolarHBondContact O-CD 3.47Å
88	Q	71.6	Confident	67.4	Low	21 Å²	21	92 Å²	92	10%	0.098	49%	0.494	C	S	.	.	H	α-helix	trans	-99.6	-10.7	-176.9	-59.8	-168.7	57.6	0	0	114.2	F79 D80 I83 Q85 E86 P90 Y91	F79-Q88 HydrophobicContact CD1-CB 3.84Å; F79-Q88 HydrophobicContact CE1-CB 4.47Å; D80-Q88 PolarHBondContact O-NE2 3.35Å; I83-Q88 HydrophobicContact CB-CG 3.84Å; I83-Q88 HydrophobicContact CG2-CG 3.57Å; I83-Q88 PolarHBondContact O-NE2 3.09Å; Q85-Q88 PolarHBondContact O-N 3.45Å; E86-Q88 VanDerWaalsContact C-N 3.27Å; E86-Q88 PolarHBondContact O-N 3.5Å; Q88-P90 WeakPolarHBondContact O-CD 3.26Å; Q88-Y91 WeakPolarHBondContact O-CB 3.5Å; Q88-Y91 PolarHBondContact O-N 3.49Å
89	R	66.1	Low	65.1	Low	143 Å²	143	90.3 Å²	90.3	54%	0.54	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.5	178.6	-143.5	179.2	-124.4	-173.3	4	114.9	Q85 Y91 D234	Q85-R89 PolarHBondContact O-N 3.45Å; Q85-R89 VanDerWaalsContact O-N 3.1Å; R89-Y91 PolarHBondContact O-N 2.86Å; R89-D234 IonicContact NH1-OD2 3.86Å
90	P	60.6	Low	62.7	Low	115 Å²	115	91.5 Å²	91.5	75%	0.747	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.7	172.3	-19.7	32.5	0	0	0	115.3	L87 Q88	L87-P90 WeakPolarHBondContact O-CD 3.47Å; Q88-P90 WeakPolarHBondContact O-CD 3.26Å
91	Y	55.6	Low	60.4	Low	120 Å²	120	98.8 Å²	98.8	47%	0.471	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.4	-23.5	-172.5	-167.8	-116	0	0	0	114.7	R66 Q88 R89	R66-Y91 PolarHBondContact N-OH 2.75Å; Q88-Y91 WeakPolarHBondContact O-CB 3.5Å; Q88-Y91 PolarHBondContact O-N 3.49Å; R89-Y91 PolarHBondContact O-N 2.86Å
92	V	56.8	Low	58.5	Low	15 Å²	15	106.2 Å²	106.2	9%	0.091	59%	0.592	C	S	.	*	T	Hydrogen-bonded Turn	trans	-114.1	-9.1	-171.5	-59.9	0	0	0	0	115.2	W78 F79 A94 A95	W78-V92 HydrophobicContact CB-CG1 3.53Å; W78-V92 HydrophobicContact CG-CG1 4.26Å; F79-V92 HydrophobicContact CE1-CG1 4.1Å; F79-V92 HydrophobicContact CE1-CG2 3.66Å; F79-V92 HydrophobicContact CZ-CG1 4.3Å; F79-V92 HydrophobicContact CZ-CG2 3.65Å; V92-A94 PolarHBondContact O-N 3.21Å; V92-A95 PolarHBondContact O-N 3.44Å
93	A	54.7	Low	56.7	Low	75 Å²	75	113.3 Å²	113.3	62%	0.62	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-17.3	-177.3	0	0	0	0	0	113.6
94	A	51.9	Low	55.3	Low	102 Å²	102	118.2 Å²	118.2	84%	0.843	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-16.9	178	0	0	0	0	0	114.1	V92	V92-A94 PolarHBondContact O-N 3.21Å
95	A	52.7	Low	53.5	Low	82 Å²	82	121.7 Å²	121.7	68%	0.678	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-7.5	-170.4	0	0	0	0	0	115.4	V92	V92-A95 PolarHBondContact O-N 3.44Å
96	Q	52.9	Low	52	Low	140 Å²	140	124.3 Å²	124.3	65%	0.654	68%	0.682	S	S	*	*			trans	-103.8	3.8	-171.5	-68.8	-175	36.2	0	0	115.9	G98	Q96-G98 PolarHBondContact O-N 2.62Å
97	R	44.1	Very low	50.7	Low	242 Å²	242	124 Å²	124	91%	0.913	68%	0.684	S	S	*	*	S	Bend	trans	-72.8	26	174.4	-66.8	-155.7	-159.4	-166.3	6.3	114.4
98	G	38.7	Very low	49.5	Very low	77 Å²	77	123 Å²	123	79%	0.794	69%	0.685	S	S	*	*			trans	-148.5	63.3	-176.8	0	0	0	0	0	112.7	Q96	Q96-G98 PolarHBondContact O-N 2.62Å
99	G	41.7	Very low	48.1	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	72%	0.717	S	S	*	*			trans	-153.7	90.5	176.2	0	0	0	0	0	111.7
100	G	37.6	Very low	46.8	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	73%	0.734	S	S	*	*			trans	-71	141.7	179.3	0	0	0	0	0	113.8
101	Q	40.8	Very low	46.1	Very low	163 Å²	163	130.1 Å²	130.1	76%	0.762	73%	0.731	S	S	*	*			trans	43.5	124.8	145.5	-51.6	-169.3	-32.4	0	0	119
102	R	42.1	Very low	45.9	Very low	201 Å²	201	129.8 Å²	129.8	76%	0.758	74%	0.742	S	S	*	*				163.3	152.8	97.9	-79.5	-172.8	-173.5	-149	-4.4	110.6
103	F	43.1	Very low	45.8	Very low	193 Å²	193	135 Å²	135	85%	0.846	78%	0.779	S	S	*	*			trans	85.6	122.1	170.1	-63.4	-83.3	0	0	0	114.3
104	I	51.4	Low	45.4	Very low	158 Å²	158	139.7 Å²	139.7	81%	0.81	79%	0.788	S	S	*	*			cis	-152.6	142.3	24.5	-51.6	176.1	0	0	0	109.9
105	D	42.8	Very low	45.3	Very low	155 Å²	155	138.6 Å²	138.6	83%	0.829	77%	0.773	S	S	*	*			trans	-65.8	138.2	170.2	-64.2	-83.8	0	0	0	114.1
106	D	43	Very low	45.5	Very low	171 Å²	171	142 Å²	142	91%	0.914	78%	0.78	S	S	*	*			trans	-162.1	123.6	140.7	-120.3	-54.6	0	0	0	111.2
107	L	43.5	Very low	45.9	Very low	153 Å²	153	143.9 Å²	143.9	80%	0.801	79%	0.788	S	S	*	*			trans	-91	175.1	-179.3	-146.5	54	0	0	0	108
108	P	47.2	Very low	46.5	Very low	109 Å²	109	137.8 Å²	137.8	71%	0.708	77%	0.77	S	S	*	*			cis	-149.5	157.7	19.4	40.3	-17.1	0	0	0	120.9
109	S	42.9	Very low	47.6	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	75%	0.751	S	S	*	*			trans	22.3	124	132.8	-165.1	0	0	0	0	119.5
110	R	39.3	Very low	48.4	Very low	235 Å²	235	136.7 Å²	136.7	89%	0.887	74%	0.739	S	S	*	*			trans	124.5	84.6	139	-162.3	156.7	86	-179.5	9.5	115.8
111	A	46.4	Very low	49.4	Very low	85 Å²	85	137.1 Å²	137.1	70%	0.702	73%	0.73	S	S	*	*			trans	-159.8	89	146.8	0	0	0	0	0	106.8
112	T	51.3	Low	50.6	Low	114 Å²	114	137.1 Å²	137.1	70%	0.699	72%	0.723	S	S	*	*				61.9	116.5	104.5	55.4	0	0	0	0	113.3	E114	T112-E114 PolarHBondContact O-N 2.81Å
113	S	53.4	Low	51.7	Low	124 Å²	124	132.5 Å²	132.5	87%	0.867	71%	0.713	S	S	*	*	S	Bend	trans	-66.5	38.2	-170.8	53.8	0	0	0	0	116.2
114	E	47.1	Very low	52.6	Low	174 Å²	174	130.7 Å²	130.7	81%	0.813	71%	0.707	S	S	*	*			trans	-134.5	60.9	-174	-67.4	-174.3	133.8	0	0	110.6	T112	T112-E114 PolarHBondContact O-N 2.81Å
115	C	50	Low	53.1	Low	78 Å²	78	127.3 Å²	127.3	53%	0.527	69%	0.694	S	S	.	*			trans	-167.9	46.5	170.3	-151.1	0	0	0	0	114.3	V119	C115-V119 WeakPolarHBondContact O-CG2 3.27Å; C115-V119 VanDerWaalsContact SG-CG2 3.53Å
116	L	56.5	Low	53.9	Low	155 Å²	155	124 Å²	124	81%	0.812	68%	0.68	S	S	*	*	S	Bend	trans	-118.1	-34.7	171.4	-73.2	174.1	0	0	0	112.7	A120	L116-A120 PolarHBondContact O-N 3.36Å
117	E	60.1	Low	54.7	Low	179 Å²	179	118.8 Å²	118.8	84%	0.836	66%	0.66	S	S	*	*	H	α-helix	trans	-71.4	-38.9	175	-144.3	96.4	-154.6	0	0	112.4	C121	E117-C121 PolarHBondContact O-N 2.96Å; E117-C121 VanDerWaalsContact O-N 3.15Å
118	E	57.7	Low	55.4	Low	114 Å²	114	115.6 Å²	115.6	53%	0.533	65%	0.65	S	S	.	*	H	α-helix	trans	-73.3	-31.9	-177.3	-159.2	-171.8	148.3	0	0	112.3	C121 R122	E118-C121 PolarHBondContact O-N 3.47Å; E118-R122 WeakPolarHBondContact O-CB 3.44Å; E118-R122 VanDerWaalsContact O-CG 3.28Å; E118-R122 WeakPolarHBondContact O-CG 3.25Å; E118-R122 PolarHBondContact O-N 2.88Å; E118-R122 IonicContact OE1-CZ 3.8Å; E118-R122 IonicContact OE1-NE 3.12Å; E118-R122 PolarHBondContact OE1-NE 2.9Å; E118-R122 VanDerWaalsContact OE1-NE 3.12Å; E118-R122 IonicContact OE1-NH2 3.59Å
119	V	61.1	Low	56.2	Low	65 Å²	65	116.2 Å²	116.2	39%	0.394	64%	0.643	S	S	.	*	H	α-helix	trans	-70.9	-40	177.7	-177.8	0	0	0	0	110.7	C115 R122 L123	C115-V119 WeakPolarHBondContact O-CG2 3.27Å; C115-V119 VanDerWaalsContact SG-CG2 3.53Å; V119-R122 PolarHBondContact O-N 3.24Å; V119-L123 HydrophobicContact CG1-CD1 3.99Å; V119-L123 VanDerWaalsContact O-CD1 3.29Å; V119-L123 WeakPolarHBondContact O-CD1 3.25Å; V119-L123 PolarHBondContact O-N 2.98Å; V119-L123 VanDerWaalsContact O-N 3.11Å
120	A	59.8	Low	57.1	Low	62 Å²	62	116.7 Å²	116.7	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-64.9	-39.1	174.4	0	0	0	0	0	112.3	L116 Q124	L116-A120 PolarHBondContact O-N 3.36Å; A120-Q124 PolarHBondContact O-N 3.19Å
121	C	58.2	Low	58.2	Low	82 Å²	82	111.3 Å²	111.3	55%	0.554	62%	0.618	S	S	*	*	H	α-helix	trans	-69.7	-35.1	177.8	-155.7	0	0	0	0	112.3	E117 E118 T125	E117-C121 PolarHBondContact O-N 2.96Å; E117-C121 VanDerWaalsContact O-N 3.15Å; E118-C121 PolarHBondContact O-N 3.47Å; C121-T125 PolarHBondContact O-N 2.9Å; C121-T125 PolarHBondContact O-OG1 2.84Å
122	R	65.4	Low	58.9	Low	164 Å²	164	114.6 Å²	114.6	62%	0.619	62%	0.619	S	S	*	*	H	α-helix	trans	-68.5	-41.3	175.9	-78.1	170.6	164.4	-101.3	-0.8	112.7	E118 V119 Q124 T125 T126	E118-R122 WeakPolarHBondContact O-CB 3.44Å; E118-R122 VanDerWaalsContact O-CG 3.28Å; E118-R122 WeakPolarHBondContact O-CG 3.25Å; E118-R122 PolarHBondContact O-N 2.88Å; E118-R122 IonicContact OE1-CZ 3.8Å; E118-R122 IonicContact OE1-NE 3.12Å; E118-R122 PolarHBondContact OE1-NE 2.9Å; E118-R122 VanDerWaalsContact OE1-NE 3.12Å; E118-R122 IonicContact OE1-NH2 3.59Å; V119-R122 PolarHBondContact O-N 3.24Å; R122-Q124 PolarHBondContact O-N 3.09Å; R122-T125 PolarHBondContact O-N 3.09Å; R122-T126 PolarHBondContact O-N 3.28Å; R122-T126 VanDerWaalsContact O-N 3.11Å; R122-T126 PolarHBondContact O-OG1 3.11Å
123	L	65.2	Low	59.3	Low	104 Å²	104	116.3 Å²	116.3	55%	0.545	62%	0.619	S	S	.	*	H	α-helix	trans	-63.5	-38.6	178.4	-99	86.5	0	0	0	113.2	V119 T125 T126 A127	V119-L123 HydrophobicContact CG1-CD1 3.99Å; V119-L123 VanDerWaalsContact O-CD1 3.29Å; V119-L123 WeakPolarHBondContact O-CD1 3.25Å; V119-L123 PolarHBondContact O-N 2.98Å; V119-L123 VanDerWaalsContact O-N 3.11Å; L123-T125 VanDerWaalsContact C-N 3.3Å; L123-T125 PolarHBondContact O-N 2.87Å; L123-T126 WeakPolarHBondContact CA-OG1 3.21Å; L123-T126 PolarHBondContact O-OG1 2.76Å; L123-A127 PolarHBondContact O-N 3.26Å
124	Q	62.5	Low	59.5	Low	155 Å²	155	116.8 Å²	116.8	72%	0.724	61%	0.607	S	S	*	*	H	α-helix	trans	-67.5	-32.4	176.4	-81.9	-175.1	8.2	0	0	112.6	A120 R122	A120-Q124 PolarHBondContact O-N 3.19Å; R122-Q124 PolarHBondContact O-N 3.09Å
125	T	61.5	Low	59.9	Low	87 Å²	87	112.1 Å²	112.1	53%	0.534	60%	0.598	S	S	.	*	H	α-helix	trans	-74.7	-37.5	-179.2	-48.7	0	0	0	0	111.5	C121 R122 L123 C128 Q129	C121-T125 PolarHBondContact O-N 2.9Å; C121-T125 PolarHBondContact O-OG1 2.84Å; R122-T125 PolarHBondContact O-N 3.09Å; L123-T125 VanDerWaalsContact C-N 3.3Å; L123-T125 PolarHBondContact O-N 2.87Å; T125-C128 PolarHBondContact O-N 3.29Å; T125-Q129 PolarHBondContact O-N 3.38Å
126	T	60.3	Low	60	Low	86 Å²	86	115 Å²	115	53%	0.528	61%	0.608	S	S	.	*	H	α-helix	trans	-68.3	-33.8	177.3	42.8	0	0	0	0	113.3	R122 L123 C128 Q129 Q130	R122-T126 PolarHBondContact O-N 3.28Å; R122-T126 VanDerWaalsContact O-N 3.11Å; R122-T126 PolarHBondContact O-OG1 3.11Å; L123-T126 WeakPolarHBondContact CA-OG1 3.21Å; L123-T126 PolarHBondContact O-OG1 2.76Å; T126-C128 PolarHBondContact O-N 2.9Å; T126-Q129 PolarHBondContact O-N 3.37Å; T126-Q130 PolarHBondContact O-N 3.07Å; T126-Q130 VanDerWaalsContact O-N 3.12Å
127	A	59.3	Low	59.9	Low	60 Å²	60	114.8 Å²	114.8	50%	0.496	61%	0.607	S	S	.	*	H	α-helix	trans	-67.1	-36	176.8	0	0	0	0	0	112.9	L123	L123-A127 PolarHBondContact O-N 3.26Å
128	C	58.9	Low	59.6	Low	87 Å²	87	115.3 Å²	115.3	59%	0.588	61%	0.607	S	S	*	*	H	α-helix	trans	-70	-37.3	176.3	-168.8	0	0	0	0	111.8	T125 T126	T125-C128 PolarHBondContact O-N 3.29Å; T126-C128 PolarHBondContact O-N 2.9Å
129	Q	63.7	Low	59.3	Low	121 Å²	121	114.1 Å²	114.1	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-74.6	-32.2	-177.4	-162.6	162.6	67.8	0	0	113	T125 T126 Q131 Q132	T125-Q129 PolarHBondContact O-N 3.38Å; T126-Q129 PolarHBondContact O-N 3.37Å; Q129-Q131 VanDerWaalsContact C-N 3.35Å; Q129-Q132 PolarHBondContact O-N 2.67Å
130	Q	62.3	Low	58.8	Low	120 Å²	120	117.4 Å²	117.4	56%	0.561	63%	0.634	S	S	*	*	H	α-helix	trans	-69.4	-33.6	176.7	-162.1	176.3	50.4	0	0	112.1	T126 Q132 Q133	T126-Q130 PolarHBondContact O-N 3.07Å; T126-Q130 VanDerWaalsContact O-N 3.12Å; Q130-Q132 VanDerWaalsContact C-N 3.28Å; Q130-Q132 PolarHBondContact O-N 3.05Å; Q130-Q133 PolarHBondContact O-N 3.5Å
131	Q	61.1	Low	58.4	Low	121 Å²	121	120 Å²	120	57%	0.565	65%	0.648	S	S	*	*	H	α-helix	trans	-71.9	-23.3	178.9	-159.5	160.8	32.2	0	0	112.9	Q129	Q129-Q131 VanDerWaalsContact C-N 3.35Å
132	Q	61	Low	58.2	Low	155 Å²	155	121.4 Å²	121.4	72%	0.724	65%	0.645	S	S	*	*	H	α-helix	trans	-78.4	-23.2	178.5	-141	162.2	38.4	0	0	113.1	Q129 Q130	Q129-Q132 PolarHBondContact O-N 2.67Å; Q130-Q132 VanDerWaalsContact C-N 3.28Å; Q130-Q132 PolarHBondContact O-N 3.05Å
133	Q	60.9	Low	57.9	Low	149 Å²	149	116.7 Å²	116.7	70%	0.696	64%	0.637	S	S	*	*	H	α-helix	trans	-77.3	-24.6	177.1	-64.8	-177.1	38.2	0	0	112.7	Q130 A135	Q130-Q133 PolarHBondContact O-N 3.5Å; Q133-A135 VanDerWaalsContact C-N 3.35Å
134	Q	57.1	Low	57.8	Low	134 Å²	134	116.3 Å²	116.3	63%	0.626	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-82.1	-12.3	179.4	-61.1	-175.3	4.2	0	0	113.5	N136	Q134-N136 PolarHBondContact O-N 3.48Å; Q134-N136 VanDerWaalsContact O-N 3.15Å
135	A	55.2	Low	58.2	Low	76 Å²	76	112.8 Å²	112.8	63%	0.628	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-74.9	1.4	-177.5	0	0	0	0	0	114.8	Q133	Q133-A135 VanDerWaalsContact C-N 3.35Å
136	N	53.4	Low	58.8	Low	138 Å²	138	111.7 Å²	111.7	74%	0.738	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-115.3	8.6	-173.2	-148.6	-0.5	0	0	0	115.4	Q134 K138	Q134-N136 PolarHBondContact O-N 3.48Å; Q134-N136 VanDerWaalsContact O-N 3.15Å; N136-K138 VanDerWaalsContact C-N 3.34Å; N136-K138 PolarHBondContact O-N 2.9Å
137	L	52.5	Low	59.7	Low	151 Å²	151	112.5 Å²	112.5	79%	0.791	62%	0.624	S	S	*	*			trans	-94.8	69	169.7	-66.7	171.3	0	0	0	110	S139	L137-S139 PolarHBondContact O-N 3.35Å
138	K	55	Low	60.9	Low	191 Å²	191	116.2 Å²	116.2	83%	0.83	63%	0.631	S	S	*	*			trans	-74.1	79.4	165.4	-73.9	-178.1	175.5	-170.7	0	109	N136	N136-K138 VanDerWaalsContact C-N 3.34Å; N136-K138 PolarHBondContact O-N 2.9Å
139	S	50.3	Low	62	Low	89 Å²	89	120.1 Å²	120.1	62%	0.622	63%	0.633	S	S	*	*			trans	-79.6	119.3	168.9	-54.8	0	0	0	0	108.9	L137 S141	L137-S139 PolarHBondContact O-N 3.35Å; S139-S141 PolarHBondContact O-N 3.37Å; S139-S141 VanDerWaalsContact O-N 3.1Å
140	P	51.6	Low	63.1	Low	133 Å²	133	117.2 Å²	117.2	86%	0.864	62%	0.624	S	S	*	*	S	Bend	trans	-87	86.4	-170.4	34.2	-31.8	0	0	0	110.5
141	S	51.1	Low	64.4	Low	116 Å²	116	117.6 Å²	117.6	81%	0.811	63%	0.626	S	S	*	*			trans	-155.9	25.2	161.5	70.2	0	0	0	0	113.1	S139	S139-S141 PolarHBondContact O-N 3.37Å; S139-S141 VanDerWaalsContact O-N 3.1Å
142	F	54	Low	65.7	Low	113 Å²	113	117.9 Å²	117.9	50%	0.496	63%	0.627	S	S	.	*			trans	-84.1	125.3	-175.1	-133.4	-109.7	0	0	0	110.8	T146 E147 V150	F142-T146 HydrophobicContact CD1-CG2 3.98Å; F142-T146 HydrophobicContact CE1-CG2 3.22Å; F142-T146 WeakPolarHBondContact CE1-O 3.33Å; F142-T146 HydrophobicContact CE2-CG2 4.13Å; F142-T146 HydrophobicContact CZ-CG2 3.29Å; F142-E147 HydrophobicContact CB-CG 4.09Å; F142-E147 HydrophobicContact CD1-CB 4.18Å; F142-E147 HydrophobicContact CD1-CG 3.41Å; F142-E147 VanDerWaalsContact CD1-CG 3.41Å; F142-E147 HydrophobicContact CE1-CG 4.23Å; F142-E147 HydrophobicContact CG-CG 4.19Å; F142-V150 HydrophobicContact CE1-CG2 3.78Å; F142-V150 HydrophobicContact CZ-CG2 3.82Å
143	C	58.6	Low	67.1	Low	65 Å²	65	114.7 Å²	114.7	44%	0.439	62%	0.615	S	S	.	*			trans	-61	135.6	169.5	165.3	0	0	0	0	109.1	S145 T146 E147	C143-S145 PolarHBondContact O-N 2.93Å; C143-S145 VanDerWaalsContact O-N 3.11Å; C143-S145 VanDerWaalsContact SG-CB 3.58Å; C143-S145 PolarHBondContact SG-N 3.12Å; C143-S145 VanDerWaalsContact SG-N 3.41Å; C143-T146 WeakPolarHBondContact O-CB 3.31Å; C143-T146 PolarHBondContact O-N 3.44Å; C143-E147 PolarHBondContact O-N 3.45Å; C143-E147 VanDerWaalsContact O-N 3.16Å
144	P	62.8	Low	68.3	Low	96 Å²	96	111.9 Å²	111.9	62%	0.623	60%	0.603	S	S	*	*	H	α-helix	trans	-58.9	-27.1	180	22.7	-33.4	0	0	0	112.9	T146 E147 Q148	P144-T146 VanDerWaalsContact C-N 3.34Å; P144-E147 PolarHBondContact O-N 3.37Å; P144-Q148 PolarHBondContact O-N 3.09Å
145	S	71.8	Confident	70	Confident	81 Å²	81	111.1 Å²	111.1	57%	0.566	60%	0.6	S	S	*	*	H	α-helix	trans	-67.5	-33.9	174	179.3	0	0	0	0	112.5	C143 R149	C143-S145 PolarHBondContact O-N 2.93Å; C143-S145 VanDerWaalsContact O-N 3.11Å; C143-S145 VanDerWaalsContact SG-CB 3.58Å; C143-S145 PolarHBondContact SG-N 3.12Å; C143-S145 VanDerWaalsContact SG-N 3.41Å; S145-R149 PolarHBondContact O-N 2.83Å
146	T	74.5	Confident	71.7	Confident	64 Å²	64	111.8 Å²	111.8	39%	0.393	59%	0.59	S	S	.	*	H	α-helix	trans	-74.9	-36.9	176.6	-41	0	0	0	0	110.3	F142 C143 P144 Q148 R149 V150	F142-T146 HydrophobicContact CD1-CG2 3.98Å; F142-T146 HydrophobicContact CE1-CG2 3.22Å; F142-T146 WeakPolarHBondContact CE1-O 3.33Å; F142-T146 HydrophobicContact CE2-CG2 4.13Å; F142-T146 HydrophobicContact CZ-CG2 3.29Å; C143-T146 WeakPolarHBondContact O-CB 3.31Å; C143-T146 PolarHBondContact O-N 3.44Å; P144-T146 VanDerWaalsContact C-N 3.34Å; T146-Q148 PolarHBondContact O-N 3Å; T146-R149 PolarHBondContact O-N 3.06Å; T146-V150 WeakPolarHBondContact O-CG2 3.37Å; T146-V150 PolarHBondContact O-N 2.66Å
147	E	78.2	Confident	73.4	Confident	102 Å²	102	113.4 Å²	113.4	48%	0.477	59%	0.586	S	S	.	*	H	α-helix	trans	-60.6	-44	176.9	-71.6	-162.9	113.6	0	0	111.6	F142 C143 P144 R149 V150 Q151	F142-E147 HydrophobicContact CB-CG 4.09Å; F142-E147 HydrophobicContact CD1-CB 4.18Å; F142-E147 HydrophobicContact CD1-CG 3.41Å; F142-E147 VanDerWaalsContact CD1-CG 3.41Å; F142-E147 HydrophobicContact CE1-CG 4.23Å; F142-E147 HydrophobicContact CG-CG 4.19Å; C143-E147 PolarHBondContact O-N 3.45Å; C143-E147 VanDerWaalsContact O-N 3.16Å; P144-E147 PolarHBondContact O-N 3.37Å; E147-R149 VanDerWaalsContact C-N 3.34Å; E147-R149 PolarHBondContact O-N 3.39Å; E147-V150 PolarHBondContact O-N 3.11Å; E147-Q151 WeakPolarHBondContact O-CG 3.48Å; E147-Q151 PolarHBondContact O-N 3.45Å
148	Q	83.9	Confident	75	Confident	139 Å²	139	112.4 Å²	112.4	65%	0.65	58%	0.577	S	S	*	*	H	α-helix	trans	-61.3	-43.5	176.9	-73.4	-171.6	-39.9	0	0	111.8	P144 T146 V150 Q151 E152	P144-Q148 PolarHBondContact O-N 3.09Å; T146-Q148 PolarHBondContact O-N 3Å; Q148-V150 VanDerWaalsContact C-N 3.33Å; Q148-V150 PolarHBondContact O-N 2.92Å; Q148-Q151 PolarHBondContact O-N 3.06Å; Q148-E152 PolarHBondContact O-N 2.7Å
149	R	84	Confident	76.8	Confident	168 Å²	168	109.2 Å²	109.2	63%	0.634	57%	0.565	S	S	*	*	H	α-helix	trans	-65.3	-37.2	177.5	-175.1	144.6	-170.5	159.2	3.9	112.6	S145 T146 E147 E152 L153	S145-R149 PolarHBondContact O-N 2.83Å; T146-R149 PolarHBondContact O-N 3.06Å; E147-R149 VanDerWaalsContact C-N 3.34Å; E147-R149 PolarHBondContact O-N 3.39Å; R149-E152 PolarHBondContact O-N 2.68Å; R149-L153 HydrophobicContact CG-CD1 4.19Å; R149-L153 WeakPolarHBondContact O-CB 3.41Å; R149-L153 VanDerWaalsContact O-CG 3.28Å; R149-L153 WeakPolarHBondContact O-CG 3.28Å; R149-L153 PolarHBondContact O-N 3.1Å
150	V	86.2	Confident	78.3	Confident	60 Å²	60	111.4 Å²	111.4	36%	0.364	56%	0.56	S	S	.	*	H	α-helix	trans	-64.9	-42.1	174.1	171.4	0	0	0	0	110.7	F142 T146 E147 Q148 L153 I154	F142-V150 HydrophobicContact CE1-CG2 3.78Å; F142-V150 HydrophobicContact CZ-CG2 3.82Å; T146-V150 WeakPolarHBondContact O-CG2 3.37Å; T146-V150 PolarHBondContact O-N 2.66Å; E147-V150 PolarHBondContact O-N 3.11Å; Q148-V150 VanDerWaalsContact C-N 3.33Å; Q148-V150 PolarHBondContact O-N 2.92Å; V150-L153 PolarHBondContact O-N 3.39Å; V150-I154 HydrophobicContact CG1-CD1 3.8Å; V150-I154 HydrophobicContact CG1-CG1 4.47Å; V150-I154 WeakPolarHBondContact O-CD1 2.88Å; V150-I154 WeakPolarHBondContact O-CG1 3.2Å; V150-I154 PolarHBondContact O-N 3.15Å
151	Q	88.4	Confident	79.9	Confident	128 Å²	128	113.3 Å²	113.3	60%	0.598	55%	0.55	S	S	*	*	H	α-helix	trans	-63	-41.5	175.5	-72.4	177.2	28.6	0	0	112.3	E147 Q148 I154 Q155	E147-Q151 WeakPolarHBondContact O-CG 3.48Å; E147-Q151 PolarHBondContact O-N 3.45Å; Q148-Q151 PolarHBondContact O-N 3.06Å; Q151-I154 PolarHBondContact O-N 3.1Å; Q151-Q155 WeakPolarHBondContact O-CB 3.48Å; Q151-Q155 PolarHBondContact O-N 3.46Å
152	E	89.2	Confident	81.6	Confident	128 Å²	128	111.1 Å²	111.1	60%	0.598	54%	0.535	S	S	*	.	H	α-helix	trans	-61.8	-46	175.6	-171.7	178.1	-167.7	0	0	111.4	Q148 R149 I154 Q155 E156	Q148-E152 PolarHBondContact O-N 2.7Å; R149-E152 PolarHBondContact O-N 2.68Å; E152-I154 VanDerWaalsContact C-N 3.33Å; E152-I154 PolarHBondContact O-N 3.04Å; E152-Q155 PolarHBondContact O-N 3.25Å; E152-E156 WeakPolarHBondContact O-CB 3.42Å; E152-E156 PolarHBondContact O-N 3.34Å
153	L	89.8	Confident	83.1	Confident	88 Å²	88	113.5 Å²	113.5	46%	0.461	54%	0.541	S	S	.	.	H	α-helix	trans	-62.8	-37.4	176	-73.8	167.8	0	0	0	112.5	R149 V150 R157	R149-L153 HydrophobicContact CG-CD1 4.19Å; R149-L153 WeakPolarHBondContact O-CB 3.41Å; R149-L153 VanDerWaalsContact O-CG 3.28Å; R149-L153 WeakPolarHBondContact O-CG 3.28Å; R149-L153 PolarHBondContact O-N 3.1Å; V150-L153 PolarHBondContact O-N 3.39Å; L153-R157 VanDerWaalsContact O-CB 3.31Å; L153-R157 WeakPolarHBondContact O-CB 3.35Å; L153-R157 PolarHBondContact O-N 3.05Å
154	I	87.7	Confident	84.4	Confident	89 Å²	89	115.5 Å²	115.5	46%	0.456	54%	0.544	S	S	.	.	H	α-helix	trans	-65.7	-44.4	174.9	-69.5	164.2	0	0	0	110.3	V150 Q151 E152 R157 Q158	V150-I154 HydrophobicContact CG1-CD1 3.8Å; V150-I154 HydrophobicContact CG1-CG1 4.47Å; V150-I154 WeakPolarHBondContact O-CD1 2.88Å; V150-I154 WeakPolarHBondContact O-CG1 3.2Å; V150-I154 PolarHBondContact O-N 3.15Å; Q151-I154 PolarHBondContact O-N 3.1Å; E152-I154 VanDerWaalsContact C-N 3.33Å; E152-I154 PolarHBondContact O-N 3.04Å; I154-R157 PolarHBondContact O-N 2.95Å; I154-Q158 WeakPolarHBondContact O-CG 3.48Å; I154-Q158 PolarHBondContact O-N 2.84Å
155	Q	92.8	Very high	85.4	Confident	118 Å²	118	115.1 Å²	115.1	55%	0.551	53%	0.534	S	S	*	.	H	α-helix	trans	-65	-45.4	178.4	-174.1	177	24	0	0	111.6	Q151 E152 R157 Q158 Q159	Q151-Q155 WeakPolarHBondContact O-CB 3.48Å; Q151-Q155 PolarHBondContact O-N 3.46Å; E152-Q155 PolarHBondContact O-N 3.25Å; Q155-R157 PolarHBondContact O-N 2.88Å; Q155-Q158 WeakPolarHBondContact O-CB 3.48Å; Q155-Q158 PolarHBondContact O-N 3.03Å; Q155-Q159 WeakPolarHBondContact O-CG 2.99Å; Q155-Q159 PolarHBondContact O-N 2.63Å
156	E	89.3	Confident	85.9	Confident	90 Å²	90	116.3 Å²	116.3	42%	0.421	53%	0.53	S	S	.	.	H	α-helix	trans	-58.4	-48.8	176.2	-177.8	177.4	-130.4	0	0	110.4	E152 Q158 Q159 Y160	E152-E156 WeakPolarHBondContact O-CB 3.42Å; E152-E156 PolarHBondContact O-N 3.34Å; E156-Q158 VanDerWaalsContact C-N 3.28Å; E156-Q158 PolarHBondContact O-N 2.75Å; E156-Q159 WeakPolarHBondContact O-CB 3.45Å; E156-Q159 PolarHBondContact O-N 3.3Å; E156-Q159 VanDerWaalsContact O-N 3.09Å; E156-Y160 HydrophobicContact CG-CD2 3.73Å; E156-Y160 HydrophobicContact CG-CE2 3.61Å; E156-Y160 VanDerWaalsContact O-CD2 3.32Å; E156-Y160 WeakPolarHBondContact O-CD2 3.22Å; E156-Y160 PolarHBondContact O-N 2.75Å
157	R	88.8	Confident	86.1	Confident	173 Å²	173	116.9 Å²	116.9	65%	0.653	53%	0.53	S	S	*	.	H	α-helix	trans	-57.5	-40.4	176.2	-172.2	-179.4	-173.7	-170.3	2.3	112.3	L153 I154 Q155 R161	L153-R157 VanDerWaalsContact O-CB 3.31Å; L153-R157 WeakPolarHBondContact O-CB 3.35Å; L153-R157 PolarHBondContact O-N 3.05Å; I154-R157 PolarHBondContact O-N 2.95Å; Q155-R157 PolarHBondContact O-N 2.88Å; R157-R161 WeakPolarHBondContact O-CB 3.26Å; R157-R161 PolarHBondContact O-N 3.24Å
158	Q	87.9	Confident	85.9	Confident	130 Å²	130	116.8 Å²	116.8	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-65.9	-41.9	176.1	-73.4	-174	14	0	0	112.1	I154 Q155 E156 R161 S162	I154-Q158 WeakPolarHBondContact O-CG 3.48Å; I154-Q158 PolarHBondContact O-N 2.84Å; Q155-Q158 WeakPolarHBondContact O-CB 3.48Å; Q155-Q158 PolarHBondContact O-N 3.03Å; E156-Q158 VanDerWaalsContact C-N 3.28Å; E156-Q158 PolarHBondContact O-N 2.75Å; Q158-R161 PolarHBondContact O-N 2.85Å; Q158-S162 PolarHBondContact O-N 3.13Å
159	Q	90.8	Very high	85.6	Confident	123 Å²	123	116.5 Å²	116.5	58%	0.575	53%	0.529	S	S	*	.	H	α-helix	trans	-61.8	-46.5	175.9	-74.4	-176.7	-6.2	0	0	111.7	Q155 E156 R161 S162 R163	Q155-Q159 WeakPolarHBondContact O-CG 2.99Å; Q155-Q159 PolarHBondContact O-N 2.63Å; E156-Q159 WeakPolarHBondContact O-CB 3.45Å; E156-Q159 PolarHBondContact O-N 3.3Å; E156-Q159 VanDerWaalsContact O-N 3.09Å; Q159-R161 VanDerWaalsContact C-N 3.31Å; Q159-R161 PolarHBondContact O-N 2.73Å; Q159-S162 PolarHBondContact O-N 3.37Å; Q159-R163 WeakPolarHBondContact O-CB 3.14Å; Q159-R163 PolarHBondContact O-N 3.43Å
160	Y	82.4	Confident	84.8	Confident	136 Å²	136	112.6 Å²	112.6	53%	0.533	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-43.9	174.9	-87.1	-82.4	0	0	0	111.3	E156 S162 R163 Q164	E156-Y160 HydrophobicContact CG-CD2 3.73Å; E156-Y160 HydrophobicContact CG-CE2 3.61Å; E156-Y160 VanDerWaalsContact O-CD2 3.32Å; E156-Y160 WeakPolarHBondContact O-CD2 3.22Å; E156-Y160 PolarHBondContact O-N 2.75Å; Y160-S162 PolarHBondContact O-N 3.33Å; Y160-R163 PolarHBondContact O-N 3.01Å; Y160-Q164 WeakPolarHBondContact O-CB 3.33Å; Y160-Q164 WeakPolarHBondContact O-CG 3.27Å; Y160-Q164 PolarHBondContact O-N 3.31Å
161	R	86.6	Confident	83.5	Confident	172 Å²	172	113.4 Å²	113.4	65%	0.649	52%	0.523	S	S	*	.	H	α-helix	trans	-60.1	-44.9	176.8	-168.6	179.8	-167.5	-113.8	3.4	112.2	R157 Q158 Q159 Q164 Q165	R157-R161 WeakPolarHBondContact O-CB 3.26Å; R157-R161 PolarHBondContact O-N 3.24Å; Q158-R161 PolarHBondContact O-N 2.85Å; Q159-R161 VanDerWaalsContact C-N 3.31Å; Q159-R161 PolarHBondContact O-N 2.73Å; R161-Q164 PolarHBondContact O-N 2.79Å; R161-Q165 WeakPolarHBondContact O-CG 3.46Å; R161-Q165 PolarHBondContact O-N 2.74Å; R161-Q165 VanDerWaalsContact O-N 3.12Å
162	S	85	Confident	81.9	Confident	71 Å²	71	114.1 Å²	114.1	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.1	-169.1	0	0	0	0	111.4	Q158 Q159 Y160 Q164 Q165 E166	Q158-S162 PolarHBondContact O-N 3.13Å; Q159-S162 PolarHBondContact O-N 3.37Å; Y160-S162 PolarHBondContact O-N 3.33Å; S162-Q164 VanDerWaalsContact C-N 3.35Å; S162-Q164 PolarHBondContact O-N 3.27Å; S162-Q165 PolarHBondContact O-N 3.18Å; S162-E166 PolarHBondContact O-N 3.06Å
163	R	87.2	Confident	80.1	Confident	162 Å²	162	111.1 Å²	111.1	61%	0.611	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-39.4	178.6	-168.5	179.1	-168.5	-160.2	2.1	112.1	Q159 Y160 E166 I167	Q159-R163 WeakPolarHBondContact O-CB 3.14Å; Q159-R163 PolarHBondContact O-N 3.43Å; Y160-R163 PolarHBondContact O-N 3.01Å; R163-E166 PolarHBondContact O-N 2.93Å; R163-I167 HydrophobicContact CG-CD1 4.04Å; R163-I167 HydrophobicContact CG-CG1 4.49Å; R163-I167 WeakPolarHBondContact O-CB 3.36Å; R163-I167 VanDerWaalsContact O-CG1 3.26Å; R163-I167 WeakPolarHBondContact O-CG1 3.24Å; R163-I167 PolarHBondContact O-N 2.68Å
164	Q	86	Confident	78.1	Confident	108 Å²	108	115.2 Å²	115.2	51%	0.505	53%	0.53	S	S	.	.	H	α-helix	trans	-61.8	-44.3	174.4	-71.3	-68.5	-53.1	0	0	111.1	Y160 R161 S162 E166 I167 L168	Y160-Q164 WeakPolarHBondContact O-CB 3.33Å; Y160-Q164 WeakPolarHBondContact O-CG 3.27Å; Y160-Q164 PolarHBondContact O-N 3.31Å; R161-Q164 PolarHBondContact O-N 2.79Å; S162-Q164 VanDerWaalsContact C-N 3.35Å; S162-Q164 PolarHBondContact O-N 3.27Å; Q164-E166 VanDerWaalsContact C-N 3.32Å; Q164-E166 PolarHBondContact O-N 2.93Å; Q164-I167 PolarHBondContact O-N 2.67Å; Q164-L168 WeakPolarHBondContact O-CB 3.45Å; Q164-L168 VanDerWaalsContact O-CG 3.25Å; Q164-L168 WeakPolarHBondContact O-CG 2.97Å; Q164-L168 PolarHBondContact O-N 2.83Å
165	Q	82.9	Confident	76.4	Confident	87 Å²	87	115.5 Å²	115.5	41%	0.407	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-37.6	174.9	-70.6	-177.9	5.4	0	0	112.5	R161 S162 L168 K169	R161-Q165 WeakPolarHBondContact O-CG 3.46Å; R161-Q165 PolarHBondContact O-N 2.74Å; R161-Q165 VanDerWaalsContact O-N 3.12Å; S162-Q165 PolarHBondContact O-N 3.18Å; Q165-L168 PolarHBondContact O-N 2.85Å; Q165-K169 VanDerWaalsContact O-CB 3.3Å; Q165-K169 WeakPolarHBondContact O-CB 3.47Å; Q165-K169 WeakPolarHBondContact O-CG 3.4Å; Q165-K169 PolarHBondContact O-N 3.45Å
166	E	82.4	Confident	74.1	Confident	107 Å²	107	117.2 Å²	117.2	50%	0.5	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-43.3	176.5	-170.3	-177.8	173.1	0	0	111.7	S162 R163 Q164 L168 K169 Q170	S162-E166 PolarHBondContact O-N 3.06Å; R163-E166 PolarHBondContact O-N 2.93Å; Q164-E166 VanDerWaalsContact C-N 3.32Å; Q164-E166 PolarHBondContact O-N 2.93Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 2.74Å; E166-K169 PolarHBondContact O-N 2.81Å; E166-Q170 HydrophobicContact CG-CG 4.43Å; E166-Q170 VanDerWaalsContact O-CB 3.28Å; E166-Q170 WeakPolarHBondContact O-CB 3.4Å; E166-Q170 VanDerWaalsContact O-CG 3.25Å; E166-Q170 WeakPolarHBondContact O-CG 3.03Å; E166-Q170 PolarHBondContact O-N 3.29Å; E166-Q170 PolarHBondContact OE1-NE2 2.91Å; E166-Q170 VanDerWaalsContact OE1-NE2 3.09Å
167	I	78.2	Confident	72.1	Confident	75 Å²	75	118.9 Å²	118.9	39%	0.385	56%	0.562	S	S	.	*	H	α-helix	trans	-60.6	-45.2	174.2	-68.8	164.7	0	0	0	109.9	R163 Q164 Q170 T171	R163-I167 HydrophobicContact CG-CD1 4.04Å; R163-I167 HydrophobicContact CG-CG1 4.49Å; R163-I167 WeakPolarHBondContact O-CB 3.36Å; R163-I167 VanDerWaalsContact O-CG1 3.26Å; R163-I167 WeakPolarHBondContact O-CG1 3.24Å; R163-I167 PolarHBondContact O-N 2.68Å; Q164-I167 PolarHBondContact O-N 2.67Å; I167-Q170 CarbonylContact O-C 3.56Å; I167-Q170 PolarHBondContact O-N 3.2Å; I167-T171 HydrophobicContact CG2-CG2 4.48Å; I167-T171 WeakPolarHBondContact O-CG2 3.43Å; I167-T171 PolarHBondContact O-N 2.81Å; I167-T171 PolarHBondContact O-OG1 3.02Å; I167-T171 VanDerWaalsContact O-OG1 3.11Å
168	L	75	Confident	69.9	Low	101 Å²	101	118.9 Å²	118.9	53%	0.529	57%	0.571	S	S	.	*	H	α-helix	trans	-62.1	-46.3	177.1	-72.7	169.9	0	0	0	111.9	Q164 Q165 E166 Q170 T171 E172	Q164-L168 WeakPolarHBondContact O-CB 3.45Å; Q164-L168 VanDerWaalsContact O-CG 3.25Å; Q164-L168 WeakPolarHBondContact O-CG 2.97Å; Q164-L168 PolarHBondContact O-N 2.83Å; Q165-L168 PolarHBondContact O-N 2.85Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 2.74Å; L168-Q170 VanDerWaalsContact C-N 3.32Å; L168-Q170 PolarHBondContact O-N 2.83Å; L168-T171 VanDerWaalsContact CA-OG1 3.27Å; L168-T171 WeakPolarHBondContact CA-OG1 2.97Å; L168-T171 PolarHBondContact O-N 2.82Å; L168-T171 PolarHBondContact O-OG1 2.86Å; L168-E172 WeakPolarHBondContact O-CG 3.41Å; L168-E172 PolarHBondContact O-N 3.34Å
169	K	77.6	Confident	67.9	Low	132 Å²	132	118.6 Å²	118.6	57%	0.574	58%	0.578	S	S	*	*	H	α-helix	trans	-62.5	-39.4	174.8	-76.3	175.2	178.2	-171.1	0	111.9	Q165 E166 E172 S173	Q165-K169 VanDerWaalsContact O-CB 3.3Å; Q165-K169 WeakPolarHBondContact O-CB 3.47Å; Q165-K169 WeakPolarHBondContact O-CG 3.4Å; Q165-K169 PolarHBondContact O-N 3.45Å; E166-K169 PolarHBondContact O-N 2.81Å; K169-E172 PolarHBondContact O-N 2.93Å; K169-S173 WeakPolarHBondContact O-CB 3.25Å; K169-S173 PolarHBondContact O-N 2.76Å; K169-S173 PolarHBondContact O-OG 2.8Å
170	Q	65.8	Low	65.4	Low	86 Å²	86	120.2 Å²	120.2	40%	0.402	59%	0.591	S	S	.	*	H	α-helix	trans	-65.6	-45	174.1	-76.1	-179.5	22.4	0	0	109.8	E166 I167 L168 E172 S173 Y174	E166-Q170 HydrophobicContact CG-CG 4.43Å; E166-Q170 VanDerWaalsContact O-CB 3.28Å; E166-Q170 WeakPolarHBondContact O-CB 3.4Å; E166-Q170 VanDerWaalsContact O-CG 3.25Å; E166-Q170 WeakPolarHBondContact O-CG 3.03Å; E166-Q170 PolarHBondContact O-N 3.29Å; E166-Q170 PolarHBondContact OE1-NE2 2.91Å; E166-Q170 VanDerWaalsContact OE1-NE2 3.09Å; I167-Q170 CarbonylContact O-C 3.56Å; I167-Q170 PolarHBondContact O-N 3.2Å; L168-Q170 VanDerWaalsContact C-N 3.32Å; L168-Q170 PolarHBondContact O-N 2.83Å; Q170-E172 VanDerWaalsContact C-N 3.31Å; Q170-E172 PolarHBondContact O-N 3.34Å; Q170-S173 CarbonylContact O-C 3.48Å; Q170-S173 PolarHBondContact O-N 3.23Å; Q170-S173 VanDerWaalsContact O-N 3.07Å; Q170-Y174 HydrophobicContact CB-CD2 4.09Å; Q170-Y174 HydrophobicContact CB-CE2 4.39Å; Q170-Y174 VanDerWaalsContact O-CB 3.25Å; Q170-Y174 WeakPolarHBondContact O-CB 3.27Å; Q170-Y174 WeakPolarHBondContact O-CD2 3.37Å; Q170-Y174 PolarHBondContact O-N 3.08Å
171	T	60.1	Low	63.5	Low	78 Å²	78	120.5 Å²	120.5	48%	0.479	60%	0.601	S	S	.	*	H	α-helix	trans	-62.6	-37	176.3	48.9	0	0	0	0	112.4	I167 L168 S175	I167-T171 HydrophobicContact CG2-CG2 4.48Å; I167-T171 WeakPolarHBondContact O-CG2 3.43Å; I167-T171 PolarHBondContact O-N 2.81Å; I167-T171 PolarHBondContact O-OG1 3.02Å; I167-T171 VanDerWaalsContact O-OG1 3.11Å; L168-T171 VanDerWaalsContact CA-OG1 3.27Å; L168-T171 WeakPolarHBondContact CA-OG1 2.97Å; L168-T171 PolarHBondContact O-N 2.82Å; L168-T171 PolarHBondContact O-OG1 2.86Å; T171-S175 WeakPolarHBondContact O-CB 2.98Å; T171-S175 PolarHBondContact O-N 2.78Å
172	E	53.7	Low	61.4	Low	143 Å²	143	118.7 Å²	118.7	67%	0.668	61%	0.61	S	S	*	*	H	α-helix	trans	-69.1	-34.9	172.5	-72.5	179.5	169.5	0	0	111.9	L168 K169 Q170	L168-E172 WeakPolarHBondContact O-CG 3.41Å; L168-E172 PolarHBondContact O-N 3.34Å; K169-E172 PolarHBondContact O-N 2.93Å; Q170-E172 VanDerWaalsContact C-N 3.31Å; Q170-E172 PolarHBondContact O-N 3.34Å
173	S	52.9	Low	59.7	Low	65 Å²	65	122.5 Å²	122.5	46%	0.455	62%	0.62	S	S	.	*	H	α-helix	trans	-78.3	-29.8	177.4	-54.9	0	0	0	0	113.2	K169 Q170 N177	K169-S173 WeakPolarHBondContact O-CB 3.25Å; K169-S173 PolarHBondContact O-N 2.76Å; K169-S173 PolarHBondContact O-OG 2.8Å; Q170-S173 CarbonylContact O-C 3.48Å; Q170-S173 PolarHBondContact O-N 3.23Å; Q170-S173 VanDerWaalsContact O-N 3.07Å; S173-N177 PolarHBondContact O-ND2 3.45Å
174	Y	47.7	Very low	57.4	Low	174 Å²	174	124.9 Å²	124.9	68%	0.682	63%	0.63	S	S	*	*	H	α-helix	trans	-85.2	-14.7	177.5	-86.6	-81.8	0	0	0	112.1	Q170	Q170-Y174 HydrophobicContact CB-CD2 4.09Å; Q170-Y174 HydrophobicContact CB-CE2 4.39Å; Q170-Y174 VanDerWaalsContact O-CB 3.25Å; Q170-Y174 WeakPolarHBondContact O-CB 3.27Å; Q170-Y174 WeakPolarHBondContact O-CD2 3.37Å; Q170-Y174 PolarHBondContact O-N 3.08Å
175	S	51.1	Low	55.9	Low	94 Å²	94	128.6 Å²	128.6	66%	0.657	65%	0.647	S	S	*	*	S	Bend	trans	-83	-10	173	-171.1	0	0	0	0	114.2	T171	T171-S175 WeakPolarHBondContact O-CB 2.98Å; T171-S175 PolarHBondContact O-N 2.78Å
176	M	44.1	Very low	54.4	Low	155 Å²	155	129.7 Å²	129.7	76%	0.764	67%	0.665	S	S	*	*	S	Bend	trans	-133.7	12.4	-173.8	-72.5	-64	-114.4	0	0	116.3
177	N	47.1	Very low	53.2	Low	124 Å²	124	134.8 Å²	134.8	66%	0.663	68%	0.679	S	S	*	*			trans	-133.7	42.3	-177.5	-63.5	-64	0	0	0	114.3	S173 V179	S173-N177 PolarHBondContact O-ND2 3.45Å; N177-V179 VanDerWaalsContact C-N 3.27Å; N177-V179 PolarHBondContact O-N 2.8Å
178	M	42.9	Very low	51.9	Low	174 Å²	174	140.1 Å²	140.1	86%	0.857	70%	0.702	S	S	*	*	S	Bend	trans	-87.1	14.9	172.6	-80.6	-79.5	-166	0	0	113.7
179	V	46	Very low	50.9	Low	124 Å²	124	143.3 Å²	143.3	75%	0.752	71%	0.712	S	S	*	*	S	Bend	trans	-143.9	119	-179.1	-98.1	0	0	0	0	110	N177	N177-V179 VanDerWaalsContact C-N 3.27Å; N177-V179 PolarHBondContact O-N 2.8Å
180	D	39.4	Very low	49.9	Very low	157 Å²	157	142.4 Å²	142.4	84%	0.84	72%	0.722	S	S	*	*			trans	46.8	99.2	164.1	-86.2	-22.7	0	0	0	118.4
181	N	42.5	Very low	49.1	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	74%	0.743	S	S	*	*				-171.8	131.6	112.6	-118.8	-18.5	0	0	0	113.7	E183	N181-E183 PolarHBondContact O-N 3.08Å
182	T	41.5	Very low	48.7	Very low	135 Å²	135	147.3 Å²	147.3	83%	0.828	76%	0.757	S	S	*	*			trans	-70.1	90.1	169.9	46.4	0	0	0	0	111.2
183	E	48.7	Very low	48.8	Very low	150 Å²	150	146 Å²	146	70%	0.701	76%	0.763	S	S	*	*			trans	-155.9	107.8	170.5	-143.5	153.1	179.6	0	0	115.1	N181	N181-E183 PolarHBondContact O-N 3.08Å
184	Y	39.2	Very low	48.6	Very low	212 Å²	212	146.6 Å²	146.6	83%	0.831	78%	0.78	S	S	*	*			trans	35.6	91.2	148.1	-82.9	-96.3	0	0	0	118.6
185	H	54.2	Low	48.7	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.866	79%	0.79	S	S	*	*			trans	-102.3	97.7	154.6	-68.4	-27.6	0	0	0	110	R187	H185-R187 PolarHBondContact O-N 2.86Å
186	S	52.8	Low	48.6	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	79%	0.793	S	S	*	*			trans	-48.4	108.5	168.7	-68.4	0	0	0	0	110.1	Q188	S186-Q188 PolarHBondContact O-N 3.44Å
187	R	57.7	Low	48.8	Very low	213 Å²	213	145.4 Å²	145.4	80%	0.804	80%	0.799	S	S	*	*			trans	-50.9	103.1	168.7	-75.5	171.8	157.7	-106.2	2.9	109.5	H185 K189	H185-R187 PolarHBondContact O-N 2.86Å; R187-K189 HydrophobicContact CB-CG 4.37Å; R187-K189 PolarHBondContact O-N 3.31Å; R187-K189 VanDerWaalsContact O-N 3.14Å
188	Q	50.4	Low	48.9	Very low	188 Å²	188	145.6 Å²	145.6	88%	0.879	81%	0.805	S	S	*	*			trans	-78.9	98.8	167.4	-156.7	159.4	-56.8	0	0	107.7	S186 S190	S186-Q188 PolarHBondContact O-N 3.44Å; Q188-S190 PolarHBondContact O-N 2.76Å
189	K	53.1	Low	48.9	Very low	168 Å²	168	145.4 Å²	145.4	73%	0.73	81%	0.807	S	S	*	*			trans	-85.2	101	175.3	-34.2	179.1	-172.2	-166	0	106.4	R187	R187-K189 HydrophobicContact CB-CG 4.37Å; R187-K189 PolarHBondContact O-N 3.31Å; R187-K189 VanDerWaalsContact O-N 3.14Å
190	S	56.8	Low	48.8	Very low	112 Å²	112	144.7 Å²	144.7	78%	0.783	81%	0.807	S	S	*	*			trans	-97.7	90.4	163.4	46.8	0	0	0	0	107.9	Q188	Q188-S190 PolarHBondContact O-N 2.76Å
191	C	48.4	Very low	48.8	Very low	125 Å²	125	143 Å²	143	85%	0.845	81%	0.807	S	S	*	*			trans	-78.6	106	158	-61.4	0	0	0	0	106.5
192	D	51.5	Low	48.7	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	80%	0.802	S	S	*	*			trans	-146.8	103.8	160.7	-155.7	9.8	0	0	0	111.6
193	S	56.1	Low	48.6	Very low	114 Å²	114	138 Å²	138	80%	0.797	80%	0.797	S	S	*	*			trans	54.5	109.4	140.4	-55.3	0	0	0	0	121
194	G	49.2	Very low	48.6	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	80%	0.801	S	S	*	*			trans	-174.4	23	159.1	0	0	0	0	0	115.6	G196	G194-G196 PolarHBondContact O-N 3.48Å
195	V	50.8	Low	49.2	Very low	148 Å²	148	134.5 Å²	134.5	90%	0.897	80%	0.799	S	S	*	*			trans	-81.5	93	173.4	-76.9	0	0	0	0	110.1
196	G	47.8	Very low	49.4	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	80%	0.799	S	S	*	*			trans	-106.5	89.9	167.9	0	0	0	0	0	110.4	G194 T198	G194-G196 PolarHBondContact O-N 3.48Å; G196-T198 PolarHBondContact O-N 3.27Å
197	M	48.7	Very low	49.5	Very low	180 Å²	180	135.1 Å²	135.1	89%	0.887	80%	0.8	S	S	*	*			trans	-66.7	114.4	177.8	-67.3	-84.8	-81.2	0	0	111
198	T	48.9	Very low	48.6	Very low	127 Å²	127	134.1 Å²	134.1	78%	0.779	81%	0.805	S	S	*	*			trans	-133.1	95.2	160.5	65.7	0	0	0	0	111	G196	G196-T198 PolarHBondContact O-N 3.27Å
199	L	42.4	Very low	48.8	Very low	171 Å²	171	131 Å²	131	90%	0.895	80%	0.799	S	S	*	*			trans	45.9	129.6	131.1	-56.3	171.8	0	0	0	120.1
200	S	43.9	Very low	48.7	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	80%	0.798	S	S	*	*			trans	94.6	95.5	146.3	-150.6	0	0	0	0	117.3
201	S	39.6	Very low	48.4	Very low	122 Å²	122	132.4 Å²	132.4	85%	0.853	81%	0.805	S	S	*	*				51.3	110.9	125.3	-53	0	0	0	0	118.7
202	G	40.2	Very low	48.2	Very low	62 Å²	62	133 Å²	133	64%	0.639	80%	0.8	S	S	*	*			trans	124.8	92.6	159.4	0	0	0	0	0	111.6
203	C	41.4	Very low	48.3	Very low	108 Å²	108	135.4 Å²	135.4	73%	0.73	80%	0.804	S	S	*	*				89.1	136.9	85.5	66.2	0	0	0	0	113.5
204	F	47.3	Very low	48	Very low	179 Å²	179	138.4 Å²	138.4	79%	0.785	81%	0.81	S	S	*	*			trans	97	85.1	164.9	-59.1	-75.1	0	0	0	119.9
205	S	52	Low	47.8	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	80%	0.802	S	S	*	*				47.4	104.6	118.1	-51.9	0	0	0	0	119.5
206	Q	58.5	Low	47.7	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.883	79%	0.791	S	S	*	*			trans	-70.5	133	163.4	-160.2	171.7	-18.6	0	0	110.1	Q208	Q206-Q208 PolarHBondContact O-N 3.08Å
207	P	54.1	Low	47.6	Very low	121 Å²	121	140.1 Å²	140.1	79%	0.786	80%	0.797	S	S	*	*			trans	-73	127.5	-177	27.6	-32.2	0	0	0	111.3
208	Q	40.7	Very low	47.9	Very low	192 Å²	192	137.6 Å²	137.6	90%	0.897	79%	0.786	S	S	*	*			trans	-87.4	115.7	178.4	-161.2	167.5	1.2	0	0	108.9	Q206	Q206-Q208 PolarHBondContact O-N 3.08Å
209	T	54	Low	48	Very low	123 Å²	123	140.7 Å²	140.7	76%	0.755	79%	0.792	S	S	*	*			trans	-80.4	126	175.4	48.9	0	0	0	0	110
210	P	50.8	Low	48.8	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	78%	0.782	S	S	*	*			trans	-70.6	139.1	179.5	27.2	-32.6	0	0	0	112	N212	P210-N212 PolarHBondContact O-N 2.86Å
211	E	49.6	Very low	49.1	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	78%	0.782	S	S	*	*	S	Bend	trans	-72.4	36.7	-169.2	-54.6	-148.2	143.3	0	0	115.9
212	N	46	Very low	50.1	Low	137 Å²	137	140.6 Å²	140.6	73%	0.733	77%	0.772	S	S	*	*			trans	-123.3	14.3	-169.3	-127	-9	0	0	0	115.5	P210	P210-N212 PolarHBondContact O-N 2.86Å
213	F	51.9	Low	50.6	Low	193 Å²	193	142.7 Å²	142.7	85%	0.846	78%	0.777	S	S	*	*	S	Bend	trans	-104	4.3	178.2	-98.3	-89	0	0	0	114.8
214	L	50	Low	51.3	Low	177 Å²	177	140.9 Å²	140.9	93%	0.927	78%	0.777	S	S	*	*	S	Bend	trans	-99.1	4.6	-177.9	-65.9	179.5	0	0	0	114.6
215	A	46	Very low	51.7	Low	80 Å²	80	138.1 Å²	138.1	66%	0.661	77%	0.769	S	S	*	*			trans	-123.5	29.6	-169.8	0	0	0	0	0	114.3
216	S	47.7	Very low	51.8	Low	93 Å²	93	138 Å²	138	65%	0.65	76%	0.759	S	S	*	*			trans	-110	101	167.9	-49	0	0	0	0	108.3	I218	S216-I218 VanDerWaalsContact C-N 3.25Å; S216-I218 PolarHBondContact O-N 2.8Å
217	D	46.5	Very low	51.8	Low	161 Å²	161	135 Å²	135	86%	0.861	75%	0.749	S	S	*	*			trans	-55.4	87.4	170.5	-61.4	-55.1	0	0	0	109.9
218	I	54	Low	51.9	Low	127 Å²	127	134.6 Å²	134.6	65%	0.651	74%	0.74	S	S	*	*			trans	-97.2	95.3	160.6	-56	172.4	0	0	0	104	S216 L220	S216-I218 VanDerWaalsContact C-N 3.25Å; S216-I218 PolarHBondContact O-N 2.8Å; I218-L220 HydrophobicContact CG2-CD2 3.7Å; I218-L220 HydrophobicContact CG2-CG 3.76Å; I218-L220 PolarHBondContact O-N 3.03Å
219	E	51.6	Low	52.6	Low	192 Å²	192	128.9 Å²	128.9	90%	0.897	72%	0.722	S	S	*	*			trans	-58.8	82	164.7	-69.6	-169.7	159.6	0	0	108.6	N221	E219-N221 PolarHBondContact O-N 3.32Å; E219-N221 VanDerWaalsContact O-N 3.13Å
220	L	59.5	Low	52.5	Low	133 Å²	133	129.7 Å²	129.7	70%	0.696	72%	0.72	S	S	*	*			trans	-75.9	100.5	167.6	-70.1	178.6	0	0	0	106.5	I218 I222	I218-L220 HydrophobicContact CG2-CD2 3.7Å; I218-L220 HydrophobicContact CG2-CG 3.76Å; I218-L220 PolarHBondContact O-N 3.03Å; L220-I222 PolarHBondContact O-N 3.07Å
221	N	49.8	Very low	52.9	Low	139 Å²	139	130.8 Å²	130.8	74%	0.743	72%	0.717	S	S	*	*			trans	-59.5	80.6	165.9	-175.3	15.8	0	0	0	109.4	E219 S223	E219-N221 PolarHBondContact O-N 3.32Å; E219-N221 VanDerWaalsContact O-N 3.13Å; N221-S223 PolarHBondContact O-N 3.47Å; N221-S223 PolarHBondContact OD1-OG 3.42Å
222	I	59.5	Low	53.1	Low	127 Å²	127	127.8 Å²	127.8	65%	0.651	71%	0.707	S	S	*	*			trans	-82.7	9.6	-176.5	-144.3	163.8	0	0	0	112.3	L220 G224 I225	L220-I222 PolarHBondContact O-N 3.07Å; I222-G224 PolarHBondContact O-N 3.4Å; I222-I225 HydrophobicContact CG1-CD1 3.97Å
223	S	52.3	Low	53.7	Low	105 Å²	105	127.1 Å²	127.1	73%	0.734	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	11.3	-175.2	68.3	0	0	0	0	115.3	N221	N221-S223 PolarHBondContact O-N 3.47Å; N221-S223 PolarHBondContact OD1-OG 3.42Å
224	G	54.5	Low	53.6	Low	71 Å²	71	121.1 Å²	121.1	73%	0.732	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	4.5	-176.3	0	0	0	0	0	116	I222	I222-G224 PolarHBondContact O-N 3.4Å
225	I	56.8	Low	53.9	Low	120 Å²	120	117.8 Å²	117.8	62%	0.615	67%	0.674	S	S	*	*			trans	-100	96.3	-179.2	-50.8	174.9	0	0	0	108.2	I222 L227	I222-I225 HydrophobicContact CG1-CD1 3.97Å; I225-L227 PolarHBondContact O-N 2.83Å; I225-L227 VanDerWaalsContact O-N 3.11Å
226	D	54.8	Low	54.3	Low	108 Å²	108	117.7 Å²	117.7	58%	0.578	67%	0.668	S	S	*	*			trans	-69.6	102.3	168.5	-173	0.9	0	0	0	109	N228 S229	D226-N228 PolarHBondContact O-N 2.81Å; D226-N228 VanDerWaalsContact O-N 3.1Å; D226-N228 VanDerWaalsContact OD1-CB 3.28Å; D226-N228 WeakPolarHBondContact OD1-CB 3.39Å; D226-N228 PolarHBondContact OD1-N 3.47Å; D226-S229 PolarHBondContact O-N 2.95Å; D226-S229 VanDerWaalsContact O-N 3.09Å
227	L	58.3	Low	54.8	Low	126 Å²	126	119.5 Å²	119.5	66%	0.66	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-62.4	-9.7	176.6	-77.1	163.5	0	0	0	112.7	I225 I230	I225-L227 PolarHBondContact O-N 2.83Å; I225-L227 VanDerWaalsContact O-N 3.11Å; L227-I230 WeakPolarHBondContact O-CG2 3.19Å
228	N	56	Low	55.1	Low	113 Å²	113	119.1 Å²	119.1	60%	0.604	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-79.8	-19	173.6	-67.6	-11.8	0	0	0	113.2	D226 I230	D226-N228 PolarHBondContact O-N 2.81Å; D226-N228 VanDerWaalsContact O-N 3.1Å; D226-N228 VanDerWaalsContact OD1-CB 3.28Å; D226-N228 WeakPolarHBondContact OD1-CB 3.39Å; D226-N228 PolarHBondContact OD1-N 3.47Å; N228-I230 VanDerWaalsContact C-N 3.26Å; N228-I230 PolarHBondContact O-N 3.24Å
229	S	54.6	Low	54.9	Low	73 Å²	73	122 Å²	122	51%	0.51	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-79.3	-7.6	178	-167.5	0	0	0	0	113.3	D226	D226-S229 PolarHBondContact O-N 2.95Å; D226-S229 VanDerWaalsContact O-N 3.09Å
230	I	53.2	Low	54.9	Low	139 Å²	139	120.2 Å²	120.2	71%	0.713	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-93.2	-0	-179	-145.1	151.4	0	0	0	113.6	L227 N228	L227-I230 WeakPolarHBondContact O-CG2 3.19Å; N228-I230 VanDerWaalsContact C-N 3.26Å; N228-I230 PolarHBondContact O-N 3.24Å
231	M	58.1	Low	54.6	Low	135 Å²	135	118 Å²	118	67%	0.665	66%	0.657	S	S	*	*			trans	-115.4	9.9	178.9	-65.4	-169	-66.2	0	0	114.1	V233	M231-V233 PolarHBondContact O-N 3.42Å
232	D	53.1	Low	55	Low	134 Å²	134	115.1 Å²	115.1	72%	0.717	65%	0.646	S	S	*	*			trans	-73	80.1	172.6	-72.7	-45.2	0	0	0	110.3	D234	D232-D234 PolarHBondContact O-N 3.49Å
233	V	58.6	Low	54.8	Low	124 Å²	124	115.6 Å²	115.6	75%	0.752	65%	0.645	S	S	*	*			trans	-71	113.4	168.1	176.5	0	0	0	0	107.8	M231 P235	M231-V233 PolarHBondContact O-N 3.42Å; V233-P235 WeakPolarHBondContact O-CD 3.44Å
234	D	50	Low	55.1	Low	67 Å²	67	115.6 Å²	115.6	36%	0.358	64%	0.637	S	S	.	*			trans	-48.6	114.6	176.8	-176	-10.2	0	0	0	111.4	R89 D232 S236 I237	R89-D234 IonicContact NH1-OD2 3.86Å; D232-D234 PolarHBondContact O-N 3.49Å; D234-S236 PolarHBondContact O-N 3.31Å; D234-S236 VanDerWaalsContact O-N 3.12Å; D234-S236 VanDerWaalsContact OD1-CB 3.31Å; D234-S236 WeakPolarHBondContact OD1-CB 3.4Å; D234-S236 PolarHBondContact OD1-N 3.14Å; D234-S236 PolarHBondContact OD1-OG 3.15Å; D234-S236 PolarHBondContact OD2-OG 2.92Å; D234-S236 VanDerWaalsContact OD2-OG 3.06Å; D234-I237 PolarHBondContact O-N 3.36Å
235	P	57.9	Low	55.2	Low	107 Å²	107	118.6 Å²	118.6	70%	0.695	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-70.1	-2.1	-179.4	26.7	-31.9	0	0	0	113.8	V233	V233-P235 WeakPolarHBondContact O-CD 3.44Å
236	S	54.3	Low	55.1	Low	77 Å²	77	119.9 Å²	119.9	54%	0.538	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-83.5	-4.1	176.1	69.9	0	0	0	0	115.1	D234 Q238	D234-S236 PolarHBondContact O-N 3.31Å; D234-S236 VanDerWaalsContact O-N 3.12Å; D234-S236 VanDerWaalsContact OD1-CB 3.31Å; D234-S236 WeakPolarHBondContact OD1-CB 3.4Å; D234-S236 PolarHBondContact OD1-N 3.14Å; D234-S236 PolarHBondContact OD1-OG 3.15Å; D234-S236 PolarHBondContact OD2-OG 2.92Å; D234-S236 VanDerWaalsContact OD2-OG 3.06Å; S236-Q238 VanDerWaalsContact C-N 3.27Å; S236-Q238 PolarHBondContact O-N 3.45Å
237	I	56.7	Low	55.2	Low	131 Å²	131	121.6 Å²	121.6	67%	0.672	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-87.7	7.3	178.4	-56.1	-164.2	0	0	0	112.3	D234	D234-I237 PolarHBondContact O-N 3.36Å
238	Q	54	Low	54.9	Low	154 Å²	154	125.2 Å²	125.2	72%	0.72	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-98.8	9.4	-172.4	-74	-177.2	-11.5	0	0	116.4	S236	S236-Q238 VanDerWaalsContact C-N 3.27Å; S236-Q238 PolarHBondContact O-N 3.45Å
239	E	49.7	Very low	54.9	Low	188 Å²	188	127 Å²	127	88%	0.879	66%	0.657	S	S	*	*			trans	-133.7	26.5	-175.2	-117.9	-175.8	158.6	0	0	116.1	N241	E239-N241 PolarHBondContact O-N 3.14Å; E239-N241 VanDerWaalsContact O-N 3.09Å
240	L	50.5	Low	55.1	Low	153 Å²	153	128 Å²	128	80%	0.801	66%	0.664	S	S	*	*			trans	-77.6	97.1	164.1	-75.1	167.9	0	0	0	109.3
241	N	53.4	Low	55.2	Low	86 Å²	86	124.2 Å²	124.2	46%	0.46	66%	0.659	S	S	.	*			trans	-47.4	119.1	172.3	-176.7	15	0	0	0	109.9	E239 Q243 D244	E239-N241 PolarHBondContact O-N 3.14Å; E239-N241 VanDerWaalsContact O-N 3.09Å; N241-Q243 PolarHBondContact O-N 3.47Å; N241-D244 PolarHBondContact O-N 3.13Å
242	P	58.9	Low	54.9	Low	79 Å²	79	125.1 Å²	125.1	51%	0.513	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	-5.7	-176.5	22.6	-32.6	0	0	0	114.3
243	Q	54.7	Low	54.6	Low	137 Å²	137	127.7 Å²	127.7	64%	0.64	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-17.4	178.8	-57.5	-163.9	-80.3	0	0	114.6	N241	N241-Q243 PolarHBondContact O-N 3.47Å
244	D	58.2	Low	54.1	Low	105 Å²	105	137 Å²	137	56%	0.561	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-16.1	177.9	-99.7	-26.1	0	0	0	113.6	N241	N241-D244 PolarHBondContact O-N 3.13Å
245	M	57	Low	54.3	Low	135 Å²	135	140.5 Å²	140.5	67%	0.665	72%	0.715	S	S	*	*	H	α-helix	trans	-77.1	-18	177.7	-77.6	-80.4	-77.7	0	0	113.6
246	E	54.8	Low	54.1	Low	147 Å²	147	142.3 Å²	142.3	69%	0.687	72%	0.717	S	S	*	*	H	α-helix	trans	-82.8	-23.4	178.7	-68.9	-166.3	143.9	0	0	113.2	S250	E246-S250 PolarHBondContact O-N 2.94Å; E246-S250 PolarHBondContact O-OG 3.22Å
247	Q	56.4	Low	54.1	Low	143 Å²	143	145.9 Å²	145.9	67%	0.668	73%	0.726	S	S	*	*	H	α-helix	trans	-74	-29.3	173.6	-68.9	-165.1	33.2	0	0	112.3	S250	Q247-S250 PolarHBondContact O-OG 2.84Å
248	Y	52.6	Low	54	Low	203 Å²	203	146.8 Å²	146.8	80%	0.796	73%	0.73	S	S	*	*	H	α-helix	trans	-77.2	-24.8	177.2	-95.6	-89	0	0	0	114.1
249	L	57.3	Low	54	Low	149 Å²	149	146.3 Å²	146.3	78%	0.78	73%	0.73	S	S	*	*	H	α-helix	trans	-92.1	-16.6	179.1	-69	171.5	0	0	0	113.6
250	S	57.6	Low	54.3	Low	94 Å²	94	143.5 Å²	143.5	66%	0.657	72%	0.72	S	S	*	*	H	α-helix	trans	-91.7	-8.1	178	55.9	0	0	0	0	114.6	E246 Q247	E246-S250 PolarHBondContact O-N 2.94Å; E246-S250 PolarHBondContact O-OG 3.22Å; Q247-S250 PolarHBondContact O-OG 2.84Å
251	G	55.4	Low	54.5	Low	60 Å²	60	142.9 Å²	142.9	62%	0.619	72%	0.715	S	S	*	*	S	Bend	trans	-87.9	-8.7	-176	0	0	0	0	0	117.2
252	N	52	Low	54.6	Low	155 Å²	155	147.2 Å²	147.2	83%	0.829	73%	0.734	S	S	*	*	S	Bend	trans	-116.7	26.7	-166.7	-98.4	12.1	0	0	0	115.7
253	M	47.6	Very low	54.3	Low	188 Å²	188	152.9 Å²	152.9	93%	0.926	75%	0.753	S	S	*	*			trans	-127.3	50.4	178.2	-124.4	-156.8	-63.8	0	0	114.3
254	R	47.6	Very low	54.2	Low	319 Å²	319	154.4 Å²	154.4	100%	1.204	76%	0.763	S	S	*	*			trans	-129.5	0	165.2	-125.1	-176.3	-176.2	171.6	2.1	111.8

Retrieved 254 of 254 residues in 870.7 ms (Link to these results)

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