A0A077ZDZ5_TRITR Loading...

Homeobox protein goosecoid A

AlphaFold DB , UniProt , Accession A0A077ZDZ5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 248 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	44	Very low	49.6	Very low	233 Å²	233	154.5 Å²	154.5	100%	1.148	80%	0.8	S	S	*	*				0	120	0	-75.9	-174.2	169.8	0	0	108.3
2	N	47.2	Very low	49.5	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	79%	0.786	S	S	*	*			trans	58	76.7	165.2	-55.4	-15	0	0	0	119
3	Y	43.7	Very low	49.5	Very low	238 Å²	238	150.8 Å²	150.8	93%	0.933	78%	0.782	S	S	*	*			trans	-77.5	107.8	149.9	-79.8	-93.1	0	0	0	108.5
4	L	56.9	Low	49.2	Very low	170 Å²	170	150.3 Å²	150.3	89%	0.89	77%	0.774	S	S	*	*			trans	-93.9	109.2	168.2	-82	163.7	0	0	0	108.8
5	S	49.5	Very low	49.3	Very low	95 Å²	95	145.9 Å²	145.9	66%	0.664	76%	0.762	S	S	*	*			trans	-61.9	142.3	178.9	-176.4	0	0	0	0	112.6	V7	S5-V7 PolarHBondContact O-N 3.36Å
6	P	56.8	Low	49.7	Very low	124 Å²	124	140.4 Å²	140.4	81%	0.805	74%	0.739	S	S	*	*			trans	-73.5	105.6	171.3	28.6	-27.8	0	0	0	109.5	A8	P6-A8 PolarHBondContact O-N 3.26Å
7	V	52.7	Low	50.1	Low	125 Å²	125	135.6 Å²	135.6	76%	0.758	72%	0.724	S	S	*	*			trans	-64.7	123	176	-178.2	0	0	0	0	109.5	S5	S5-V7 PolarHBondContact O-N 3.36Å
8	A	46.9	Very low	50.7	Low	77 Å²	77	135.9 Å²	135.9	64%	0.636	72%	0.721	S	S	*	*			trans	-60.1	131.9	-177.3	0	0	0	0	0	112.9	P6 P10	P6-A8 PolarHBondContact O-N 3.26Å; A8-P10 WeakPolarHBondContact O-CD 3.46Å
9	Y	49.9	Very low	51.1	Low	182 Å²	182	133.2 Å²	133.2	71%	0.714	70%	0.704	S	S	*	*			trans	-113.4	67.6	167.7	-85.9	-86.8	0	0	0	111.6	L12	Y9-L12 HydrophobicContact CD1-CB 4.35Å; Y9-L12 HydrophobicContact CD1-CD1 3.6Å; Y9-L12 HydrophobicContact CE1-CD1 3.51Å
10	P	55.7	Low	51.8	Low	96 Å²	96	130.3 Å²	130.3	62%	0.623	69%	0.691	S	S	*	*			trans	-89.3	-6.3	177.5	33.3	-30.7	0	0	0	114.1	A8	A8-P10 WeakPolarHBondContact O-CD 3.46Å
11	Y	42.1	Very low	52.5	Low	207 Å²	207	130.9 Å²	130.9	81%	0.812	69%	0.688	S	S	*	*	S	Bend	trans	-105.8	-19.5	-173.2	-126.5	-98.3	0	0	0	115.7
12	L	48.7	Very low	53.8	Low	122 Å²	122	123.9 Å²	123.9	64%	0.639	66%	0.658	S	S	*	*	H	α-helix	trans	-84.2	-14.5	-179.9	-92.5	157.4	0	0	0	114	Y9	Y9-L12 HydrophobicContact CD1-CB 4.35Å; Y9-L12 HydrophobicContact CD1-CD1 3.6Å; Y9-L12 HydrophobicContact CE1-CD1 3.51Å
13	L	49.9	Very low	54.3	Low	139 Å²	139	117.9 Å²	117.9	73%	0.728	62%	0.624	S	S	*	*	H	α-helix	trans	-82.8	-28.1	-179.1	-142.5	72.5	0	0	0	112.6	A17	L13-A17 PolarHBondContact O-N 3.37Å
14	Q	45.4	Very low	55.5	Low	144 Å²	144	110.7 Å²	110.7	67%	0.673	60%	0.602	S	S	*	*	H	α-helix	trans	-80.8	-37	-173.1	-159.2	146.2	4.7	0	0	112.9	S16 A17 E18	Q14-S16 VanDerWaalsContact C-N 3.35Å; Q14-A17 PolarHBondContact O-N 3.44Å; Q14-E18 PolarHBondContact O-N 2.92Å
15	S	50.2	Low	56	Low	85 Å²	85	107 Å²	107	59%	0.594	58%	0.583	S	S	*	*	H	α-helix	trans	-68.8	-34.3	171	-174.8	0	0	0	0	112	E18 Q19	S15-E18 PolarHBondContact O-N 3.2Å; S15-Q19 PolarHBondContact O-N 3.37Å; S15-Q19 VanDerWaalsContact O-N 3.11Å
16	S	55.2	Low	56.8	Low	57 Å²	57	107.1 Å²	107.1	40%	0.399	57%	0.574	S	S	.	*	H	α-helix	trans	-64.9	-39.5	173.2	-175.9	0	0	0	0	112	Q14 E18 Q19 V20	Q14-S16 VanDerWaalsContact C-N 3.35Å; S16-E18 PolarHBondContact O-N 2.85Å; S16-Q19 PolarHBondContact O-N 3.13Å; S16-V20 WeakPolarHBondContact O-CB 3.16Å; S16-V20 WeakPolarHBondContact O-CG2 2.91Å; S16-V20 PolarHBondContact O-N 3.32Å
17	A	57.4	Low	57	Low	59 Å²	59	103.9 Å²	103.9	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-63.5	-39.6	177.2	0	0	0	0	0	112.9	L13 Q14 V20 K21	L13-A17 PolarHBondContact O-N 3.37Å; Q14-A17 PolarHBondContact O-N 3.44Å; A17-V20 PolarHBondContact O-N 2.85Å; A17-K21 WeakPolarHBondContact O-CB 3.32Å; A17-K21 PolarHBondContact O-N 3.22Å
18	E	60	Low	57.6	Low	142 Å²	142	103 Å²	103	66%	0.664	54%	0.541	S	S	*	.	H	α-helix	trans	-71.5	-36.9	176.7	-65.4	-157	156.6	0	0	112.7	Q14 S15 S16 V20 K21 T22	Q14-E18 PolarHBondContact O-N 2.92Å; S15-E18 PolarHBondContact O-N 3.2Å; S16-E18 PolarHBondContact O-N 2.85Å; E18-V20 VanDerWaalsContact C-N 3.32Å; E18-K21 PolarHBondContact O-N 3.44Å; E18-T22 WeakPolarHBondContact O-CG2 3.02Å; E18-T22 PolarHBondContact O-N 2.96Å; E18-T22 PolarHBondContact O-OG1 3.07Å
19	Q	58.8	Low	58.2	Low	84 Å²	84	102.2 Å²	102.2	39%	0.393	54%	0.535	S	S	.	.	H	α-helix	trans	-67.8	-34.3	174.2	-159.9	175.2	11.4	0	0	111.8	S15 S16 T22 Y23 K154	S15-Q19 PolarHBondContact O-N 3.37Å; S15-Q19 VanDerWaalsContact O-N 3.11Å; S16-Q19 PolarHBondContact O-N 3.13Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.44Å; Q19-T22 PolarHBondContact O-OG1 2.9Å; Q19-Y23 WeakPolarHBondContact O-CB 3.27Å; Q19-Y23 PolarHBondContact O-N 2.75Å; Q19-Y23 VanDerWaalsContact O-N 3.1Å; Q19-K154 PolarHBondContact NE2-O 3.28Å
20	V	64.3	Low	58.4	Low	75 Å²	75	98.5 Å²	98.5	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-68.7	-39.6	171.7	171.1	0	0	0	0	110.9	S16 A17 E18 Y23 L24	S16-V20 WeakPolarHBondContact O-CB 3.16Å; S16-V20 WeakPolarHBondContact O-CG2 2.91Å; S16-V20 PolarHBondContact O-N 3.32Å; A17-V20 PolarHBondContact O-N 2.85Å; E18-V20 VanDerWaalsContact C-N 3.32Å; V20-Y23 PolarHBondContact O-N 2.99Å; V20-L24 HydrophobicContact CG1-CD1 3.55Å; V20-L24 WeakPolarHBondContact O-CB 3.37Å; V20-L24 WeakPolarHBondContact O-CD1 3.4Å; V20-L24 PolarHBondContact O-N 2.9Å
21	K	66.7	Low	58.4	Low	142 Å²	142	100.7 Å²	100.7	62%	0.617	53%	0.53	S	S	*	.	H	α-helix	trans	-65	-48	177.7	-171.3	176.4	-179.3	-176.7	0	112.2	A17 E18 Y23 L24 D25	A17-K21 WeakPolarHBondContact O-CB 3.32Å; A17-K21 PolarHBondContact O-N 3.22Å; E18-K21 PolarHBondContact O-N 3.44Å; K21-Y23 VanDerWaalsContact C-N 3.26Å; K21-Y23 PolarHBondContact O-N 3.05Å; K21-L24 PolarHBondContact O-N 3.11Å; K21-D25 WeakPolarHBondContact O-CB 3.34Å; K21-D25 PolarHBondContact O-N 3.45Å
22	T	72.1	Confident	58.9	Low	86 Å²	86	96.6 Å²	96.6	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-60.7	-37.9	174.9	49	0	0	0	0	111.8	E18 Q19 M26	E18-T22 WeakPolarHBondContact O-CG2 3.02Å; E18-T22 PolarHBondContact O-N 2.96Å; E18-T22 PolarHBondContact O-OG1 3.07Å; Q19-T22 WeakPolarHBondContact CA-OG1 3.44Å; Q19-T22 PolarHBondContact O-OG1 2.9Å; T22-M26 WeakPolarHBondContact O-CG 3.4Å; T22-M26 PolarHBondContact O-N 2.7Å
23	Y	56.7	Low	58.9	Low	26 Å²	26	99 Å²	99	10%	0.102	53%	0.534	C	S	.	.	H	α-helix	trans	-69	-41	175.9	-163.6	-75.4	0	0	0	113	Q19 V20 K21 M26 C27 H156 Y157 W188	Q19-Y23 WeakPolarHBondContact O-CB 3.27Å; Q19-Y23 PolarHBondContact O-N 2.75Å; Q19-Y23 VanDerWaalsContact O-N 3.1Å; V20-Y23 PolarHBondContact O-N 2.99Å; K21-Y23 VanDerWaalsContact C-N 3.26Å; K21-Y23 PolarHBondContact O-N 3.05Å; Y23-M26 PolarHBondContact O-N 3.25Å; Y23-C27 WeakPolarHBondContact CE1-SG 3.47Å; Y23-C27 PolarHBondContact O-N 2.82Å; Y23-C27 VanDerWaalsContact O-N 3.09Å; Y23-C27 PolarHBondContact O-SG 3.46Å; Y23-H156 AromaticContact CE2-ND1 3.94Å; Y23-Y157 HydrophobicContact CD2-CE2 4.13Å; Y23-Y157 AromaticContact CE2-CE2 3.77Å; Y23-Y157 HydrophobicContact CE2-CE2 3.77Å; Y23-W188 AromaticContact CD1-CH2 3.48Å; Y23-W188 HydrophobicContact CD1-CH2 3.48Å; Y23-W188 VanDerWaalsContact CD1-CH2 3.48Å; Y23-W188 HydrophobicContact CD1-CZ2 4.22Å; Y23-W188 HydrophobicContact CD1-CZ3 4.06Å; Y23-W188 HydrophobicContact CE1-CE3 4.01Å; Y23-W188 AromaticContact CE1-CH2 2.86Å; Y23-W188 HydrophobicContact CE1-CH2 2.86Å; Y23-W188 AromaticContact CE1-CZ2 3.85Å; Y23-W188 HydrophobicContact CE1-CZ2 3.85Å; Y23-W188 AromaticContact CE1-CZ3 2.99Å; Y23-W188 HydrophobicContact CE1-CZ3 2.99Å; Y23-W188 HydrophobicContact CE2-CH2 4.34Å; Y23-W188 HydrophobicContact CE2-CZ3 4.33Å; Y23-W188 HydrophobicContact CG-CH2 4.46Å; Y23-W188 AromaticContact CZ-CE3 3.69Å; Y23-W188 AromaticContact CZ-CH2 3.36Å; Y23-W188 AromaticContact CZ-CZ3 3.13Å; Y23-W188 WeakPolarHBondContact OH-CZ3 3.42Å
24	L	69.9	Low	58.8	Low	88 Å²	88	98.2 Å²	98.2	46%	0.461	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-40.5	174.6	-103.8	121.1	0	0	0	111.3	V20 K21 C27 H28	V20-L24 HydrophobicContact CG1-CD1 3.55Å; V20-L24 WeakPolarHBondContact O-CB 3.37Å; V20-L24 WeakPolarHBondContact O-CD1 3.4Å; V20-L24 PolarHBondContact O-N 2.9Å; K21-L24 PolarHBondContact O-N 3.11Å; L24-C27 CarbonylContact O-C 3.38Å; L24-C27 WeakPolarHBondContact O-CB 3.35Å; L24-C27 PolarHBondContact O-N 2.95Å; L24-C27 VanDerWaalsContact O-N 3.1Å; L24-H28 PolarHBondContact O-N 3.47Å
25	D	66.6	Low	58.5	Low	91 Å²	91	101.7 Å²	101.7	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-40.9	175.9	-83.2	-13.4	0	0	0	111.5	K21 C27 H28 A29	K21-D25 WeakPolarHBondContact O-CB 3.34Å; K21-D25 PolarHBondContact O-N 3.45Å; D25-C27 VanDerWaalsContact C-N 3.27Å; D25-C27 PolarHBondContact O-N 3.08Å; D25-H28 PolarHBondContact O-N 3.1Å; D25-A29 VanDerWaalsContact O-CB 3.26Å; D25-A29 WeakPolarHBondContact O-CB 2.97Å; D25-A29 PolarHBondContact O-N 3.24Å
26	M	67.1	Low	58.4	Low	98 Å²	98	102.5 Å²	102.5	48%	0.483	54%	0.54	S	S	.	.	H	α-helix	trans	-62.5	-33.6	172.1	-81.1	-179.3	56.8	0	0	112.9	T22 Y23 N30	T22-M26 WeakPolarHBondContact O-CG 3.4Å; T22-M26 PolarHBondContact O-N 2.7Å; Y23-M26 PolarHBondContact O-N 3.25Å; M26-N30 PolarHBondContact O-N 3.25Å; M26-N30 PolarHBondContact O-ND2 3.42Å
27	C	61.2	Low	57.8	Low	57 Å²	57	105.1 Å²	105.1	39%	0.385	56%	0.559	S	S	.	*	H	α-helix	trans	-75.1	-41.1	176.1	-69.4	0	0	0	0	112.2	Y23 L24 D25 Q31	Y23-C27 WeakPolarHBondContact CE1-SG 3.47Å; Y23-C27 PolarHBondContact O-N 2.82Å; Y23-C27 VanDerWaalsContact O-N 3.09Å; Y23-C27 PolarHBondContact O-SG 3.46Å; L24-C27 CarbonylContact O-C 3.38Å; L24-C27 WeakPolarHBondContact O-CB 3.35Å; L24-C27 PolarHBondContact O-N 2.95Å; L24-C27 VanDerWaalsContact O-N 3.1Å; D25-C27 VanDerWaalsContact C-N 3.27Å; D25-C27 PolarHBondContact O-N 3.08Å; C27-Q31 PolarHBondContact O-N 3.07Å
28	H	65.7	Low	57.4	Low	105 Å²	105	108 Å²	108	49%	0.486	57%	0.571	S	S	.	*	H	α-helix	trans	-66.2	-42.4	175.5	-83	160.2	0	0	0	111.9	L24 D25 N30 Q31 V32	L24-H28 PolarHBondContact O-N 3.47Å; D25-H28 PolarHBondContact O-N 3.1Å; H28-N30 VanDerWaalsContact C-N 3.29Å; H28-N30 PolarHBondContact O-N 3.27Å; H28-Q31 WeakPolarHBondContact O-CB 3.48Å; H28-Q31 PolarHBondContact O-N 3.2Å; H28-V32 PolarHBondContact O-N 3.01Å
29	A	58.9	Low	56.7	Low	61 Å²	61	106.9 Å²	106.9	50%	0.504	58%	0.578	S	S	.	*	H	α-helix	trans	-60.7	-36.5	178.8	0	0	0	0	0	112.8	D25 Q31	D25-A29 VanDerWaalsContact O-CB 3.26Å; D25-A29 WeakPolarHBondContact O-CB 2.97Å; D25-A29 PolarHBondContact O-N 3.24Å; A29-Q31 VanDerWaalsContact C-N 3.33Å
30	N	54.1	Low	55.9	Low	105 Å²	105	107.6 Å²	107.6	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-75.2	-20.8	175.9	-84.1	-76	0	0	0	113.7	M26 H28	M26-N30 PolarHBondContact O-N 3.25Å; M26-N30 PolarHBondContact O-ND2 3.42Å; H28-N30 VanDerWaalsContact C-N 3.29Å; H28-N30 PolarHBondContact O-N 3.27Å
31	Q	55.3	Low	55.1	Low	142 Å²	142	112.2 Å²	112.2	66%	0.664	62%	0.62	S	S	*	*	H	α-helix	trans	-81.4	-24.9	179.1	-160.1	156.1	35.7	0	0	112.4	C27 H28 A29	C27-Q31 PolarHBondContact O-N 3.07Å; H28-Q31 WeakPolarHBondContact O-CB 3.48Å; H28-Q31 PolarHBondContact O-N 3.2Å; A29-Q31 VanDerWaalsContact C-N 3.33Å
32	V	53.2	Low	53.9	Low	120 Å²	120	111.1 Å²	111.1	73%	0.727	63%	0.63	S	S	*	*	H	α-helix	trans	-75.5	-30.6	176.5	179.5	0	0	0	0	112.1	H28	H28-V32 PolarHBondContact O-N 3.01Å
33	Q	49	Very low	53.1	Low	173 Å²	173	112.6 Å²	112.6	81%	0.808	64%	0.644	S	S	*	*	H	α-helix	trans	-90.5	-12.1	-178.1	-62.8	-145.4	-22.3	0	0	115.2
34	N	46.7	Very low	52.7	Low	123 Å²	123	114.6 Å²	114.6	66%	0.658	67%	0.672	S	S	*	*			trans	-122.5	55.9	179.3	-72.8	-75	0	0	0	111.6	P36	N34-P36 VanDerWaalsContact C-CD 3.45Å; N34-P36 WeakPolarHBondContact O-CD 3.37Å
35	R	39.3	Very low	52.2	Low	217 Å²	217	116 Å²	116	82%	0.819	69%	0.69	S	S	*	*			trans	-94.4	92.9	168.1	-161.5	-178.6	-163.6	-151.6	4.7	109.4	S37	R35-S37 PolarHBondContact O-N 3.25Å
36	P	49	Very low	51.9	Low	101 Å²	101	116.6 Å²	116.6	66%	0.656	70%	0.697	S	S	*	*			trans	-69.8	115.1	166.8	27.3	-31	0	0	0	108.8	N34 T38	N34-P36 VanDerWaalsContact C-CD 3.45Å; N34-P36 WeakPolarHBondContact O-CD 3.37Å; P36-T38 VanDerWaalsContact C-N 3.27Å; P36-T38 PolarHBondContact O-N 3.36Å
37	S	42.5	Very low	51.9	Low	113 Å²	113	119.9 Å²	119.9	79%	0.79	71%	0.709	S	S	*	*			trans	-72.2	77.9	167.8	-61.2	0	0	0	0	109.5	R35	R35-S37 PolarHBondContact O-N 3.25Å
38	T	49.4	Very low	52.1	Low	120 Å²	120	119.7 Å²	119.7	74%	0.736	71%	0.708	S	S	*	*			trans	-144.6	130.8	170.3	55.6	0	0	0	0	111.9	P36	P36-T38 VanDerWaalsContact C-N 3.27Å; P36-T38 PolarHBondContact O-N 3.36Å
39	S	43.6	Very low	52.5	Low	118 Å²	118	120.4 Å²	120.4	83%	0.825	71%	0.714	S	S	*	*			trans	-50.6	151.7	177.1	32.6	0	0	0	0	114.8	L41	S39-L41 PolarHBondContact O-N 2.74Å
40	A	42.7	Very low	53	Low	99 Å²	99	124.7 Å²	124.7	82%	0.818	72%	0.724	S	S	*	*			trans	-57.6	122.5	178.7	0	0	0	0	0	113.4
41	L	47.4	Very low	53.7	Low	171 Å²	171	124.1 Å²	124.1	90%	0.895	72%	0.721	S	S	*	*			trans	-137.1	98.2	153.1	-79.2	165.4	0	0	0	107.5	S39	S39-L41 PolarHBondContact O-N 2.74Å
42	S	42.2	Very low	54.5	Low	119 Å²	119	122.5 Å²	122.5	83%	0.832	72%	0.715	S	S	*	*			trans	-72.1	116.3	167.7	177.8	0	0	0	0	108.2
43	S	54.7	Low	55.5	Low	117 Å²	117	123.2 Å²	123.2	82%	0.818	71%	0.714	S	S	*	*			trans	-153.7	107.1	164.6	-87	0	0	0	0	111.5
44	G	48	Very low	56.1	Low	68 Å²	68	118.9 Å²	118.9	70%	0.701	70%	0.703	S	S	*	*			trans	33.8	95.1	147.4	0	0	0	0	0	119	T46	G44-T46 PolarHBondContact O-N 2.92Å
45	S	59.3	Low	56.8	Low	119 Å²	119	118.5 Å²	118.5	83%	0.832	71%	0.707	S	S	*	*			trans	-85	91.8	152.5	-176.7	0	0	0	0	108.7	F47	S45-F47 VanDerWaalsContact C-N 3.26Å; S45-F47 PolarHBondContact O-N 3.02Å; S45-F47 VanDerWaalsContact O-N 3.16Å
46	T	59.7	Low	57.4	Low	103 Å²	103	112.8 Å²	112.8	63%	0.632	70%	0.701	S	S	*	*			trans	-84.4	66.2	172.6	42.2	0	0	0	0	110.6	G44 S48	G44-T46 PolarHBondContact O-N 2.92Å; T46-S48 VanDerWaalsContact C-N 3.34Å; T46-S48 PolarHBondContact O-N 3.42Å
47	F	67.2	Low	57.6	Low	167 Å²	167	117.5 Å²	117.5	73%	0.732	71%	0.711	S	S	*	*			trans	-84.5	85.6	159.8	-171.4	-94.6	0	0	0	108.3	S45 I52	S45-F47 VanDerWaalsContact C-N 3.26Å; S45-F47 PolarHBondContact O-N 3.02Å; S45-F47 VanDerWaalsContact O-N 3.16Å; F47-I52 HydrophobicContact CD2-CD1 4.41Å; F47-I52 HydrophobicContact CE2-CD1 3.68Å; F47-I52 HydrophobicContact CZ-CD1 3.96Å
48	S	65.8	Low	58	Low	53 Å²	53	117.6 Å²	117.6	37%	0.371	71%	0.706	S	S	.	*			trans	-116.2	141.5	165.8	-169.1	0	0	0	0	109	T46 E50 N51	T46-S48 VanDerWaalsContact C-N 3.34Å; T46-S48 PolarHBondContact O-N 3.42Å; S48-E50 PolarHBondContact O-N 3.34Å; S48-E50 VanDerWaalsContact O-N 3.17Å; S48-N51 PolarHBondContact O-N 3.36Å
49	I	74	Confident	57.9	Low	120 Å²	120	115 Å²	115	62%	0.615	70%	0.698	S	S	*	*	H	α-helix	trans	-56.2	-32.6	179.2	-66.7	172.2	0	0	0	110.5	N51 I52 L53	I49-N51 PolarHBondContact O-N 3.28Å; I49-I52 PolarHBondContact O-N 2.77Å; I49-I52 VanDerWaalsContact O-N 3.1Å; I49-L53 HydrophobicContact CG2-CD1 3.63Å; I49-L53 WeakPolarHBondContact O-CD1 3.44Å; I49-L53 PolarHBondContact O-N 3.15Å; I49-L53 VanDerWaalsContact O-N 3.13Å
50	E	69	Low	58.2	Low	151 Å²	151	117.7 Å²	117.7	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-65.4	-33.6	178.3	-65.6	-178.4	169.6	0	0	113.2	S48 I52 S54	S48-E50 PolarHBondContact O-N 3.34Å; S48-E50 VanDerWaalsContact O-N 3.17Å; E50-I52 PolarHBondContact O-N 3.12Å; E50-S54 PolarHBondContact O-N 3.48Å
51	N	69	Low	58.7	Low	93 Å²	93	119.8 Å²	119.8	50%	0.497	70%	0.696	S	S	.	*	H	α-helix	trans	-69.6	-20.4	174.2	-85.9	55.1	0	0	0	112.9	S48 I49	S48-N51 PolarHBondContact O-N 3.36Å; I49-N51 PolarHBondContact O-N 3.28Å
52	I	72.1	Confident	58.5	Low	107 Å²	107	115.8 Å²	115.8	55%	0.549	68%	0.683	S	S	.	*	H	α-helix	trans	-87.4	-41.7	179	-56.3	174.6	0	0	0	110.5	F47 I49 E50	F47-I52 HydrophobicContact CD2-CD1 4.41Å; F47-I52 HydrophobicContact CE2-CD1 3.68Å; F47-I52 HydrophobicContact CZ-CD1 3.96Å; I49-I52 PolarHBondContact O-N 2.77Å; I49-I52 VanDerWaalsContact O-N 3.1Å; E50-I52 PolarHBondContact O-N 3.12Å
53	L	74.3	Confident	58.9	Low	136 Å²	136	114.8 Å²	114.8	71%	0.712	68%	0.682	S	S	*	*	H	α-helix	trans	-78.7	-24.5	-179.8	-84.7	84.6	0	0	0	113.4	I49	I49-L53 HydrophobicContact CG2-CD1 3.63Å; I49-L53 WeakPolarHBondContact O-CD1 3.44Å; I49-L53 PolarHBondContact O-N 3.15Å; I49-L53 VanDerWaalsContact O-N 3.13Å
54	S	62.9	Low	58.9	Low	81 Å²	81	112.8 Å²	112.8	57%	0.566	67%	0.672	S	S	*	*			trans	-130.8	95.9	175	-86.9	0	0	0	0	109.4	E50 S56	E50-S54 PolarHBondContact O-N 3.48Å; S54-S56 PolarHBondContact O-N 3.49Å
55	P	60.1	Low	58.9	Low	116 Å²	116	116.1 Å²	116.1	75%	0.753	67%	0.674	S	S	*	*			trans	-69.8	68.1	159.7	31.1	-32.5	0	0	0	108	K57	P55-K57 PolarHBondContact O-N 2.88Å
56	S	52	Low	58.7	Low	97 Å²	97	117.8 Å²	117.8	68%	0.678	67%	0.673	S	S	*	*			trans	-67.4	126.5	167.9	-175.8	0	0	0	0	106.7	S54 V58	S54-S56 PolarHBondContact O-N 3.49Å; S56-V58 VanDerWaalsContact C-N 3.34Å; S56-V58 PolarHBondContact O-N 2.92Å
57	K	54.7	Low	58.5	Low	200 Å²	200	120.5 Å²	120.5	87%	0.87	68%	0.683	S	S	*	*			trans	-56.7	95.4	179.3	-63.2	171.3	-178.4	173.5	0	108.4	P55 A59	P55-K57 PolarHBondContact O-N 2.88Å; K57-A59 PolarHBondContact O-N 2.91Å
58	V	51.1	Low	57.7	Low	114 Å²	114	121.4 Å²	121.4	69%	0.691	69%	0.689	S	S	*	*			trans	-69.8	98.9	159.6	179.8	0	0	0	0	104.7	S56 M60	S56-V58 VanDerWaalsContact C-N 3.34Å; S56-V58 PolarHBondContact O-N 2.92Å; V58-M60 WeakPolarHBondContact O-CE 3.47Å; V58-M60 PolarHBondContact O-N 3.02Å; V58-M60 VanDerWaalsContact O-N 3.07Å
59	A	46.3	Very low	56.8	Low	67 Å²	67	123.5 Å²	123.5	55%	0.554	70%	0.704	S	S	*	*			trans	-54.1	112.3	164.1	0	0	0	0	0	106.9	K57 N61	K57-A59 PolarHBondContact O-N 2.91Å; A59-N61 VanDerWaalsContact C-N 3.3Å; A59-N61 PolarHBondContact O-N 3.34Å
60	M	49.8	Very low	55.7	Low	173 Å²	173	123.3 Å²	123.3	85%	0.852	71%	0.713	S	S	*	*			trans	-65.3	100.1	163.5	27	-122.9	80	0	0	106.8	V58	V58-M60 WeakPolarHBondContact O-CE 3.47Å; V58-M60 PolarHBondContact O-N 3.02Å; V58-M60 VanDerWaalsContact O-N 3.07Å
61	N	52.5	Low	54.8	Low	143 Å²	143	126.8 Å²	126.8	77%	0.765	72%	0.719	S	S	*	*			trans	-65.4	140.8	173.3	-62.9	-36.8	0	0	0	109.1	A59	A59-N61 VanDerWaalsContact C-N 3.3Å; A59-N61 PolarHBondContact O-N 3.34Å
62	S	43.2	Very low	53.7	Low	88 Å²	88	129.6 Å²	129.6	62%	0.615	73%	0.734	S	S	*	*			trans	78	105	167.7	-158	0	0	0	0	117.1	A64	S62-A64 PolarHBondContact O-N 3.1Å; S62-A64 VanDerWaalsContact O-N 3.13Å; S62-A64 WeakPolarHBondContact OG-CB 3.31Å
63	A	50.6	Low	52.5	Low	97 Å²	97	131.8 Å²	131.8	80%	0.802	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	10	168.1	0	0	0	0	0	114
64	A	55.2	Low	51.8	Low	76 Å²	76	130.3 Å²	130.3	63%	0.628	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-15.8	-175.9	0	0	0	0	0	114.7	S62 L66	S62-A64 PolarHBondContact O-N 3.1Å; S62-A64 VanDerWaalsContact O-N 3.13Å; S62-A64 WeakPolarHBondContact OG-CB 3.31Å; A64-L66 VanDerWaalsContact C-N 3.35Å; A64-L66 PolarHBondContact O-N 3.44Å
65	D	47.7	Very low	51.3	Low	137 Å²	137	136.7 Å²	136.7	73%	0.733	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-85.1	-2.3	-176.2	-80.9	-32.4	0	0	0	114.9	L67	D65-L67 VanDerWaalsContact C-N 3.35Å; D65-L67 PolarHBondContact O-N 3.03Å
66	L	55.4	Low	51.3	Low	154 Å²	154	140.1 Å²	140.1	81%	0.806	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-82.8	1.3	-174.9	-75.5	173.7	0	0	0	115.6	A64	A64-L66 VanDerWaalsContact C-N 3.35Å; A64-L66 PolarHBondContact O-N 3.44Å
67	L	56.8	Low	51.8	Low	161 Å²	161	140 Å²	140	84%	0.843	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-117.8	3.3	-179.8	-69.7	176.7	0	0	0	116	D65	D65-L67 VanDerWaalsContact C-N 3.35Å; D65-L67 PolarHBondContact O-N 3.03Å
68	H	50.5	Low	52.3	Low	185 Å²	185	134.6 Å²	134.6	86%	0.856	74%	0.737	S	S	*	*	S	Bend	trans	-119	3.3	-177.7	-127.3	79.8	0	0	0	116.4
69	S	45.3	Very low	52.8	Low	98 Å²	98	137.5 Å²	137.5	69%	0.685	75%	0.745	S	S	*	*			trans	-106.1	56.4	175.2	-139.1	0	0	0	0	111.9
70	S	51.3	Low	53.5	Low	116 Å²	116	138.5 Å²	138.5	81%	0.811	75%	0.754	S	S	*	*			trans	-103.6	68.2	165	-75.3	0	0	0	0	109.6
71	R	49.2	Very low	54	Low	223 Å²	223	135.2 Å²	135.2	84%	0.842	75%	0.748	S	S	*	*	S	Bend	trans	-168	111.4	154.8	-116.5	175.8	-173.3	-132	-1.5	111.3
72	L	46.6	Very low	54.3	Low	152 Å²	152	134.2 Å²	134.2	80%	0.796	74%	0.742	S	S	*	*			trans	71.8	67.9	156.1	-46.4	-178.5	0	0	0	116.3
73	Q	48.1	Very low	55.2	Low	154 Å²	154	134.2 Å²	134.2	72%	0.72	74%	0.74	S	S	*	*			trans	-85.7	122.6	151.3	-70.6	-70.8	-21.1	0	0	108.1	Y75	Q73-Y75 PolarHBondContact O-N 2.73Å
74	P	59	Low	55.5	Low	105 Å²	105	140.8 Å²	140.8	68%	0.682	74%	0.744	S	S	*	*			trans	-65.3	126.5	165.9	28.2	-29.6	0	0	0	107.7	F76	P74-F76 PolarHBondContact O-N 2.87Å
75	Y	52.6	Low	55.6	Low	215 Å²	215	141.7 Å²	141.7	84%	0.843	75%	0.746	S	S	*	*			trans	-47.1	97.4	-176.2	-45.5	-86.6	0	0	0	112.1	Q73 V77	Q73-Y75 PolarHBondContact O-N 2.73Å; Y75-V77 PolarHBondContact O-N 3.26Å
76	F	60.6	Low	55.6	Low	187 Å²	187	138.6 Å²	138.6	82%	0.82	74%	0.739	S	S	*	*			trans	-74.9	88.5	157.1	-174.7	-98.9	0	0	0	106.4	P74 P78	P74-F76 PolarHBondContact O-N 2.87Å; F76-P78 VanDerWaalsContact O-CD 3.32Å; F76-P78 WeakPolarHBondContact O-CD 3.47Å
77	V	61.5	Low	55.3	Low	94 Å²	94	136 Å²	136	57%	0.57	74%	0.74	S	S	*	*			trans	-70.6	118.4	170.3	-175.2	0	0	0	0	106.4	Y75 M79	Y75-V77 PolarHBondContact O-N 3.26Å; V77-M79 PolarHBondContact O-N 3.16Å
78	P	64.6	Low	54.8	Low	88 Å²	88	133 Å²	133	57%	0.571	74%	0.738	S	S	*	*			trans	-59.7	113.8	171.8	-15.5	28.9	0	0	0	107.3	F76 A80	F76-P78 VanDerWaalsContact O-CD 3.32Å; F76-P78 WeakPolarHBondContact O-CD 3.47Å; P78-A80 PolarHBondContact O-N 3.38Å
79	M	62.3	Low	54.9	Low	174 Å²	174	129.5 Å²	129.5	86%	0.857	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	67.8	174.6	-166.6	-162.4	-168.9	0	0	108.9	V77 L82	V77-M79 PolarHBondContact O-N 3.16Å; M79-L82 HydrophobicContact CG-CD1 4.27Å
80	A	61.4	Low	55.4	Low	89 Å²	89	134.2 Å²	134.2	74%	0.736	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.9	5.6	172.7	0	0	0	0	0	111.8	P78	P78-A80 PolarHBondContact O-N 3.38Å
81	S	59.1	Low	55	Low	104 Å²	104	139 Å²	139	73%	0.727	75%	0.745	S	S	*	*	S	Bend	trans	-146	23.7	-179.9	-49	0	0	0	0	113.3	P83	S81-P83 WeakPolarHBondContact O-CD 3.36Å
82	L	59	Low	54.9	Low	122 Å²	122	137.3 Å²	137.3	64%	0.639	75%	0.746	S	S	*	*			trans	-81.6	102.4	163.8	-75.9	152.1	0	0	0	107.1	M79 W84	M79-L82 HydrophobicContact CG-CD1 4.27Å; L82-W84 PolarHBondContact O-N 3.48Å
83	P	62.6	Low	54.8	Low	87 Å²	87	134.7 Å²	134.7	57%	0.565	75%	0.747	S	S	*	*			trans	-56.3	139	152.6	27.9	-32	0	0	0	105.5	S81 S85	S81-P83 WeakPolarHBondContact O-CD 3.36Å; P83-S85 PolarHBondContact O-N 2.93Å; P83-S85 PolarHBondContact O-OG 2.93Å
84	W	57	Low	54.6	Low	235 Å²	235	130.5 Å²	130.5	89%	0.89	75%	0.745	S	S	*	*			trans	-54	100.6	161.7	90.7	-61.5	0	0	0	105.1	L82 A86	L82-W84 PolarHBondContact O-N 3.48Å; W84-A86 PolarHBondContact O-N 3.2Å; W84-A86 VanDerWaalsContact O-N 3.11Å
85	S	56.3	Low	54.1	Low	95 Å²	95	133.6 Å²	133.6	66%	0.664	76%	0.756	S	S	*	*			trans	-77.4	114.7	-172.1	-73	0	0	0	0	104.7	P83 A87	P83-S85 PolarHBondContact O-N 2.93Å; P83-S85 PolarHBondContact O-OG 2.93Å; S85-A87 PolarHBondContact O-N 3.39Å
86	A	49.4	Very low	53.8	Low	73 Å²	73	127.1 Å²	127.1	60%	0.603	76%	0.755	S	S	*	*			trans	-40.8	126.2	171.2	0	0	0	0	0	109.3	W84 A88	W84-A86 PolarHBondContact O-N 3.2Å; W84-A86 VanDerWaalsContact O-N 3.11Å; A86-A88 PolarHBondContact O-N 3.4Å
87	A	47.7	Very low	53.2	Low	98 Å²	98	128.2 Å²	128.2	81%	0.81	76%	0.76	S	S	*	*			trans	-60.6	94.2	162.2	0	0	0	0	0	107.5	S85 S89	S85-A87 PolarHBondContact O-N 3.39Å; A87-S89 VanDerWaalsContact C-N 3.34Å; A87-S89 PolarHBondContact O-N 3.43Å
88	A	46.4	Very low	52.6	Low	99 Å²	99	127.2 Å²	127.2	82%	0.818	76%	0.761	S	S	*	*			trans	-78.8	90.2	163.5	0	0	0	0	0	107.2	A86	A86-A88 PolarHBondContact O-N 3.4Å
89	S	53.5	Low	52	Low	111 Å²	111	129.5 Å²	129.5	78%	0.776	77%	0.768	S	S	*	*			trans	-107	104.1	161.3	-74.2	0	0	0	0	108.5	A87	A87-S89 VanDerWaalsContact C-N 3.34Å; A87-S89 PolarHBondContact O-N 3.43Å
90	F	55.8	Low	51.3	Low	197 Å²	197	129.3 Å²	129.3	86%	0.864	76%	0.762	S	S	*	*			trans	71.2	117.6	136.6	-154.7	-108.8	0	0	0	118.8
91	Y	42.6	Very low	50.9	Low	217 Å²	217	131.1 Å²	131.1	85%	0.851	76%	0.764	S	S	*	*			trans	-56.7	138.5	178.7	-72.6	-99.6	0	0	0	113.9
92	Q	46.5	Very low	50.9	Low	187 Å²	187	133.3 Å²	133.3	87%	0.874	77%	0.773	S	S	*	*			trans	-142	135.4	145.8	-166.8	77.8	49.6	0	0	108.3
93	A	44.1	Very low	50.7	Low	98 Å²	98	132.6 Å²	132.6	81%	0.81	78%	0.778	S	S	*	*			trans	-63.2	160.1	-165.9	0	0	0	0	0	116.9
94	G	43.6	Very low	50.7	Low	66 Å²	66	134.4 Å²	134.4	68%	0.68	79%	0.79	S	S	*	*			trans	159.2	96.1	161.6	0	0	0	0	0	114.6
95	D	49.7	Very low	50.9	Low	169 Å²	169	131.4 Å²	131.4	90%	0.904	79%	0.789	S	S	*	*			trans	58.3	100.7	144.1	-52.3	-33.5	0	0	0	122.2
96	G	46	Very low	50.7	Low	80 Å²	80	133 Å²	133	83%	0.825	80%	0.796	S	S	*	*				52.8	110.1	120.5	0	0	0	0	0	121.9
97	F	48	Very low	50.7	Low	210 Å²	210	133.8 Å²	133.8	92%	0.921	80%	0.802	S	S	*	*				-162.3	136.7	121.8	-148.6	-105.8	0	0	0	110.9
98	A	49.2	Very low	50.8	Low	72 Å²	72	133.6 Å²	133.6	60%	0.595	80%	0.8	S	S	*	*			trans	-81	155.1	-174.8	0	0	0	0	0	112.7
99	L	51.1	Low	51	Low	136 Å²	136	134.8 Å²	134.8	71%	0.712	80%	0.803	S	S	*	*				160.3	131.4	111.3	-82.1	175	0	0	0	113.9
100	K	48.7	Very low	50.9	Low	171 Å²	171	133.6 Å²	133.6	74%	0.743	80%	0.799	S	S	*	*			trans	77.3	97.5	146.9	-62.2	166.6	-178.4	-163.4	0	117.6
101	T	53.7	Low	50.7	Low	127 Å²	127	132.7 Å²	132.7	78%	0.779	80%	0.8	S	S	*	*				56	102.5	75.3	68.8	0	0	0	0	115.4
102	V	57.2	Low	51.4	Low	149 Å²	149	130.4 Å²	130.4	90%	0.903	80%	0.797	S	S	*	*			trans	-156.2	129.4	131.8	-178.6	0	0	0	0	108.4
103	S	56.6	Low	51.9	Low	107 Å²	107	130.1 Å²	130.1	75%	0.748	79%	0.793	S	S	*	*			trans	-87.8	161.9	-176.2	-38.9	0	0	0	0	113.1
104	P	61.7	Low	52.5	Low	125 Å²	125	131.5 Å²	131.5	81%	0.812	79%	0.794	S	S	*	*			trans	-91.5	153	-170.9	36.2	-32.4	0	0	0	113.5
105	I	60.5	Low	53.3	Low	172 Å²	172	138.7 Å²	138.7	88%	0.882	80%	0.801	S	S	*	*			trans	-120.1	128.3	167.9	-72.2	176.7	0	0	0	111.1
106	T	53.4	Low	53.8	Low	130 Å²	130	139.9 Å²	139.9	80%	0.798	80%	0.798	S	S	*	*			trans	-47.7	140.3	167.5	-40.5	0	0	0	0	115.6
107	A	49.3	Very low	54.4	Low	89 Å²	89	143.8 Å²	143.8	74%	0.736	80%	0.799	S	S	*	*			trans	165.6	102.5	138.1	0	0	0	0	0	108.1
108	A	49.3	Very low	55	Low	94 Å²	94	140.4 Å²	140.4	78%	0.777	80%	0.796	S	S	*	*				50.7	89.4	85.3	0	0	0	0	0	113.6
109	S	50.9	Low	55.3	Low	124 Å²	124	143.1 Å²	143.1	87%	0.867	81%	0.807	S	S	*	*			trans	-173.3	137.8	138.5	-98.9	0	0	0	0	113.6
110	A	50.5	Low	55.8	Low	85 Å²	85	140.7 Å²	140.7	70%	0.702	81%	0.807	S	S	*	*			trans	63.8	92	144.1	0	0	0	0	0	118.2	Q112	A110-Q112 PolarHBondContact O-N 3.28Å
111	M	52.1	Low	56.1	Low	179 Å²	179	140.7 Å²	140.7	88%	0.882	81%	0.814	S	S	*	*				16.1	95.2	115	-61.4	-80.6	154.6	0	0	115
112	Q	56.6	Low	56.3	Low	168 Å²	168	141.3 Å²	141.3	79%	0.785	81%	0.812	S	S	*	*			trans	-148	109.2	155.7	-165.8	75.9	6.9	0	0	107.7	A110	A110-Q112 PolarHBondContact O-N 3.28Å
113	F	57.3	Low	56.2	Low	181 Å²	181	140 Å²	140	79%	0.794	81%	0.806	S	S	*	*			trans	-51.9	125.6	169.7	-67.3	-91.9	0	0	0	109.2	R115	F113-R115 PolarHBondContact O-N 3.46Å
114	P	57.5	Low	56.1	Low	128 Å²	128	139.5 Å²	139.5	83%	0.831	80%	0.803	S	S	*	*			trans	-71	96.5	163.6	28.3	-27.4	0	0	0	106.1	F116	P114-F116 PolarHBondContact O-N 2.88Å
115	R	60.5	Low	55.7	Low	216 Å²	216	141.3 Å²	141.3	82%	0.815	80%	0.803	S	S	*	*			trans	-49.8	134.9	161.3	-69.1	-165.1	161.5	156.3	-1.2	107.9	F113	F113-R115 PolarHBondContact O-N 3.46Å
116	F	60.8	Low	55.9	Low	194 Å²	194	140.7 Å²	140.7	85%	0.851	80%	0.798	S	S	*	*	S	Bend	trans	-38	140.7	155.7	-72.6	-96.9	0	0	0	109.8	P114	P114-F116 PolarHBondContact O-N 2.88Å
117	L	58.3	Low	56.1	Low	163 Å²	163	140 Å²	140	85%	0.853	80%	0.796	S	S	*	*			trans	95	84.5	173.2	-48.4	170.4	0	0	0	116.5
118	T	60	Low	56.7	Low	138 Å²	138	143.9 Å²	143.9	85%	0.847	80%	0.803	S	S	*	*			trans	-150.6	107.9	137	35.7	0	0	0	0	109.2
119	P	56.1	Low	57.4	Low	129 Å²	129	144.8 Å²	144.8	84%	0.838	80%	0.8	S	S	*	*			trans	-94.2	98.8	166.9	33.4	-22.4	0	0	0	108.5
120	A	60.3	Low	57.9	Low	86 Å²	86	142 Å²	142	71%	0.711	79%	0.79	S	S	*	*			trans	-164.2	142.3	165.4	0	0	0	0	0	109.3
121	L	55.4	Low	58.8	Low	170 Å²	170	149.3 Å²	149.3	89%	0.89	80%	0.8	S	S	*	*			trans	89.4	70	176.9	-59.9	143.5	0	0	0	115.3
122	L	57.3	Low	59.8	Low	141 Å²	141	152.5 Å²	152.5	74%	0.738	80%	0.802	S	S	*	*			trans	-55.2	146.8	150.8	-126.8	77.7	0	0	0	110.1
123	P	56.5	Low	61	Low	120 Å²	120	153.3 Å²	153.3	78%	0.779	80%	0.803	S	S	*	*				-125.6	136.8	121.7	33.5	-27.1	0	0	0	112.2
124	S	54.5	Low	62.2	Low	97 Å²	97	155.2 Å²	155.2	68%	0.678	81%	0.805	S	S	*	*			trans	63	80.8	152.6	-141.4	0	0	0	0	116.5
125	M	53.2	Low	63.5	Low	163 Å²	163	159.5 Å²	159.5	80%	0.803	80%	0.804	S	S	*	*				63.7	64.7	94.5	-52.8	-90.7	173.6	0	0	112.7
126	M	64.4	Low	64.8	Low	159 Å²	159	156.6 Å²	156.6	78%	0.783	80%	0.8	S	S	*	*			trans	-111.2	129.8	154.2	-58	-148.2	157.1	0	0	106.9	L128	M126-L128 PolarHBondContact O-N 2.99Å
127	P	57.5	Low	66.3	Low	116 Å²	116	157.8 Å²	157.8	75%	0.753	80%	0.799	S	S	*	*			trans	-70.5	87.3	-177.1	27.7	-31.4	0	0	0	109.1	T129	P127-T129 PolarHBondContact O-N 2.95Å
128	L	62.4	Low	67.9	Low	170 Å²	170	151.9 Å²	151.9	89%	0.89	77%	0.769	S	S	*	*			trans	-71.7	46.9	162.5	-65	175.3	0	0	0	109.9	M126	M126-L128 PolarHBondContact O-N 2.99Å
129	T	62.9	Low	69.6	Low	114 Å²	114	152.5 Å²	152.5	70%	0.699	77%	0.766	S	S	*	*			trans	-143.6	37.1	172.9	63.5	0	0	0	0	110.6	P127 R131	P127-T129 PolarHBondContact O-N 2.95Å; T129-R131 PolarHBondContact O-N 3.36Å
130	G	62.6	Low	71.5	Confident	65 Å²	65	149.2 Å²	149.2	67%	0.67	74%	0.738	S	S	*	*			trans	-68.4	76.3	154.5	0	0	0	0	0	108.3	R132	G130-R132 PolarHBondContact O-N 2.73Å
131	R	69.3	Low	73.3	Confident	239 Å²	239	148 Å²	148	90%	0.902	73%	0.725	S	S	*	*			trans	-61.5	88.5	169.9	-77.5	-141.4	-115.9	-108	6	106.9	T129 K133	T129-R131 PolarHBondContact O-N 3.36Å; R131-K133 PolarHBondContact O-N 3.13Å
132	R	73.3	Confident	75.3	Confident	245 Å²	245	146.6 Å²	146.6	93%	0.925	71%	0.713	S	S	*	*			trans	-50.2	109.9	173.4	-78.5	-176.6	174.7	146	-1.5	106.5	G130 R134	G130-R132 PolarHBondContact O-N 2.73Å; R132-R134 PolarHBondContact O-N 2.95Å; R132-R134 VanDerWaalsContact O-N 3.1Å
133	K	81	Confident	77.2	Confident	186 Å²	186	147.2 Å²	147.2	81%	0.809	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-56.5	120.8	-179.7	-168.1	168.4	-177.5	177.5	0	106.8	R131 R135	R131-K133 PolarHBondContact O-N 3.13Å; K133-R135 PolarHBondContact O-N 3.49Å; K133-R135 VanDerWaalsContact O-N 3.1Å
134	R	83.7	Confident	79.2	Confident	221 Å²	221	143.2 Å²	143.2	83%	0.834	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-56.1	120.7	178.7	-175.5	176.5	179.7	171.9	0.7	107.4	R132	R132-R134 PolarHBondContact O-N 2.95Å; R132-R134 VanDerWaalsContact O-N 3.1Å
135	R	83.6	Confident	81.3	Confident	218 Å²	218	141.2 Å²	141.2	82%	0.823	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-58.3	140.1	177.5	-79	-173.7	-81.1	-176.2	-5.9	109.6	K133 R137	K133-R135 PolarHBondContact O-N 3.49Å; K133-R135 VanDerWaalsContact O-N 3.1Å; R135-R137 PolarHBondContact O-N 3.32Å
136	H	88.7	Confident	83.4	Confident	155 Å²	155	137.6 Å²	137.6	72%	0.718	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-60.2	126.7	173.2	-69	-80.2	0	0	0	109.9	R176	H136-R176 PolarHBondContact O-NH2 2.93Å
137	R	90.6	Very high	85	Confident	219 Å²	219	134 Å²	134	83%	0.826	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-86.6	130.8	176.8	-177.9	177.6	-176.4	175.6	2.5	108.9	R135	R135-R137 PolarHBondContact O-N 3.32Å
138	T	93	Very high	86.9	Confident	39 Å²	39	128.5 Å²	128.5	24%	0.239	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-76.3	135.4	170.8	-52.6	0	0	0	0	109.8	F140 L172 R176	T138-F140 HydrophobicContact CG2-CD1 4.34Å; T138-F140 HydrophobicContact CG2-CE1 4.05Å; T138-F140 HydrophobicContact CG2-CZ 4.27Å; T138-L172 HydrophobicContact CG2-CD2 4.08Å; T138-R176 WeakPolarHBondContact OG1-CD 3.23Å; T138-R176 VanDerWaalsContact OG1-CZ 3.28Å; T138-R176 PolarHBondContact OG1-NE 3.27Å
139	I	95.2	Very high	88.6	Confident	151 Å²	151	122.9 Å²	122.9	77%	0.774	57%	0.566	S	S	*	*			trans	-107.7	130.5	167.4	-56.7	175.6	0	0	0	105.8
140	F	96.1	Very high	90.3	Very high	60 Å²	60	119.1 Å²	119.1	26%	0.263	55%	0.547	S	S	.	.			trans	-93	137.9	179.7	-57.9	-79.9	0	0	0	109.5	T138 Q144 L145 L148 L172 W180	T138-F140 HydrophobicContact CG2-CD1 4.34Å; T138-F140 HydrophobicContact CG2-CE1 4.05Å; T138-F140 HydrophobicContact CG2-CZ 4.27Å; F140-Q144 VanDerWaalsContact CA-OE1 3.29Å; F140-L145 HydrophobicContact CB-CD1 4.48Å; F140-L145 HydrophobicContact CB-CD2 3.74Å; F140-L145 HydrophobicContact CB-CG 3.91Å; F140-L145 HydrophobicContact CD2-CD2 4.42Å; F140-L145 HydrophobicContact CG-CD2 4.15Å; F140-L148 HydrophobicContact CD1-CD1 4.39Å; F140-L172 HydrophobicContact CD1-CD1 3.73Å; F140-L172 HydrophobicContact CD1-CD2 4.34Å; F140-L172 HydrophobicContact CE1-CD1 3.61Å; F140-L172 HydrophobicContact CE1-CD2 4.29Å; F140-W180 AromaticContact CE2-CD1 3.71Å; F140-W180 HydrophobicContact CZ-CB 4.15Å; F140-W180 AromaticContact CZ-CD1 3.76Å; F140-W180 HydrophobicContact CZ-CG 4.34Å
141	S	97.8	Very high	91.9	Very high	60 Å²	60	116.5 Å²	116.5	42%	0.42	52%	0.518	S	S	.	.			trans	-69.4	156.4	166.3	177.6	0	0	0	0	110.3	E143 Q144 L145	S141-E143 VanDerWaalsContact C-N 3.32Å; S141-E143 PolarHBondContact O-N 3.04Å; S141-Q144 WeakPolarHBondContact O-CB 3.4Å; S141-Q144 PolarHBondContact O-N 3.33Å; S141-L145 WeakPolarHBondContact O-CG 3.36Å; S141-L145 PolarHBondContact O-N 3.13Å; S141-L145 VanDerWaalsContact O-N 3.1Å
142	E	97.8	Very high	93.2	Very high	140 Å²	140	105.3 Å²	105.3	65%	0.654	48%	0.476	S	S	*	.	H	α-helix	trans	-59.3	-43.2	175.7	-172	59.5	-152.2	0	0	111.5	Q144 L145 V146	E142-Q144 VanDerWaalsContact C-N 3.29Å; E142-Q144 PolarHBondContact O-N 3.17Å; E142-L145 WeakPolarHBondContact O-CB 3.2Å; E142-L145 PolarHBondContact O-N 2.86Å; E142-V146 WeakPolarHBondContact O-CG2 3.46Å; E142-V146 PolarHBondContact O-N 2.72Å
143	E	97.5	Very high	94.3	Very high	154 Å²	154	100.9 Å²	100.9	72%	0.72	47%	0.466	S	S	*	.	H	α-helix	trans	-58.9	-40.5	177.7	-64	176.8	176.8	0	0	112.1	S141 L145 V146 E147	S141-E143 VanDerWaalsContact C-N 3.32Å; S141-E143 PolarHBondContact O-N 3.04Å; E143-L145 VanDerWaalsContact C-N 3.34Å; E143-L145 PolarHBondContact O-N 3.4Å; E143-V146 PolarHBondContact O-N 2.96Å; E143-E147 PolarHBondContact O-N 3.32Å
144	Q	98.1	Very high	95	Very high	37 Å²	37	99.3 Å²	99.3	17%	0.173	46%	0.459	C	S	.	.	H	α-helix	trans	-64.5	-40.8	175.7	-65.1	172.4	-28.6	0	0	111.1	F140 S141 E142 V146 E147 L148 T170	F140-Q144 VanDerWaalsContact CA-OE1 3.29Å; S141-Q144 WeakPolarHBondContact O-CB 3.4Å; S141-Q144 PolarHBondContact O-N 3.33Å; E142-Q144 VanDerWaalsContact C-N 3.29Å; E142-Q144 PolarHBondContact O-N 3.17Å; Q144-V146 VanDerWaalsContact C-N 3.34Å; Q144-E147 PolarHBondContact O-N 3.45Å; Q144-L148 WeakPolarHBondContact O-CB 3.5Å; Q144-L148 WeakPolarHBondContact O-CD1 3.39Å; Q144-L148 WeakPolarHBondContact O-CG 3.21Å; Q144-L148 PolarHBondContact O-N 2.83Å; Q144-L148 VanDerWaalsContact O-N 3.08Å; Q144-T170 HydrophobicContact CB-CG2 4.35Å; Q144-T170 PolarHBondContact NE2-O 2.87Å
145	L	98.1	Very high	95.6	Very high	54 Å²	54	90.3 Å²	90.3	28%	0.283	43%	0.428	S	S	.	.	H	α-helix	trans	-65.8	-37.2	178.5	-67.3	175.4	0	0	0	111.9	F140 S141 E142 E143 L148 E149	F140-L145 HydrophobicContact CB-CD1 4.48Å; F140-L145 HydrophobicContact CB-CD2 3.74Å; F140-L145 HydrophobicContact CB-CG 3.91Å; F140-L145 HydrophobicContact CD2-CD2 4.42Å; F140-L145 HydrophobicContact CG-CD2 4.15Å; S141-L145 WeakPolarHBondContact O-CG 3.36Å; S141-L145 PolarHBondContact O-N 3.13Å; S141-L145 VanDerWaalsContact O-N 3.1Å; E142-L145 WeakPolarHBondContact O-CB 3.2Å; E142-L145 PolarHBondContact O-N 2.86Å; E143-L145 VanDerWaalsContact C-N 3.34Å; E143-L145 PolarHBondContact O-N 3.4Å; L145-L148 PolarHBondContact O-N 3.47Å; L145-E149 VanDerWaalsContact O-CB 3.26Å; L145-E149 WeakPolarHBondContact O-CB 3.48Å; L145-E149 PolarHBondContact O-N 2.96Å
146	V	97.9	Very high	96.2	Very high	88 Å²	88	81.9 Å²	81.9	53%	0.533	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-49.4	176.4	172.1	0	0	0	0	111	E142 E143 Q144 E149 A150	E142-V146 WeakPolarHBondContact O-CG2 3.46Å; E142-V146 PolarHBondContact O-N 2.72Å; E143-V146 PolarHBondContact O-N 2.96Å; Q144-V146 VanDerWaalsContact C-N 3.34Å; V146-E149 PolarHBondContact O-N 3.07Å; V146-A150 VanDerWaalsContact O-CB 3.23Å; V146-A150 WeakPolarHBondContact O-CB 3.47Å; V146-A150 PolarHBondContact O-N 3.39Å
147	E	97.4	Very high	96.7	Very high	84 Å²	84	79.7 Å²	79.7	39%	0.393	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-42.6	178.1	-79.2	-71.6	177.3	0	0	112.8	E143 Q144 A150 T151 T170	E143-E147 PolarHBondContact O-N 3.32Å; Q144-E147 PolarHBondContact O-N 3.45Å; E147-A150 PolarHBondContact O-N 3.16Å; E147-T151 PolarHBondContact O-N 3.33Å; E147-T151 PolarHBondContact O-OG1 3.35Å; E147-T170 HydrophobicContact CB-CG2 3.98Å
148	L	98.4	Very high	96.9	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-43.9	177.9	-71.1	169.6	0	0	0	111.6	F140 Q144 L145 T151 F152 L166 T170 L172 V177 W180 F181	F140-L148 HydrophobicContact CD1-CD1 4.39Å; Q144-L148 WeakPolarHBondContact O-CB 3.5Å; Q144-L148 WeakPolarHBondContact O-CD1 3.39Å; Q144-L148 WeakPolarHBondContact O-CG 3.21Å; Q144-L148 PolarHBondContact O-N 2.83Å; Q144-L148 VanDerWaalsContact O-N 3.08Å; L145-L148 PolarHBondContact O-N 3.47Å; L148-T151 PolarHBondContact O-N 3.08Å; L148-F152 WeakPolarHBondContact O-CB 3.42Å; L148-F152 PolarHBondContact O-N 2.92Å; L148-L166 HydrophobicContact CD2-CD1 4.47Å; L148-T170 HydrophobicContact CG-CG2 4.45Å; L148-L172 HydrophobicContact CD1-CD1 4.39Å; L148-V177 HydrophobicContact CD2-CG1 4Å; L148-V177 HydrophobicContact CD2-CG2 4.39Å; L148-W180 HydrophobicContact CB-CD2 4.08Å; L148-W180 HydrophobicContact CB-CE3 4.01Å; L148-W180 HydrophobicContact CB-CH2 3.63Å; L148-W180 HydrophobicContact CB-CZ2 3.65Å; L148-W180 HydrophobicContact CB-CZ3 3.8Å; L148-W180 HydrophobicContact CD1-CD2 3.89Å; L148-W180 HydrophobicContact CD1-CE3 4.45Å; L148-W180 HydrophobicContact CD1-CG 3.95Å; L148-W180 HydrophobicContact CD1-CZ2 4.5Å; L148-W180 HydrophobicContact CD2-CD2 4.49Å; L148-W180 HydrophobicContact CD2-CE3 4.29Å; L148-W180 HydrophobicContact CG-CD2 4.39Å; L148-W180 HydrophobicContact CG-CE3 4.49Å; L148-F181 HydrophobicContact CD2-CE2 4.02Å
149	E	98.2	Very high	97.2	Very high	51 Å²	51	72.9 Å²	72.9	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-70.8	-37.8	178.2	-165.6	67.3	-160.5	0	0	111.7	L145 V146 T151 F152 Q153 R184	L145-E149 VanDerWaalsContact O-CB 3.26Å; L145-E149 WeakPolarHBondContact O-CB 3.48Å; L145-E149 PolarHBondContact O-N 2.96Å; V146-E149 PolarHBondContact O-N 3.07Å; E149-T151 VanDerWaalsContact C-N 3.25Å; E149-T151 PolarHBondContact O-N 3.48Å; E149-F152 WeakPolarHBondContact O-CB 3.38Å; E149-F152 PolarHBondContact O-N 3.46Å; E149-F152 VanDerWaalsContact O-N 3.11Å; E149-Q153 WeakPolarHBondContact O-CG 3.26Å; E149-Q153 PolarHBondContact O-N 2.92Å; E149-R184 IonicContact OE1-CZ 3.21Å; E149-R184 IonicContact OE1-NE 2.77Å; E149-R184 PolarHBondContact OE1-NE 2.83Å; E149-R184 IonicContact OE1-NH2 3.66Å; E149-R184 PolarHBondContact OE1-NH2 2.92Å; E149-R184 WeakPolarHBondContact OE2-CD 3.23Å; E149-R184 IonicContact OE2-CZ 3.39Å; E149-R184 IonicContact OE2-NE 2.8Å; E149-R184 PolarHBondContact OE2-NE 3.18Å; E149-R184 IonicContact OE2-NH2 2.72Å
150	A	97.4	Very high	97.2	Very high	35 Å²	35	68.8 Å²	68.8	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-59.4	-37.8	173.8	0	0	0	0	0	111.7	V146 E147	V146-A150 VanDerWaalsContact O-CB 3.23Å; V146-A150 WeakPolarHBondContact O-CB 3.47Å; V146-A150 PolarHBondContact O-N 3.39Å; E147-A150 PolarHBondContact O-N 3.16Å
151	T	96.8	Very high	97.3	Very high	10 Å²	10	71.3 Å²	71.3	6%	0.061	36%	0.361	C	S	.	.	H	α-helix	trans	-75.8	-35.7	173.8	-55.3	0	0	0	0	112.3	E147 L148 E149 Q153 K154 T155 L162 L166 F181	E147-T151 PolarHBondContact O-N 3.33Å; E147-T151 PolarHBondContact O-OG1 3.35Å; L148-T151 PolarHBondContact O-N 3.08Å; E149-T151 VanDerWaalsContact C-N 3.25Å; E149-T151 PolarHBondContact O-N 3.48Å; T151-Q153 PolarHBondContact O-N 2.94Å; T151-K154 WeakPolarHBondContact O-CA 3.42Å; T151-K154 WeakPolarHBondContact O-CB 3.43Å; T151-K154 PolarHBondContact O-N 2.91Å; T151-T155 HydrophobicContact CG2-CG2 4.43Å; T151-T155 PolarHBondContact O-N 2.8Å; T151-L162 HydrophobicContact CG2-CD1 4.48Å; T151-L162 HydrophobicContact CG2-CD2 3.99Å; T151-L162 HydrophobicContact CG2-CG 4.35Å; T151-L166 HydrophobicContact CG2-CD1 3.8Å; T151-L166 WeakPolarHBondContact OG1-CD2 3.35Å; T151-F181 HydrophobicContact CG2-CZ 4.21Å
152	F	97.5	Very high	97.3	Very high	5 Å²	5	71.1 Å²	71.1	2%	0.022	36%	0.355	C	S	.	.	H	α-helix	trans	-57.3	-38.8	174.1	-170.5	-98.3	0	0	0	111.9	L148 E149 K154 T155 H156 W180 F181 R184 R185 W188	L148-F152 WeakPolarHBondContact O-CB 3.42Å; L148-F152 PolarHBondContact O-N 2.92Å; E149-F152 WeakPolarHBondContact O-CB 3.38Å; E149-F152 PolarHBondContact O-N 3.46Å; E149-F152 VanDerWaalsContact O-N 3.11Å; F152-K154 VanDerWaalsContact C-N 3.26Å; F152-K154 PolarHBondContact O-N 2.85Å; F152-T155 CarbonylContact O-C 3.52Å; F152-T155 PolarHBondContact O-N 3.35Å; F152-H156 AromaticContact CD1-CD2 3.63Å; F152-H156 AromaticContact CD1-NE2 3.93Å; F152-H156 AromaticContact CD2-CD2 3.85Å; F152-H156 AromaticContact CE1-CD2 3.28Å; F152-H156 WeakPolarHBondContact CE1-CD2 3.41Å; F152-H156 AromaticContact CE1-NE2 3.43Å; F152-H156 WeakPolarHBondContact CE1-NE2 3.44Å; F152-H156 HydrophobicContact CE2-CB 4.02Å; F152-H156 AromaticContact CE2-CD2 3.54Å; F152-H156 AromaticContact CE2-CG 4Å; F152-H156 AromaticContact CG-CD2 3.89Å; F152-H156 HydrophobicContact CZ-CB 4.32Å; F152-H156 AromaticContact CZ-CD2 3.23Å; F152-H156 WeakPolarHBondContact CZ-CD2 2.79Å; F152-H156 AromaticContact CZ-CG 3.84Å; F152-H156 AromaticContact CZ-NE2 3.73Å; F152-H156 PolarHBondContact O-CD2 3.37Å; F152-W180 HydrophobicContact CB-CH2 4.23Å; F152-W180 HydrophobicContact CB-CZ3 4.27Å; F152-W180 HydrophobicContact CD2-CZ3 4.35Å; F152-F181 HydrophobicContact CB-CE1 4.19Å; F152-F181 AromaticContact CD2-CD1 3.9Å; F152-F181 HydrophobicContact CD2-CD1 3.9Å; F152-F181 AromaticContact CD2-CE1 3.92Å; F152-F181 HydrophobicContact CD2-CE1 3.92Å; F152-R184 HydrophobicContact CD1-CG 4.08Å; F152-R184 HydrophobicContact CD2-CB 4.23Å; F152-R184 HydrophobicContact CD2-CG 3.55Å; F152-R184 HydrophobicContact CE1-CG 3.98Å; F152-R184 HydrophobicContact CE2-CB 4.01Å; F152-R184 HydrophobicContact CE2-CG 3.44Å; F152-R184 VanDerWaalsContact CE2-CG 3.44Å; F152-R184 HydrophobicContact CG-CG 3.88Å; F152-R184 HydrophobicContact CZ-CG 3.68Å; F152-R185 HydrophobicContact CE2-CG 4.02Å; F152-W188 HydrophobicContact CZ-CB 4.16Å; F152-W188 HydrophobicContact CZ-CG 4.27Å
153	Q	96.1	Very high	97.3	Very high	152 Å²	152	66.8 Å²	66.8	71%	0.71	33%	0.333	S	S	*	.	H	α-helix	trans	-63.4	-29.1	174.5	-69.1	174.9	11.2	0	0	113.4	E149 T151	E149-Q153 WeakPolarHBondContact O-CG 3.26Å; E149-Q153 PolarHBondContact O-N 2.92Å; T151-Q153 PolarHBondContact O-N 2.94Å
154	K	95.8	Very high	97.4	Very high	153 Å²	153	64 Å²	64	67%	0.665	32%	0.319	S	S	*	.	H	α-helix	trans	-82.3	-44.1	176.2	-62.1	173.4	-175.6	174.7	0	111.8	Q19 T151 F152	Q19-K154 PolarHBondContact NE2-O 3.28Å; T151-K154 WeakPolarHBondContact O-CA 3.42Å; T151-K154 WeakPolarHBondContact O-CB 3.43Å; T151-K154 PolarHBondContact O-N 2.91Å; F152-K154 VanDerWaalsContact C-N 3.26Å; F152-K154 PolarHBondContact O-N 2.85Å
155	T	96.1	Very high	97.4	Very high	31 Å²	31	67.8 Å²	67.8	19%	0.19	34%	0.337	C	S	.	.			trans	-152.7	130.3	177.2	178.5	0	0	0	0	111.6	T151 F152 Y157 P158 L162	T151-T155 HydrophobicContact CG2-CG2 4.43Å; T151-T155 PolarHBondContact O-N 2.8Å; F152-T155 CarbonylContact O-C 3.52Å; F152-T155 PolarHBondContact O-N 3.35Å; T155-Y157 VanDerWaalsContact C-N 3.28Å; T155-Y157 PolarHBondContact OG1-N 3.1Å; T155-Y157 VanDerWaalsContact OG1-N 3.16Å; T155-Y157 PolarHBondContact OG1-O 3.09Å; T155-P158 HydrophobicContact CG2-CB 4.34Å; T155-L162 HydrophobicContact CG2-CD2 3.76Å
156	H	96.4	Very high	97.3	Very high	42 Å²	42	65.4 Å²	65.4	19%	0.194	33%	0.325	C	S	.	.	S	Bend	trans	-76.3	-17.4	172.8	-58	151.4	0	0	0	113	Y23 F152 P158 R185 W188	Y23-H156 AromaticContact CE2-ND1 3.94Å; F152-H156 AromaticContact CD1-CD2 3.63Å; F152-H156 AromaticContact CD1-NE2 3.93Å; F152-H156 AromaticContact CD2-CD2 3.85Å; F152-H156 AromaticContact CE1-CD2 3.28Å; F152-H156 WeakPolarHBondContact CE1-CD2 3.41Å; F152-H156 AromaticContact CE1-NE2 3.43Å; F152-H156 WeakPolarHBondContact CE1-NE2 3.44Å; F152-H156 HydrophobicContact CE2-CB 4.02Å; F152-H156 AromaticContact CE2-CD2 3.54Å; F152-H156 AromaticContact CE2-CG 4Å; F152-H156 AromaticContact CG-CD2 3.89Å; F152-H156 HydrophobicContact CZ-CB 4.32Å; F152-H156 AromaticContact CZ-CD2 3.23Å; F152-H156 WeakPolarHBondContact CZ-CD2 2.79Å; F152-H156 AromaticContact CZ-CG 3.84Å; F152-H156 AromaticContact CZ-NE2 3.73Å; F152-H156 PolarHBondContact O-CD2 3.37Å; H156-P158 WeakPolarHBondContact O-CD 3.48Å; H156-R185 HydrophobicContact CB-CG 4.38Å; H156-R185 WeakPolarHBondContact O-CD 3.38Å; H156-R185 PolarHBondContact O-NH1 3.46Å; H156-W188 AromaticContact CE1-NE1 3.87Å
157	Y	97.8	Very high	97.3	Very high	109 Å²	109	61.6 Å²	61.6	43%	0.427	30%	0.302	S	S	.	.	S	Bend	trans	-125.5	74.9	-176.2	-63.3	-82.4	0	0	0	109.6	Y23 T155	Y23-Y157 HydrophobicContact CD2-CE2 4.13Å; Y23-Y157 AromaticContact CE2-CE2 3.77Å; Y23-Y157 HydrophobicContact CE2-CE2 3.77Å; T155-Y157 VanDerWaalsContact C-N 3.28Å; T155-Y157 PolarHBondContact OG1-N 3.1Å; T155-Y157 VanDerWaalsContact OG1-N 3.16Å; T155-Y157 PolarHBondContact OG1-O 3.09Å
158	P	96.6	Very high	97.4	Very high	7 Å²	7	64.9 Å²	64.9	5%	0.045	32%	0.32	C	S	.	.			trans	-67.9	135.7	176.5	29.8	-36.7	0	0	0	110.8	T155 H156 L162 R163 F181	T155-P158 HydrophobicContact CG2-CB 4.34Å; H156-P158 WeakPolarHBondContact O-CD 3.48Å; P158-L162 HydrophobicContact CB-CB 4.24Å; P158-L162 HydrophobicContact CB-CD2 3.72Å; P158-L162 HydrophobicContact CB-CG 3.98Å; P158-R163 HydrophobicContact CB-CG 3.91Å; P158-R163 HydrophobicContact CG-CG 3.75Å; P158-R163 PolarHBondContact O-NH1 3.17Å; P158-F181 HydrophobicContact CB-CZ 4.49Å; P158-F181 VanDerWaalsContact CD-CD1 3.46Å; P158-F181 HydrophobicContact CG-CD1 3.64Å; P158-F181 HydrophobicContact CG-CD2 3.85Å; P158-F181 HydrophobicContact CG-CE1 3.64Å; P158-F181 HydrophobicContact CG-CE2 3.87Å; P158-F181 HydrophobicContact CG-CG 3.75Å; P158-F181 HydrophobicContact CG-CZ 3.78Å
159	D	97.5	Very high	97.3	Very high	107 Å²	107	71.6 Å²	71.6	57%	0.572	35%	0.349	S	S	*	.			trans	-68.9	165.1	173	-170.4	25.3	0	0	0	111.7	L161 L162 R163	D159-L161 VanDerWaalsContact C-N 3.33Å; D159-L161 PolarHBondContact O-N 2.86Å; D159-L162 PolarHBondContact O-N 3.1Å; D159-L162 VanDerWaalsContact O-N 3.11Å; D159-R163 WeakPolarHBondContact O-CG 3.45Å; D159-R163 PolarHBondContact O-N 2.94Å
160	V	97.2	Very high	97.2	Very high	65 Å²	65	69.4 Å²	69.4	39%	0.394	34%	0.339	S	S	.	.	H	α-helix	trans	-52	-49.6	-177.4	-179.3	0	0	0	0	111.2	L162 R163 E164	V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 PolarHBondContact O-N 3.38Å; V160-R163 PolarHBondContact O-N 3.41Å; V160-R163 VanDerWaalsContact O-N 3.12Å; V160-E164 WeakPolarHBondContact O-CG 3.27Å; V160-E164 PolarHBondContact O-N 3.45Å
161	L	97.6	Very high	97.2	Very high	114 Å²	114	74.7 Å²	74.7	60%	0.597	36%	0.362	S	S	*	.	H	α-helix	trans	-60.8	-41.6	180	-63.2	177	0	0	0	112.5	D159 R163 E164 Q165	D159-L161 VanDerWaalsContact C-N 3.33Å; D159-L161 PolarHBondContact O-N 2.86Å; L161-R163 VanDerWaalsContact C-N 3.33Å; L161-E164 PolarHBondContact O-N 3.46Å; L161-Q165 WeakPolarHBondContact O-CG 3.46Å; L161-Q165 PolarHBondContact O-N 3.31Å
162	L	97.2	Very high	97.2	Very high	55 Å²	55	75.6 Å²	75.6	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-68.1	-36.2	178.1	-179.3	57.9	0	0	0	111.1	T151 T155 P158 D159 V160 L166	T151-L162 HydrophobicContact CG2-CD1 4.48Å; T151-L162 HydrophobicContact CG2-CD2 3.99Å; T151-L162 HydrophobicContact CG2-CG 4.35Å; T155-L162 HydrophobicContact CG2-CD2 3.76Å; P158-L162 HydrophobicContact CB-CB 4.24Å; P158-L162 HydrophobicContact CB-CD2 3.72Å; P158-L162 HydrophobicContact CB-CG 3.98Å; D159-L162 PolarHBondContact O-N 3.1Å; D159-L162 VanDerWaalsContact O-N 3.11Å; V160-L162 VanDerWaalsContact C-N 3.34Å; V160-L162 PolarHBondContact O-N 3.38Å; L162-L166 WeakPolarHBondContact O-CG 3.4Å; L162-L166 PolarHBondContact O-N 2.99Å
163	R	98.1	Very high	97.2	Very high	50 Å²	50	82.7 Å²	82.7	19%	0.189	40%	0.397	C	S	.	.	H	α-helix	trans	-66.8	-40.2	174.8	-66.7	-162.6	-56	-116.4	10.8	112	P158 D159 V160 L161 L166 A167 E174 V177	P158-R163 HydrophobicContact CB-CG 3.91Å; P158-R163 HydrophobicContact CG-CG 3.75Å; P158-R163 PolarHBondContact O-NH1 3.17Å; D159-R163 WeakPolarHBondContact O-CG 3.45Å; D159-R163 PolarHBondContact O-N 2.94Å; V160-R163 PolarHBondContact O-N 3.41Å; V160-R163 VanDerWaalsContact O-N 3.12Å; L161-R163 VanDerWaalsContact C-N 3.33Å; R163-L166 PolarHBondContact O-N 3.2Å; R163-A167 VanDerWaalsContact O-CB 3.28Å; R163-A167 WeakPolarHBondContact O-CB 3.38Å; R163-A167 PolarHBondContact O-N 3.29Å; R163-E174 HydrophobicContact CB-CG 3.97Å; R163-E174 IonicContact CZ-OE1 3.24Å; R163-E174 VanDerWaalsContact CZ-OE1 3.24Å; R163-E174 IonicContact NE-OE1 2.77Å; R163-E174 PolarHBondContact NE-OE1 3.32Å; R163-E174 IonicContact NH2-OE1 2.83Å; R163-E174 PolarHBondContact NH2-OE1 3.37Å; R163-V177 HydrophobicContact CB-CG1 4.33Å; R163-V177 HydrophobicContact CG-CG1 4.33Å
164	E	98.4	Very high	97.3	Very high	95 Å²	95	78 Å²	78	44%	0.444	38%	0.376	S	S	.	.	H	α-helix	trans	-63.3	-44.5	175.2	-71	179.9	155.9	0	0	111.6	V160 L161 L166 A167 M168 E174	V160-E164 WeakPolarHBondContact O-CG 3.27Å; V160-E164 PolarHBondContact O-N 3.45Å; L161-E164 PolarHBondContact O-N 3.46Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.99Å; E164-A167 WeakPolarHBondContact O-CB 3.34Å; E164-A167 PolarHBondContact O-N 3.44Å; E164-M168 WeakPolarHBondContact O-CG 3.46Å; E164-M168 PolarHBondContact O-N 2.96Å; E164-E174 HydrophobicContact CG-CB 4.49Å; E164-E174 HydrophobicContact CG-CG 4.02Å
165	Q	98	Very high	97.3	Very high	116 Å²	116	75.7 Å²	75.7	54%	0.542	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-42.2	174.7	-72.8	177.4	-8.5	0	0	112.4	L161 M168 K169	L161-Q165 WeakPolarHBondContact O-CG 3.46Å; L161-Q165 PolarHBondContact O-N 3.31Å; Q165-M168 PolarHBondContact O-N 2.96Å; Q165-K169 WeakPolarHBondContact O-CG 3.36Å; Q165-K169 PolarHBondContact O-N 3.27Å
166	L	97.8	Very high	97.4	Very high	4 Å²	4	78.1 Å²	78.1	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-65.9	-39.9	174.9	-76.2	175.3	0	0	0	112.6	L148 T151 L162 R163 E164 M168 K169 T170 V177 F181	L148-L166 HydrophobicContact CD2-CD1 4.47Å; T151-L166 HydrophobicContact CG2-CD1 3.8Å; T151-L166 WeakPolarHBondContact OG1-CD2 3.35Å; L162-L166 WeakPolarHBondContact O-CG 3.4Å; L162-L166 PolarHBondContact O-N 2.99Å; R163-L166 PolarHBondContact O-N 3.2Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.99Å; L166-M168 VanDerWaalsContact C-N 3.28Å; L166-M168 PolarHBondContact O-N 2.8Å; L166-K169 PolarHBondContact O-N 3.47Å; L166-T170 WeakPolarHBondContact O-CB 3.2Å; L166-T170 PolarHBondContact O-N 3Å; L166-T170 PolarHBondContact O-OG1 3.23Å; L166-V177 HydrophobicContact CB-CG1 4.26Å; L166-V177 HydrophobicContact CD1-CG1 4.25Å; L166-F181 HydrophobicContact CD1-CE2 3.77Å; L166-F181 HydrophobicContact CD1-CZ 3.96Å
167	A	98.1	Very high	97.5	Very high	8 Å²	8	76.1 Å²	76.1	7%	0.066	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-43.1	177	0	0	0	0	0	110.8	R163 E164 D171 L172 E174 V177	R163-A167 VanDerWaalsContact O-CB 3.28Å; R163-A167 WeakPolarHBondContact O-CB 3.38Å; R163-A167 PolarHBondContact O-N 3.29Å; E164-A167 WeakPolarHBondContact O-CB 3.34Å; E164-A167 PolarHBondContact O-N 3.44Å; A167-D171 PolarHBondContact O-N 2.82Å; A167-D171 VanDerWaalsContact O-N 3.1Å; A167-L172 CarbonylContact C-O 3.59Å; A167-L172 WeakPolarHBondContact CB-O 3.41Å; A167-L172 PolarHBondContact O-N 3.1Å; A167-E174 HydrophobicContact CB-CB 4.31Å; A167-V177 HydrophobicContact CB-CG2 4.09Å
168	M	97.8	Very high	97.5	Very high	153 Å²	153	73.7 Å²	73.7	75%	0.754	36%	0.356	S	S	*	.	H	α-helix	trans	-64.9	-43.7	173.7	-65.5	176	70.9	0	0	112.7	E164 Q165 L166 T170	E164-M168 WeakPolarHBondContact O-CG 3.46Å; E164-M168 PolarHBondContact O-N 2.96Å; Q165-M168 PolarHBondContact O-N 2.96Å; L166-M168 VanDerWaalsContact C-N 3.28Å; L166-M168 PolarHBondContact O-N 2.8Å; M168-T170 VanDerWaalsContact C-N 3.33Å; M168-T170 PolarHBondContact O-N 2.84Å
169	K	97.2	Very high	97.5	Very high	141 Å²	141	76.2 Å²	76.2	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-67.2	-31.5	-179.6	-75.7	179.8	174.8	-173.7	0	114.1	Q165 L166	Q165-K169 WeakPolarHBondContact O-CG 3.36Å; Q165-K169 PolarHBondContact O-N 3.27Å; L166-K169 PolarHBondContact O-N 3.47Å
170	T	96.7	Very high	97.5	Very high	5 Å²	5	72.3 Å²	72.3	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-102.2	2	-175	56.1	0	0	0	0	113	Q144 E147 L148 L166 M168 L172	Q144-T170 HydrophobicContact CB-CG2 4.35Å; Q144-T170 PolarHBondContact NE2-O 2.87Å; E147-T170 HydrophobicContact CB-CG2 3.98Å; L148-T170 HydrophobicContact CG-CG2 4.45Å; L166-T170 WeakPolarHBondContact O-CB 3.2Å; L166-T170 PolarHBondContact O-N 3Å; L166-T170 PolarHBondContact O-OG1 3.23Å; M168-T170 VanDerWaalsContact C-N 3.33Å; M168-T170 PolarHBondContact O-N 2.84Å; T170-L172 VanDerWaalsContact C-N 3.28Å; T170-L172 PolarHBondContact O-N 3.36Å; T170-L172 WeakPolarHBondContact OG1-CD1 3.15Å
171	D	97.5	Very high	97.6	Very high	146 Å²	146	69.2 Å²	69.2	78%	0.781	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	42.2	-173.9	-61.3	-48.9	0	0	0	113.5	A167	A167-D171 PolarHBondContact O-N 2.82Å; A167-D171 VanDerWaalsContact O-N 3.1Å
172	L	95.9	Very high	97.6	Very high	29 Å²	29	68.7 Å²	68.7	15%	0.152	32%	0.323	C	S	.	.			trans	-116.8	163.5	178.5	-64.4	174	0	0	0	110.9	T138 F140 L148 A167 T170 R176 V177	T138-L172 HydrophobicContact CG2-CD2 4.08Å; F140-L172 HydrophobicContact CD1-CD1 3.73Å; F140-L172 HydrophobicContact CD1-CD2 4.34Å; F140-L172 HydrophobicContact CE1-CD1 3.61Å; F140-L172 HydrophobicContact CE1-CD2 4.29Å; L148-L172 HydrophobicContact CD1-CD1 4.39Å; A167-L172 CarbonylContact C-O 3.59Å; A167-L172 WeakPolarHBondContact CB-O 3.41Å; A167-L172 PolarHBondContact O-N 3.1Å; T170-L172 VanDerWaalsContact C-N 3.28Å; T170-L172 PolarHBondContact O-N 3.36Å; T170-L172 WeakPolarHBondContact OG1-CD1 3.15Å; L172-R176 HydrophobicContact CB-CB 4.44Å; L172-V177 HydrophobicContact CB-CG2 4.28Å; L172-V177 HydrophobicContact CD1-CG2 4.45Å
173	K	97	Very high	97.6	Very high	154 Å²	154	71.1 Å²	71.1	67%	0.67	34%	0.336	S	S	*	.			trans	-77.5	145.9	165.9	-61.8	-172.7	174.9	-175.2	0	109.8	E175 R176 V177	K173-E175 PolarHBondContact O-N 3.41Å; K173-R176 HydrophobicContact CB-CG 4.19Å; K173-R176 WeakPolarHBondContact O-CA 3.48Å; K173-R176 VanDerWaalsContact O-CB 3.31Å; K173-R176 WeakPolarHBondContact O-CB 3.42Å; K173-R176 PolarHBondContact O-N 3.41Å; K173-V177 PolarHBondContact O-N 3.24Å
174	E	98	Very high	97.7	Very high	54 Å²	54	70.8 Å²	70.8	25%	0.252	34%	0.335	S	S	.	.	H	α-helix	trans	-51.1	-42.5	175.6	-177.2	-83.4	164.3	0	0	111.9	R163 E164 A167 R176 V177 E178	R163-E174 HydrophobicContact CB-CG 3.97Å; R163-E174 IonicContact CZ-OE1 3.24Å; R163-E174 VanDerWaalsContact CZ-OE1 3.24Å; R163-E174 IonicContact NE-OE1 2.77Å; R163-E174 PolarHBondContact NE-OE1 3.32Å; R163-E174 IonicContact NH2-OE1 2.83Å; R163-E174 PolarHBondContact NH2-OE1 3.37Å; E164-E174 HydrophobicContact CG-CB 4.49Å; E164-E174 HydrophobicContact CG-CG 4.02Å; A167-E174 HydrophobicContact CB-CB 4.31Å; E174-R176 PolarHBondContact O-N 3.19Å; E174-V177 CarbonylContact O-C 3.57Å; E174-V177 WeakPolarHBondContact O-CA 3.37Å; E174-V177 WeakPolarHBondContact O-CB 3.4Å; E174-V177 PolarHBondContact O-N 3.36Å; E174-E178 PolarHBondContact O-N 3.1Å
175	E	97.1	Very high	97.6	Very high	105 Å²	105	68.3 Å²	68.3	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-55.6	-36.2	174.6	-171.4	-170	-177.4	0	0	112.7	K173 E178 V179	K173-E175 PolarHBondContact O-N 3.41Å; E175-E178 PolarHBondContact O-N 2.99Å; E175-V179 VanDerWaalsContact O-CG2 3.27Å; E175-V179 WeakPolarHBondContact O-CG2 3.35Å; E175-V179 PolarHBondContact O-N 2.8Å
176	R	97.4	Very high	97.6	Very high	82 Å²	82	64.6 Å²	64.6	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-71	-38.4	178	-60.1	-56.3	-176.8	165.2	6.8	111.4	H136 T138 L172 K173 E174 W180	H136-R176 PolarHBondContact O-NH2 2.93Å; T138-R176 WeakPolarHBondContact OG1-CD 3.23Å; T138-R176 VanDerWaalsContact OG1-CZ 3.28Å; T138-R176 PolarHBondContact OG1-NE 3.27Å; L172-R176 HydrophobicContact CB-CB 4.44Å; K173-R176 HydrophobicContact CB-CG 4.19Å; K173-R176 WeakPolarHBondContact O-CA 3.48Å; K173-R176 VanDerWaalsContact O-CB 3.31Å; K173-R176 WeakPolarHBondContact O-CB 3.42Å; K173-R176 PolarHBondContact O-N 3.41Å; E174-R176 PolarHBondContact O-N 3.19Å; R176-W180 WeakPolarHBondContact O-CB 3.4Å; R176-W180 PolarHBondContact O-N 2.79Å
177	V	97.9	Very high	97.5	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-46.6	173.2	179.8	0	0	0	0	109.6	L148 R163 L166 A167 L172 K173 E174 V179 W180 F181	L148-V177 HydrophobicContact CD2-CG1 4Å; L148-V177 HydrophobicContact CD2-CG2 4.39Å; R163-V177 HydrophobicContact CB-CG1 4.33Å; R163-V177 HydrophobicContact CG-CG1 4.33Å; L166-V177 HydrophobicContact CB-CG1 4.26Å; L166-V177 HydrophobicContact CD1-CG1 4.25Å; A167-V177 HydrophobicContact CB-CG2 4.09Å; L172-V177 HydrophobicContact CB-CG2 4.28Å; L172-V177 HydrophobicContact CD1-CG2 4.45Å; K173-V177 PolarHBondContact O-N 3.24Å; E174-V177 CarbonylContact O-C 3.57Å; E174-V177 WeakPolarHBondContact O-CA 3.37Å; E174-V177 WeakPolarHBondContact O-CB 3.4Å; E174-V177 PolarHBondContact O-N 3.36Å; V177-V179 PolarHBondContact O-N 3.32Å; V177-W180 WeakPolarHBondContact O-CB 3.43Å; V177-W180 PolarHBondContact O-N 2.97Å; V177-W180 VanDerWaalsContact O-N 3.14Å; V177-F181 HydrophobicContact CG1-CD2 3.66Å; V177-F181 HydrophobicContact CG1-CE2 3.65Å; V177-F181 WeakPolarHBondContact O-CD2 3.31Å; V177-F181 PolarHBondContact O-N 3.2Å
178	E	97.9	Very high	97.3	Very high	58 Å²	58	72.6 Å²	72.6	27%	0.271	34%	0.342	S	S	.	.	H	α-helix	trans	-55.2	-50.3	176.4	-167.8	-148.8	137	0	0	111.8	E174 E175 W180 F181 K182	E174-E178 PolarHBondContact O-N 3.1Å; E175-E178 PolarHBondContact O-N 2.99Å; E178-W180 VanDerWaalsContact C-N 3.34Å; E178-W180 PolarHBondContact O-N 2.87Å; E178-F181 PolarHBondContact O-N 2.9Å; E178-K182 HydrophobicContact CG-CD 4.23Å; E178-K182 WeakPolarHBondContact O-CG 3.4Å; E178-K182 PolarHBondContact O-N 3.43Å; E178-K182 WeakPolarHBondContact OE1-CD 3.47Å; E178-K182 IonicContact OE1-NZ 3.29Å; E178-K182 PolarHBondContact OE1-NZ 3.11Å
179	V	97.4	Very high	97.2	Very high	59 Å²	59	70.4 Å²	70.4	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-39.3	178.3	172.8	0	0	0	0	111.5	E175 V177 K182 N183	E175-V179 VanDerWaalsContact O-CG2 3.27Å; E175-V179 WeakPolarHBondContact O-CG2 3.35Å; E175-V179 PolarHBondContact O-N 2.8Å; V177-V179 PolarHBondContact O-N 3.32Å; V179-K182 PolarHBondContact O-N 2.97Å; V179-N183 PolarHBondContact O-N 3.48Å; V179-N183 PolarHBondContact O-ND2 2.9Å
180	W	98.2	Very high	96.9	Very high	25 Å²	25	69.8 Å²	69.8	10%	0.095	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-49.8	175.3	-175.8	99.7	0	0	0	110.9	F140 L148 F152 R176 V177 E178 K182 N183 R184	F140-W180 AromaticContact CE2-CD1 3.71Å; F140-W180 HydrophobicContact CZ-CB 4.15Å; F140-W180 AromaticContact CZ-CD1 3.76Å; F140-W180 HydrophobicContact CZ-CG 4.34Å; L148-W180 HydrophobicContact CB-CD2 4.08Å; L148-W180 HydrophobicContact CB-CE3 4.01Å; L148-W180 HydrophobicContact CB-CH2 3.63Å; L148-W180 HydrophobicContact CB-CZ2 3.65Å; L148-W180 HydrophobicContact CB-CZ3 3.8Å; L148-W180 HydrophobicContact CD1-CD2 3.89Å; L148-W180 HydrophobicContact CD1-CE3 4.45Å; L148-W180 HydrophobicContact CD1-CG 3.95Å; L148-W180 HydrophobicContact CD1-CZ2 4.5Å; L148-W180 HydrophobicContact CD2-CD2 4.49Å; L148-W180 HydrophobicContact CD2-CE3 4.29Å; L148-W180 HydrophobicContact CG-CD2 4.39Å; L148-W180 HydrophobicContact CG-CE3 4.49Å; F152-W180 HydrophobicContact CB-CH2 4.23Å; F152-W180 HydrophobicContact CB-CZ3 4.27Å; F152-W180 HydrophobicContact CD2-CZ3 4.35Å; R176-W180 WeakPolarHBondContact O-CB 3.4Å; R176-W180 PolarHBondContact O-N 2.79Å; V177-W180 WeakPolarHBondContact O-CB 3.43Å; V177-W180 PolarHBondContact O-N 2.97Å; V177-W180 VanDerWaalsContact O-N 3.14Å; E178-W180 VanDerWaalsContact C-N 3.34Å; E178-W180 PolarHBondContact O-N 2.87Å; W180-K182 VanDerWaalsContact C-N 3.32Å; W180-K182 PolarHBondContact O-N 3.45Å; W180-N183 PolarHBondContact O-N 3.26Å; W180-R184 HydrophobicContact CD2-CB 4.49Å; W180-R184 HydrophobicContact CE3-CB 4.15Å; W180-R184 HydrophobicContact CH2-CB 4.13Å; W180-R184 HydrophobicContact CH2-CG 3.79Å; W180-R184 HydrophobicContact CZ2-CB 4.5Å; W180-R184 HydrophobicContact CZ2-CG 4.32Å; W180-R184 HydrophobicContact CZ3-CB 3.96Å; W180-R184 HydrophobicContact CZ3-CG 3.99Å; W180-R184 WeakPolarHBondContact O-CB 3.35Å; W180-R184 PolarHBondContact O-N 3.3Å
181	F	98.5	Very high	96.6	Very high	1 Å²	1	74 Å²	74	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-37.8	178.5	-89	-87.6	0	0	0	112.1	L148 T151 F152 P158 L166 V177 E178 R184 R185	L148-F181 HydrophobicContact CD2-CE2 4.02Å; T151-F181 HydrophobicContact CG2-CZ 4.21Å; F152-F181 HydrophobicContact CB-CE1 4.19Å; F152-F181 AromaticContact CD2-CD1 3.9Å; F152-F181 HydrophobicContact CD2-CD1 3.9Å; F152-F181 AromaticContact CD2-CE1 3.92Å; F152-F181 HydrophobicContact CD2-CE1 3.92Å; P158-F181 HydrophobicContact CB-CZ 4.49Å; P158-F181 VanDerWaalsContact CD-CD1 3.46Å; P158-F181 HydrophobicContact CG-CD1 3.64Å; P158-F181 HydrophobicContact CG-CD2 3.85Å; P158-F181 HydrophobicContact CG-CE1 3.64Å; P158-F181 HydrophobicContact CG-CE2 3.87Å; P158-F181 HydrophobicContact CG-CG 3.75Å; P158-F181 HydrophobicContact CG-CZ 3.78Å; L166-F181 HydrophobicContact CD1-CE2 3.77Å; L166-F181 HydrophobicContact CD1-CZ 3.96Å; V177-F181 HydrophobicContact CG1-CD2 3.66Å; V177-F181 HydrophobicContact CG1-CE2 3.65Å; V177-F181 WeakPolarHBondContact O-CD2 3.31Å; V177-F181 PolarHBondContact O-N 3.2Å; E178-F181 PolarHBondContact O-N 2.9Å; F181-R184 PolarHBondContact O-N 3.23Å; F181-R185 WeakPolarHBondContact O-CB 3.46Å; F181-R185 WeakPolarHBondContact O-CG 3.45Å; F181-R185 PolarHBondContact O-N 3.02Å
182	K	97.8	Very high	96	Very high	102 Å²	102	72 Å²	72	44%	0.443	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-47.8	173.9	-74.6	166.4	77.6	168.6	0	112	E178 V179 W180 R185 A186	E178-K182 HydrophobicContact CG-CD 4.23Å; E178-K182 WeakPolarHBondContact O-CG 3.4Å; E178-K182 PolarHBondContact O-N 3.43Å; E178-K182 WeakPolarHBondContact OE1-CD 3.47Å; E178-K182 IonicContact OE1-NZ 3.29Å; E178-K182 PolarHBondContact OE1-NZ 3.11Å; V179-K182 PolarHBondContact O-N 2.97Å; W180-K182 VanDerWaalsContact C-N 3.32Å; W180-K182 PolarHBondContact O-N 3.45Å; K182-R185 PolarHBondContact O-N 2.93Å; K182-A186 PolarHBondContact O-N 3.36Å
183	N	97.9	Very high	95.6	Very high	106 Å²	106	78.2 Å²	78.2	57%	0.567	35%	0.348	S	S	*	.	H	α-helix	trans	-66.2	-39.2	177.8	-72	-23.1	0	0	0	111.7	V179 W180 A186 K187	V179-N183 PolarHBondContact O-N 3.48Å; V179-N183 PolarHBondContact O-ND2 2.9Å; W180-N183 PolarHBondContact O-N 3.26Å; N183-A186 WeakPolarHBondContact O-CB 3.45Å; N183-A186 PolarHBondContact O-N 2.91Å; N183-K187 PolarHBondContact O-N 3Å
184	R	98.3	Very high	95.1	Very high	44 Å²	44	73.9 Å²	73.9	17%	0.166	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-45.7	177.2	-172.7	67.6	-171.6	104.1	-3.3	111.4	E149 F152 W180 F181 A186 K187 W188	E149-R184 IonicContact OE1-CZ 3.21Å; E149-R184 IonicContact OE1-NE 2.77Å; E149-R184 PolarHBondContact OE1-NE 2.83Å; E149-R184 IonicContact OE1-NH2 3.66Å; E149-R184 PolarHBondContact OE1-NH2 2.92Å; E149-R184 WeakPolarHBondContact OE2-CD 3.23Å; E149-R184 IonicContact OE2-CZ 3.39Å; E149-R184 IonicContact OE2-NE 2.8Å; E149-R184 PolarHBondContact OE2-NE 3.18Å; E149-R184 IonicContact OE2-NH2 2.72Å; F152-R184 HydrophobicContact CD1-CG 4.08Å; F152-R184 HydrophobicContact CD2-CB 4.23Å; F152-R184 HydrophobicContact CD2-CG 3.55Å; F152-R184 HydrophobicContact CE1-CG 3.98Å; F152-R184 HydrophobicContact CE2-CB 4.01Å; F152-R184 HydrophobicContact CE2-CG 3.44Å; F152-R184 VanDerWaalsContact CE2-CG 3.44Å; F152-R184 HydrophobicContact CG-CG 3.88Å; F152-R184 HydrophobicContact CZ-CG 3.68Å; W180-R184 HydrophobicContact CD2-CB 4.49Å; W180-R184 HydrophobicContact CE3-CB 4.15Å; W180-R184 HydrophobicContact CH2-CB 4.13Å; W180-R184 HydrophobicContact CH2-CG 3.79Å; W180-R184 HydrophobicContact CZ2-CB 4.5Å; W180-R184 HydrophobicContact CZ2-CG 4.32Å; W180-R184 HydrophobicContact CZ3-CB 3.96Å; W180-R184 HydrophobicContact CZ3-CG 3.99Å; W180-R184 WeakPolarHBondContact O-CB 3.35Å; W180-R184 PolarHBondContact O-N 3.3Å; F181-R184 PolarHBondContact O-N 3.23Å; R184-A186 VanDerWaalsContact C-N 3.32Å; R184-A186 PolarHBondContact O-N 2.77Å; R184-K187 PolarHBondContact O-N 3.48Å; R184-W188 WeakPolarHBondContact O-CB 3.34Å; R184-W188 PolarHBondContact O-N 2.85Å
185	R	97.9	Very high	94.5	Very high	43 Å²	43	75.8 Å²	75.8	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-38.4	171.9	-74	-167	-62.1	-90.7	3.4	112.3	F152 H156 F181 K182 W188 R189	F152-R185 HydrophobicContact CE2-CG 4.02Å; H156-R185 HydrophobicContact CB-CG 4.38Å; H156-R185 WeakPolarHBondContact O-CD 3.38Å; H156-R185 PolarHBondContact O-NH1 3.46Å; F181-R185 WeakPolarHBondContact O-CB 3.46Å; F181-R185 WeakPolarHBondContact O-CG 3.45Å; F181-R185 PolarHBondContact O-N 3.02Å; K182-R185 PolarHBondContact O-N 2.93Å; R185-W188 PolarHBondContact O-N 3.01Å; R185-R189 WeakPolarHBondContact O-CG 3.28Å; R185-R189 PolarHBondContact O-N 3.14Å
186	A	96.9	Very high	93.8	Very high	38 Å²	38	74.2 Å²	74.2	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-45.3	175	0	0	0	0	0	111.9	K182 N183 R184 R189 K190	K182-A186 PolarHBondContact O-N 3.36Å; N183-A186 WeakPolarHBondContact O-CB 3.45Å; N183-A186 PolarHBondContact O-N 2.91Å; R184-A186 VanDerWaalsContact C-N 3.32Å; R184-A186 PolarHBondContact O-N 2.77Å; A186-R189 PolarHBondContact O-N 3.21Å; A186-K190 PolarHBondContact O-N 2.72Å
187	K	96	Very high	93.2	Very high	125 Å²	125	76.3 Å²	76.3	54%	0.543	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-44.4	175.1	-173.3	178.7	179.4	-175.8	0	111.6	N183 R184 R189 K190 Q191	N183-K187 PolarHBondContact O-N 3Å; R184-K187 PolarHBondContact O-N 3.48Å; K187-R189 PolarHBondContact O-N 3.21Å; K187-K190 PolarHBondContact O-N 3.38Å; K187-Q191 WeakPolarHBondContact O-CG 3.43Å; K187-Q191 PolarHBondContact O-N 2.83Å
188	W	95.1	Very high	92.6	Very high	55 Å²	55	80.1 Å²	80.1	21%	0.208	38%	0.375	C	S	.	.	H	α-helix	trans	-59.6	-44.7	177.5	-178.6	94.2	0	0	0	111.8	Y23 F152 H156 R184 R185 K190 Q191 K192	Y23-W188 AromaticContact CD1-CH2 3.48Å; Y23-W188 HydrophobicContact CD1-CH2 3.48Å; Y23-W188 VanDerWaalsContact CD1-CH2 3.48Å; Y23-W188 HydrophobicContact CD1-CZ2 4.22Å; Y23-W188 HydrophobicContact CD1-CZ3 4.06Å; Y23-W188 HydrophobicContact CE1-CE3 4.01Å; Y23-W188 AromaticContact CE1-CH2 2.86Å; Y23-W188 HydrophobicContact CE1-CH2 2.86Å; Y23-W188 AromaticContact CE1-CZ2 3.85Å; Y23-W188 HydrophobicContact CE1-CZ2 3.85Å; Y23-W188 AromaticContact CE1-CZ3 2.99Å; Y23-W188 HydrophobicContact CE1-CZ3 2.99Å; Y23-W188 HydrophobicContact CE2-CH2 4.34Å; Y23-W188 HydrophobicContact CE2-CZ3 4.33Å; Y23-W188 HydrophobicContact CG-CH2 4.46Å; Y23-W188 AromaticContact CZ-CE3 3.69Å; Y23-W188 AromaticContact CZ-CH2 3.36Å; Y23-W188 AromaticContact CZ-CZ3 3.13Å; Y23-W188 WeakPolarHBondContact OH-CZ3 3.42Å; F152-W188 HydrophobicContact CZ-CB 4.16Å; F152-W188 HydrophobicContact CZ-CG 4.27Å; H156-W188 AromaticContact CE1-NE1 3.87Å; R184-W188 WeakPolarHBondContact O-CB 3.34Å; R184-W188 PolarHBondContact O-N 2.85Å; R185-W188 PolarHBondContact O-N 3.01Å; W188-K190 VanDerWaalsContact C-N 3.34Å; W188-K190 PolarHBondContact O-N 2.9Å; W188-Q191 PolarHBondContact O-N 2.77Å; W188-K192 HydrophobicContact CH2-CG 4.26Å; W188-K192 HydrophobicContact CZ3-CG 4.32Å; W188-K192 PolarHBondContact O-N 3.35Å
189	R	94.2	Very high	91.8	Very high	106 Å²	106	82.2 Å²	82.2	40%	0.4	39%	0.387	S	S	.	.	H	α-helix	trans	-65.7	-35.8	175.7	-75.1	-173.7	-72.2	97.2	-4.4	112.4	R185 A186 K187 R193	R185-R189 WeakPolarHBondContact O-CG 3.28Å; R185-R189 PolarHBondContact O-N 3.14Å; A186-R189 PolarHBondContact O-N 3.21Å; K187-R189 PolarHBondContact O-N 3.21Å; R189-R193 PolarHBondContact O-N 3.16Å
190	K	92.4	Very high	91.2	Very high	129 Å²	129	85.8 Å²	85.8	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-65.7	-47.3	176.5	-172.1	-177.8	174.9	-176.1	0	111.2	A186 K187 W188 K192 R193 D194	A186-K190 PolarHBondContact O-N 2.72Å; K187-K190 PolarHBondContact O-N 3.38Å; W188-K190 VanDerWaalsContact C-N 3.34Å; W188-K190 PolarHBondContact O-N 2.9Å; K190-K192 PolarHBondContact O-N 3.26Å; K190-R193 WeakPolarHBondContact O-CA 3.41Å; K190-R193 WeakPolarHBondContact O-CB 3.44Å; K190-R193 PolarHBondContact O-N 3.08Å; K190-D194 WeakPolarHBondContact CE-OD2 3.46Å; K190-D194 PolarHBondContact O-N 3.46Å
191	Q	88.6	Confident	90.4	Very high	93 Å²	93	87.5 Å²	87.5	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-54.6	-39.8	178.3	-74.8	174.1	-24.4	0	0	112.3	K187 W188 R193 D194 E195	K187-Q191 WeakPolarHBondContact O-CG 3.43Å; K187-Q191 PolarHBondContact O-N 2.83Å; W188-Q191 PolarHBondContact O-N 2.77Å; Q191-R193 VanDerWaalsContact C-N 3.34Å; Q191-R193 PolarHBondContact O-N 3.44Å; Q191-D194 PolarHBondContact O-N 3.36Å; Q191-E195 WeakPolarHBondContact O-CB 3.42Å; Q191-E195 PolarHBondContact O-N 3.04Å
192	K	86.1	Confident	89.5	Confident	104 Å²	104	91.3 Å²	91.3	45%	0.452	44%	0.441	S	S	.	.	H	α-helix	trans	-67.7	-29.2	176.3	-72	-73.2	156.8	-156.4	0	114.1	W188 K190 E195 V196	W188-K192 HydrophobicContact CH2-CG 4.26Å; W188-K192 HydrophobicContact CZ3-CG 4.32Å; W188-K192 PolarHBondContact O-N 3.35Å; K190-K192 PolarHBondContact O-N 3.26Å; K192-E195 IonicContact NZ-OE2 3.7Å; K192-E195 PolarHBondContact NZ-OE2 3.42Å; K192-V196 WeakPolarHBondContact O-CG2 3.48Å; K192-V196 PolarHBondContact O-N 3.34Å
193	R	87.4	Confident	88.5	Confident	159 Å²	159	89.9 Å²	89.9	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-75.9	-45.6	174.6	-67.6	174.5	-178.3	-177.8	-3.3	110.9	R189 K190 Q191 E195 V196 E197	R189-R193 PolarHBondContact O-N 3.16Å; K190-R193 WeakPolarHBondContact O-CA 3.41Å; K190-R193 WeakPolarHBondContact O-CB 3.44Å; K190-R193 PolarHBondContact O-N 3.08Å; Q191-R193 VanDerWaalsContact C-N 3.34Å; Q191-R193 PolarHBondContact O-N 3.44Å; R193-E195 VanDerWaalsContact C-N 3.27Å; R193-E195 PolarHBondContact O-N 3.35Å; R193-V196 PolarHBondContact O-N 3.29Å; R193-V196 VanDerWaalsContact O-N 3.07Å; R193-E197 WeakPolarHBondContact O-CG 3.32Å; R193-E197 PolarHBondContact O-N 3.33Å
194	D	86.5	Confident	87.3	Confident	64 Å²	64	88.1 Å²	88.1	34%	0.342	44%	0.439	S	S	.	.	H	α-helix	trans	-61.7	-36.3	178.9	-58.6	-9.6	0	0	0	110.7	K190 Q191 E197 T198	K190-D194 WeakPolarHBondContact CE-OD2 3.46Å; K190-D194 PolarHBondContact O-N 3.46Å; Q191-D194 PolarHBondContact O-N 3.36Å; D194-E197 PolarHBondContact O-N 3.45Å; D194-T198 WeakPolarHBondContact O-CB 3.38Å; D194-T198 VanDerWaalsContact O-CG2 3.23Å; D194-T198 WeakPolarHBondContact O-CG2 3.28Å; D194-T198 PolarHBondContact O-N 3.35Å; D194-T198 PolarHBondContact O-OG1 3.38Å
195	E	84.2	Confident	86	Confident	93 Å²	93	88.5 Å²	88.5	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-61.6	-41.9	172.5	-174.6	170	-153.3	0	0	112.3	Q191 K192 R193 T198 I199	Q191-E195 WeakPolarHBondContact O-CB 3.42Å; Q191-E195 PolarHBondContact O-N 3.04Å; K192-E195 IonicContact NZ-OE2 3.7Å; K192-E195 PolarHBondContact NZ-OE2 3.42Å; R193-E195 VanDerWaalsContact C-N 3.27Å; R193-E195 PolarHBondContact O-N 3.35Å; E195-T198 WeakPolarHBondContact CA-OG1 3.41Å; E195-T198 PolarHBondContact O-OG1 2.85Å; E195-I199 HydrophobicContact CG-CD1 4.26Å; E195-I199 WeakPolarHBondContact O-CD1 3.26Å; E195-I199 WeakPolarHBondContact O-CG1 3.19Å; E195-I199 PolarHBondContact O-N 2.85Å; E195-I199 VanDerWaalsContact O-N 3.16Å
196	V	84.2	Confident	84.5	Confident	73 Å²	73	90.5 Å²	90.5	44%	0.442	46%	0.463	S	S	.	.	H	α-helix	trans	-70.7	-38.6	176.8	174.2	0	0	0	0	111.6	K192 R193 K200	K192-V196 WeakPolarHBondContact O-CG2 3.48Å; K192-V196 PolarHBondContact O-N 3.34Å; R193-V196 PolarHBondContact O-N 3.29Å; R193-V196 VanDerWaalsContact O-N 3.07Å; V196-K200 HydrophobicContact CG1-CD 4.19Å; V196-K200 VanDerWaalsContact O-CG 3.31Å; V196-K200 WeakPolarHBondContact O-CG 3.44Å; V196-K200 PolarHBondContact O-N 3.39Å; V196-K200 VanDerWaalsContact O-N 3.08Å
197	E	84.9	Confident	82.9	Confident	125 Å²	125	91.5 Å²	91.5	58%	0.584	47%	0.471	S	S	*	.	H	α-helix	trans	-68.1	-41.9	178.3	-72.6	177.9	-168.7	0	0	112	R193 D194 K200 A201	R193-E197 WeakPolarHBondContact O-CG 3.32Å; R193-E197 PolarHBondContact O-N 3.33Å; D194-E197 PolarHBondContact O-N 3.45Å; E197-K200 PolarHBondContact O-N 3.06Å; E197-A201 WeakPolarHBondContact O-CB 3.39Å; E197-A201 PolarHBondContact O-N 3.11Å
198	T	84.8	Confident	81.2	Confident	81 Å²	81	93 Å²	93	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-63.9	-43.2	176	49	0	0	0	0	111.6	D194 E195 K200 A201 V202	D194-T198 WeakPolarHBondContact O-CB 3.38Å; D194-T198 VanDerWaalsContact O-CG2 3.23Å; D194-T198 WeakPolarHBondContact O-CG2 3.28Å; D194-T198 PolarHBondContact O-N 3.35Å; D194-T198 PolarHBondContact O-OG1 3.38Å; E195-T198 WeakPolarHBondContact CA-OG1 3.41Å; E195-T198 PolarHBondContact O-OG1 2.85Å; T198-K200 PolarHBondContact O-N 3.46Å; T198-A201 PolarHBondContact O-N 2.95Å; T198-V202 WeakPolarHBondContact O-CG2 3.49Å; T198-V202 PolarHBondContact O-N 3.38Å
199	I	81	Confident	79.6	Confident	102 Å²	102	97.4 Å²	97.4	52%	0.523	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-45.2	175.3	-67	165.4	0	0	0	110.9	E195 A201 V202 S203	E195-I199 HydrophobicContact CG-CD1 4.26Å; E195-I199 WeakPolarHBondContact O-CD1 3.26Å; E195-I199 WeakPolarHBondContact O-CG1 3.19Å; E195-I199 PolarHBondContact O-N 2.85Å; E195-I199 VanDerWaalsContact O-N 3.16Å; I199-A201 PolarHBondContact O-N 3.44Å; I199-V202 PolarHBondContact O-N 2.92Å; I199-S203 PolarHBondContact O-N 3.36Å; I199-S203 PolarHBondContact O-OG 3.12Å; I199-S203 VanDerWaalsContact O-OG 3.13Å
200	K	83.8	Confident	77.9	Confident	134 Å²	134	99 Å²	99	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-63.3	-39.4	177	-74.9	174.9	-179.2	177.7	0	112.9	V196 E197 T198 S204	V196-K200 HydrophobicContact CG1-CD 4.19Å; V196-K200 VanDerWaalsContact O-CG 3.31Å; V196-K200 WeakPolarHBondContact O-CG 3.44Å; V196-K200 PolarHBondContact O-N 3.39Å; V196-K200 VanDerWaalsContact O-N 3.08Å; E197-K200 PolarHBondContact O-N 3.06Å; T198-K200 PolarHBondContact O-N 3.46Å; K200-S204 WeakPolarHBondContact O-CB 3.36Å; K200-S204 PolarHBondContact O-N 2.92Å; K200-S204 PolarHBondContact O-OG 2.97Å
201	A	81.6	Confident	76.4	Confident	60 Å²	60	95.5 Å²	95.5	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-43.3	177	0	0	0	0	0	111.1	E197 T198 I199 S204 S205	E197-A201 WeakPolarHBondContact O-CB 3.39Å; E197-A201 PolarHBondContact O-N 3.11Å; T198-A201 PolarHBondContact O-N 2.95Å; I199-A201 PolarHBondContact O-N 3.44Å; A201-S204 PolarHBondContact O-N 3.02Å; A201-S205 WeakPolarHBondContact O-CB 3.44Å; A201-S205 PolarHBondContact O-N 3.31Å; A201-S205 PolarHBondContact O-OG 2.91Å
202	V	79.9	Confident	75	Confident	82 Å²	82	97.2 Å²	97.2	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-47.3	177.1	177	0	0	0	0	110.5	T198 I199 S204 S205 N206	T198-V202 WeakPolarHBondContact O-CG2 3.49Å; T198-V202 PolarHBondContact O-N 3.38Å; I199-V202 PolarHBondContact O-N 2.92Å; V202-S204 VanDerWaalsContact C-N 3.34Å; V202-S204 PolarHBondContact O-N 2.86Å; V202-S205 PolarHBondContact O-N 3.36Å; V202-S205 PolarHBondContact O-OG 3.33Å; V202-N206 PolarHBondContact O-N 2.75Å
203	S	76.8	Confident	73.7	Confident	72 Å²	72	95.3 Å²	95.3	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-60.7	-41.2	176.5	-60	0	0	0	0	112.6	I199 S205 N206 A207	I199-S203 PolarHBondContact O-N 3.36Å; I199-S203 PolarHBondContact O-OG 3.12Å; I199-S203 VanDerWaalsContact O-OG 3.13Å; S203-S205 VanDerWaalsContact C-N 3.34Å; S203-S205 PolarHBondContact O-N 3.11Å; S203-N206 PolarHBondContact O-N 3.1Å; S203-A207 WeakPolarHBondContact O-CB 3.46Å; S203-A207 PolarHBondContact O-N 3.25Å
204	S	73.8	Confident	72.6	Confident	69 Å²	69	91.7 Å²	91.7	48%	0.483	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-35.3	177.5	-57.7	0	0	0	0	112.1	K200 A201 V202 K208	K200-S204 WeakPolarHBondContact O-CB 3.36Å; K200-S204 PolarHBondContact O-N 2.92Å; K200-S204 PolarHBondContact O-OG 2.97Å; A201-S204 PolarHBondContact O-N 3.02Å; V202-S204 VanDerWaalsContact C-N 3.34Å; V202-S204 PolarHBondContact O-N 2.86Å; S204-K208 WeakPolarHBondContact O-CG 3.43Å; S204-K208 PolarHBondContact O-N 3.44Å; S204-K208 VanDerWaalsContact O-N 3.15Å
205	S	70.8	Confident	71.3	Confident	52 Å²	52	94.4 Å²	94.4	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-69.9	-36.6	175.9	73.2	0	0	0	0	112.5	A201 V202 S203 K209	A201-S205 WeakPolarHBondContact O-CB 3.44Å; A201-S205 PolarHBondContact O-N 3.31Å; A201-S205 PolarHBondContact O-OG 2.91Å; V202-S205 PolarHBondContact O-N 3.36Å; V202-S205 PolarHBondContact O-OG 3.33Å; S203-S205 VanDerWaalsContact C-N 3.34Å; S203-S205 PolarHBondContact O-N 3.11Å; S205-K209 WeakPolarHBondContact O-CG 3.44Å; S205-K209 PolarHBondContact O-N 3.32Å; S205-K209 VanDerWaalsContact O-N 3.12Å
206	N	65.8	Low	70.1	Confident	85 Å²	85	97.6 Å²	97.6	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-71.6	-37.1	174.8	-81.3	-13.4	0	0	0	112.4	V202 S203 K208 K209 Q210	V202-N206 PolarHBondContact O-N 2.75Å; S203-N206 PolarHBondContact O-N 3.1Å; N206-K208 VanDerWaalsContact C-N 3.34Å; N206-K208 PolarHBondContact O-N 2.96Å; N206-K209 PolarHBondContact O-N 2.96Å; N206-Q210 PolarHBondContact O-N 3.1Å
207	A	62.8	Low	68.5	Low	59 Å²	59	101 Å²	101	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-38.2	174.5	0	0	0	0	0	112.1	S203 Q210 A211	S203-A207 WeakPolarHBondContact O-CB 3.46Å; S203-A207 PolarHBondContact O-N 3.25Å; A207-Q210 PolarHBondContact O-N 3.49Å; A207-A211 VanDerWaalsContact O-CB 3.27Å; A207-A211 WeakPolarHBondContact O-CB 3.43Å; A207-A211 PolarHBondContact O-N 3.08Å
208	K	61	Low	67.2	Low	156 Å²	156	102.9 Å²	102.9	68%	0.678	57%	0.565	S	S	*	*	H	α-helix	trans	-66.6	-42.8	174.3	-72.9	-179.2	179.8	-174.6	0	112.3	S204 N206 A211 E212	S204-K208 WeakPolarHBondContact O-CG 3.43Å; S204-K208 PolarHBondContact O-N 3.44Å; S204-K208 VanDerWaalsContact O-N 3.15Å; N206-K208 VanDerWaalsContact C-N 3.34Å; N206-K208 PolarHBondContact O-N 2.96Å; K208-A211 PolarHBondContact O-N 3.03Å; K208-E212 WeakPolarHBondContact O-CB 3.39Å; K208-E212 PolarHBondContact O-N 3.31Å
209	K	60.5	Low	66	Low	148 Å²	148	107.7 Å²	107.7	64%	0.643	58%	0.579	S	S	*	*	H	α-helix	trans	-64.4	-38.6	175.8	-73.4	-178.4	178.8	-177.9	0	112.5	S205 N206 A213	S205-K209 WeakPolarHBondContact O-CG 3.44Å; S205-K209 PolarHBondContact O-N 3.32Å; S205-K209 VanDerWaalsContact O-N 3.12Å; N206-K209 PolarHBondContact O-N 2.96Å; K209-A213 WeakPolarHBondContact O-CB 3.42Å; K209-A213 PolarHBondContact O-N 3.39Å
210	Q	59.8	Low	64.1	Low	140 Å²	140	108.5 Å²	108.5	65%	0.654	59%	0.592	S	S	*	*	H	α-helix	trans	-69.8	-41	174.6	-75.8	-176.2	12.3	0	0	112.1	N206 A207 E212 A213 T214	N206-Q210 PolarHBondContact O-N 3.1Å; A207-Q210 PolarHBondContact O-N 3.49Å; Q210-E212 VanDerWaalsContact C-N 3.29Å; Q210-E212 PolarHBondContact O-N 3.35Å; Q210-A213 PolarHBondContact O-N 2.67Å; Q210-T214 WeakPolarHBondContact O-CG2 3.23Å; Q210-T214 PolarHBondContact O-N 2.92Å; Q210-T214 PolarHBondContact O-OG1 3.44Å
211	A	59.6	Low	62.1	Low	54 Å²	54	106.8 Å²	106.8	45%	0.446	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-31.7	175.9	0	0	0	0	0	112.9	A207 K208 T214 N215	A207-A211 VanDerWaalsContact O-CB 3.27Å; A207-A211 WeakPolarHBondContact O-CB 3.43Å; A207-A211 PolarHBondContact O-N 3.08Å; K208-A211 PolarHBondContact O-N 3.03Å; A211-T214 WeakPolarHBondContact CA-OG1 3.39Å; A211-T214 PolarHBondContact O-OG1 3.49Å; A211-T214 VanDerWaalsContact O-OG1 3.07Å; A211-N215 WeakPolarHBondContact O-CB 3.39Å; A211-N215 PolarHBondContact O-N 3.2Å; A211-N215 VanDerWaalsContact O-N 3.1Å
212	E	59.7	Low	60.8	Low	129 Å²	129	109.1 Å²	109.1	60%	0.603	61%	0.607	S	S	*	*	H	α-helix	trans	-75.6	-36.2	174.7	-168.8	167.1	172.6	0	0	112.1	K208 Q210 K216	K208-E212 WeakPolarHBondContact O-CB 3.39Å; K208-E212 PolarHBondContact O-N 3.31Å; Q210-E212 VanDerWaalsContact C-N 3.29Å; Q210-E212 PolarHBondContact O-N 3.35Å; E212-K216 PolarHBondContact O-N 3.44Å; E212-K216 VanDerWaalsContact O-N 3.08Å
213	A	59.5	Low	59.3	Low	64 Å²	64	114 Å²	114	53%	0.529	63%	0.625	S	S	.	*	H	α-helix	trans	-66.9	-38	172.8	0	0	0	0	0	112.5	K209 Q210 L217	K209-A213 WeakPolarHBondContact O-CB 3.42Å; K209-A213 PolarHBondContact O-N 3.39Å; Q210-A213 PolarHBondContact O-N 2.67Å; A213-L217 PolarHBondContact O-N 2.99Å
214	T	63.3	Low	57.9	Low	84 Å²	84	116.7 Å²	116.7	52%	0.515	64%	0.638	S	S	.	*	H	α-helix	trans	-72.7	-35.7	176.7	56.7	0	0	0	0	112.4	Q210 A211 L217 M218	Q210-T214 WeakPolarHBondContact O-CG2 3.23Å; Q210-T214 PolarHBondContact O-N 2.92Å; Q210-T214 PolarHBondContact O-OG1 3.44Å; A211-T214 WeakPolarHBondContact CA-OG1 3.39Å; A211-T214 PolarHBondContact O-OG1 3.49Å; A211-T214 VanDerWaalsContact O-OG1 3.07Å; T214-L217 PolarHBondContact O-N 2.86Å; T214-M218 PolarHBondContact O-N 3.19Å
215	N	59.4	Low	57	Low	121 Å²	121	118.7 Å²	118.7	65%	0.647	65%	0.648	S	S	*	*	H	α-helix	trans	-68.5	-35.5	175	-121.4	-66.2	0	0	0	112.8	A211 L217 M218	A211-N215 WeakPolarHBondContact O-CB 3.39Å; A211-N215 PolarHBondContact O-N 3.2Å; A211-N215 VanDerWaalsContact O-N 3.1Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.03Å; N215-M218 PolarHBondContact O-N 3.43Å
216	K	59.4	Low	55.9	Low	160 Å²	160	122.5 Å²	122.5	70%	0.696	67%	0.671	S	S	*	*	H	α-helix	trans	-67.2	-29.1	172.7	-93.2	-171.4	178.5	-170.2	0	113.1	E212	E212-K216 PolarHBondContact O-N 3.44Å; E212-K216 VanDerWaalsContact O-N 3.08Å
217	L	50.7	Low	55.2	Low	145 Å²	145	129.8 Å²	129.8	76%	0.759	69%	0.692	S	S	*	*	H	α-helix	trans	-76.6	-29.2	178.1	-168.5	59.7	0	0	0	112.8	A213 T214 N215	A213-L217 PolarHBondContact O-N 2.99Å; T214-L217 PolarHBondContact O-N 2.86Å; N215-L217 VanDerWaalsContact C-N 3.29Å; N215-L217 PolarHBondContact O-N 3.03Å
218	M	58.2	Low	54.7	Low	164 Å²	164	132 Å²	132	81%	0.808	70%	0.704	S	S	*	*	H	α-helix	trans	-83.7	-5.8	178	-72.7	-176.8	138.1	0	0	114.8	T214 N215	T214-M218 PolarHBondContact O-N 3.19Å; N215-M218 PolarHBondContact O-N 3.43Å
219	K	57.7	Low	54.2	Low	181 Å²	181	130.8 Å²	130.8	79%	0.787	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	1.5	-177.3	-164	59	179.5	-174.8	0	114.9
220	C	41.5	Very low	53.8	Low	119 Å²	119	127.4 Å²	127.4	80%	0.804	71%	0.712	S	S	*	*			trans	-108.5	73	169.8	-68.2	0	0	0	0	110
221	S	42.6	Very low	53.5	Low	98 Å²	98	127.2 Å²	127.2	69%	0.685	72%	0.716	S	S	*	*			trans	-129.9	117	167	-160.6	0	0	0	0	107.9	Q223	S221-Q223 PolarHBondContact O-N 3.2Å
222	P	53.6	Low	53.3	Low	109 Å²	109	135.8 Å²	135.8	71%	0.708	74%	0.736	S	S	*	*			trans	-66.3	127.3	177.2	2.7	9.5	0	0	0	108.2	T224	P222-T224 PolarHBondContact O-N 3.41Å
223	Q	48.4	Very low	53.3	Low	186 Å²	186	137.7 Å²	137.7	87%	0.869	75%	0.747	S	S	*	*			trans	-65.5	96.4	173.2	-66.9	-177.5	41.5	0	0	109	S221	S221-Q223 PolarHBondContact O-N 3.2Å
224	T	46.9	Very low	53.4	Low	128 Å²	128	141.9 Å²	141.9	79%	0.785	76%	0.761	S	S	*	*			trans	-89.3	98.9	161.3	49.7	0	0	0	0	107.4	P222	P222-T224 PolarHBondContact O-N 3.41Å
225	T	55	Low	53.3	Low	111 Å²	111	145.1 Å²	145.1	68%	0.681	78%	0.775	S	S	*	*			trans	-68.9	129.1	169.5	51.3	0	0	0	0	109.2	R227	T225-R227 PolarHBondContact O-N 3.02Å
226	P	48.5	Very low	53.1	Low	132 Å²	132	146.1 Å²	146.1	86%	0.857	78%	0.78	S	S	*	*			trans	-76	106.4	170	7.7	7.1	0	0	0	108.2
227	R	50.2	Low	53	Low	237 Å²	237	143 Å²	143	89%	0.894	78%	0.779	S	S	*	*			trans	-85.1	122.8	174.5	-157.7	172.1	-169.4	-121.5	3.1	108.9	T225	T225-R227 PolarHBondContact O-N 3.02Å
228	S	53.4	Low	53.5	Low	105 Å²	105	141.4 Å²	141.4	73%	0.734	78%	0.78	S	S	*	*			trans	-56.4	139	-178.1	-163.1	0	0	0	0	112.4	A230	S228-A230 PolarHBondContact O-N 3.29Å
229	P	50	Low	53.5	Low	131 Å²	131	142.4 Å²	142.4	85%	0.851	78%	0.776	S	S	*	*			trans	-84.5	101.1	178	-2.8	21.8	0	0	0	110.9
230	A	53.5	Low	53.5	Low	77 Å²	77	139.9 Å²	139.9	64%	0.636	78%	0.78	S	S	*	*			trans	-153.5	134.2	162	0	0	0	0	0	108.7	S228	S228-A230 PolarHBondContact O-N 3.29Å
231	D	52.9	Low	54.4	Low	137 Å²	137	137.5 Å²	137.5	73%	0.733	76%	0.764	S	S	*	*			trans	70.3	91.5	169.9	-51.5	-41.5	0	0	0	117.4
232	R	55.7	Low	54.8	Low	234 Å²	234	142.2 Å²	142.2	88%	0.883	78%	0.775	S	S	*	*				-176.8	121	113.4	-94.9	160.9	-167.6	86.4	-1.4	111.7
233	M	58.7	Low	55	Low	169 Å²	169	140.5 Å²	140.5	83%	0.833	78%	0.777	S	S	*	*			trans	-71	174.8	162.8	-71.4	157.3	160.9	0	0	110.2
234	D	61.2	Low	55.3	Low	151 Å²	151	138.9 Å²	138.9	81%	0.807	78%	0.775	S	S	*	*			trans	97.5	90.1	169.4	-45.9	-45.6	0	0	0	114.2
235	D	61.7	Low	56	Low	152 Å²	152	139 Å²	139	81%	0.813	77%	0.774	S	S	*	*				71.7	107.3	88.2	-112.9	-62.5	0	0	0	113.2
236	D	55.3	Low	56.1	Low	142 Å²	142	137.9 Å²	137.9	76%	0.759	77%	0.772	S	S	*	*				169.1	123.3	104.5	-167.5	36.9	0	0	0	111
237	S	56.9	Low	56.8	Low	96 Å²	96	137.9 Å²	137.9	67%	0.671	77%	0.769	S	S	*	*			trans	21.4	121.7	140.4	-172	0	0	0	0	120.1
238	S	61.7	Low	57.2	Low	111 Å²	111	134.9 Å²	134.9	78%	0.776	80%	0.795	S	S	*	*				-178.2	109.7	106	-177.7	0	0	0	0	111.3
239	Y	57.8	Low	57.4	Low	185 Å²	185	136.4 Å²	136.4	73%	0.725	80%	0.798	S	S	*	*			trans	-31.1	137.2	155.9	-171.2	-105.5	0	0	0	115.7	S241	Y239-S241 WeakPolarHBondContact CE1-OG 3.39Å; Y239-S241 PolarHBondContact OH-OG 3.17Å
240	C	58.6	Low	57.8	Low	128 Å²	128	136.7 Å²	136.7	87%	0.865	80%	0.796	S	S	*	*			trans	-160.3	137.7	130.5	-106.5	0	0	0	0	111.1
241	S	59.5	Low	58	Low	68 Å²	68	140 Å²	140	48%	0.476	80%	0.804	S	S	.	*			trans	-83.1	156.3	-152.3	-46.3	0	0	0	0	117.5	Y239	Y239-S241 WeakPolarHBondContact CE1-OG 3.39Å; Y239-S241 PolarHBondContact OH-OG 3.17Å
242	E	51.6	Low	58.3	Low	198 Å²	198	140.2 Å²	140.2	93%	0.925	81%	0.809	S	S	*	*			trans	2.8	150.3	140.6	-57	-168.3	125.3	0	0	121.5
243	G	57.4	Low	58.5	Low	72 Å²	72	134.3 Å²	134.3	74%	0.742	80%	0.804	S	S	*	*			trans	156.5	66	171.1	0	0	0	0	0	109.1
244	D	55.7	Low	58.4	Low	153 Å²	153	132 Å²	132	82%	0.818	80%	0.802	S	S	*	*				83	137.3	76.2	-152.3	3	0	0	0	113.3
245	V	60.5	Low	58.2	Low	129 Å²	129	130.6 Å²	130.6	78%	0.782	80%	0.802	S	S	*	*			trans	69	147.2	163.5	143.9	0	0	0	0	119.2
246	S	58.3	Low	58	Low	89 Å²	89	129 Å²	129	62%	0.622	80%	0.801	S	S	*	*			cis	170.6	133.2	-28	178.6	0	0	0	0	104.1
247	T	61.3	Low	58.2	Low	132 Å²	132	127.9 Å²	127.9	81%	0.81	80%	0.804	S	S	*	*			trans	56.2	109.4	146.9	-49.1	0	0	0	0	120.1
248	A	59.1	Low	58.3	Low	174 Å²	174	130.8 Å²	130.8	100%	1.438	82%	0.816	S	S	*	*				-159.3	0	116.9	0	0	0	0	0	109.4

Retrieved 248 of 248 residues in 448.2 ms (Link to these results)

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