A0A077YZX9_TRITR Loading...

Kinetochore protein SPC25

Acts as a component of the essential kinetochore-associated NDC80 complex, which is required for chromosome segregation and spindle checkpoint activity.

AlphaFold DB , UniProt , Accession A0A077YZX9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 227 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	40.1	Very low	36.6	Very low	241 Å²	241	145.1 Å²	145.1	100%	1.187	84%	0.838	S	S	*	*				0	86.6	0	-74.7	-179.2	174.6	0	0	107.9
2	S	39.3	Very low	37.5	Very low	111 Å²	111	141.3 Å²	141.3	78%	0.776	82%	0.823	S	S	*	*			trans	-154.4	81.5	174.6	-56.8	0	0	0	0	107.5	L4	S2-L4 PolarHBondContact O-N 3.44Å
3	D	38	Very low	38.5	Very low	164 Å²	164	137.9 Å²	137.9	88%	0.877	80%	0.799	S	S	*	*			trans	-72.9	104.3	169.3	-72.2	-36.2	0	0	0	108	V5	D3-V5 PolarHBondContact O-N 3.42Å
4	L	39.6	Very low	39.4	Very low	161 Å²	161	132.6 Å²	132.6	84%	0.843	78%	0.78	S	S	*	*			trans	-76.7	109	168.1	-99	137.5	0	0	0	108.3	S2 C6	S2-L4 PolarHBondContact O-N 3.44Å; L4-C6 PolarHBondContact O-N 3.48Å
5	V	37.5	Very low	39.9	Very low	137 Å²	137	133.7 Å²	133.7	83%	0.83	77%	0.774	S	S	*	*			trans	-58.9	99.3	170.9	177.9	0	0	0	0	109.2	D3	D3-V5 PolarHBondContact O-N 3.42Å
6	C	31.3	Very low	40.2	Very low	135 Å²	135	129.6 Å²	129.6	91%	0.912	75%	0.748	S	S	*	*			trans	-89.1	112.5	159.4	-91.4	0	0	0	0	107.8	L4	L4-C6 PolarHBondContact O-N 3.48Å
7	G	31.5	Very low	41	Very low	57 Å²	57	131.3 Å²	131.3	59%	0.588	74%	0.739	S	S	*	*			trans	173.6	86.3	174.3	0	0	0	0	0	112.6
8	N	35	Very low	41.8	Very low	160 Å²	160	129.4 Å²	129.4	86%	0.856	73%	0.732	S	S	*	*			trans	-172.1	64.3	148	-93.1	-13.3	0	0	0	109.9
9	E	35.3	Very low	42.2	Very low	195 Å²	195	125.3 Å²	125.3	91%	0.911	71%	0.709	S	S	*	*			trans	-98.7	72.2	163.7	-77.8	-171	147.9	0	0	109.3
10	L	35	Very low	42.6	Very low	165 Å²	165	121.7 Å²	121.7	86%	0.864	69%	0.688	S	S	*	*			trans	-146.1	75.6	-179.9	-92.2	155.2	0	0	0	109.8
11	A	39.6	Very low	43.4	Very low	70 Å²	70	119.6 Å²	119.6	58%	0.579	68%	0.678	S	S	*	*			trans	-157.9	-9	171.1	0	0	0	0	0	118.9	D13	A11-D13 PolarHBondContact O-N 3.44Å
12	P	47.5	Very low	44.5	Very low	100 Å²	100	109.9 Å²	109.9	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-73.5	-23.2	-178.2	-14.7	26.5	0	0	0	115.2
13	D	50.6	Low	45.5	Very low	97 Å²	97	106 Å²	106	52%	0.519	61%	0.611	S	S	.	*	H	α-helix	trans	-79.8	-27.6	-170.8	-158.2	48.6	0	0	0	112.9	A11 R17	A11-D13 PolarHBondContact O-N 3.44Å; D13-R17 WeakPolarHBondContact O-CB 3.33Å; D13-R17 WeakPolarHBondContact O-CG 3.24Å; D13-R17 PolarHBondContact O-N 2.89Å; D13-R17 VanDerWaalsContact O-N 3.07Å; D13-R17 IonicContact OD2-CZ 3.97Å; D13-R17 IonicContact OD2-NE 3.09Å; D13-R17 PolarHBondContact OD2-NE 3.09Å; D13-R17 IonicContact OD2-NH2 3.93Å; D13-R17 PolarHBondContact OD2-NH2 3.24Å
14	A	51.6	Low	46.6	Very low	64 Å²	64	103.8 Å²	103.8	53%	0.529	60%	0.599	S	S	.	*	H	α-helix	trans	-73.7	-47.1	-178.7	0	0	0	0	0	112.1	L16 R17 T18	A14-L16 VanDerWaalsContact C-N 3.33Å; A14-L16 PolarHBondContact O-N 3.35Å; A14-R17 PolarHBondContact O-N 3.4Å; A14-T18 PolarHBondContact O-N 3.5Å; A14-T18 PolarHBondContact O-OG1 2.95Å
15	E	46.1	Very low	47.9	Very low	149 Å²	149	101.5 Å²	101.5	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-63	-40.9	177.1	-72	-177.4	168.5	0	0	111.6	T18 V19	E15-T18 WeakPolarHBondContact O-CB 3.38Å; E15-T18 PolarHBondContact O-N 3.24Å; E15-V19 WeakPolarHBondContact O-CG2 3.43Å; E15-V19 PolarHBondContact O-N 2.94Å
16	L	45.7	Very low	49.1	Very low	68 Å²	68	96.9 Å²	96.9	36%	0.356	56%	0.555	S	S	.	*	H	α-helix	trans	-63.7	-43.3	176.6	-127.7	120.2	0	0	0	111.4	A14 T18 V19 L20	A14-L16 VanDerWaalsContact C-N 3.33Å; A14-L16 PolarHBondContact O-N 3.35Å; L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 3.1Å; L16-V19 PolarHBondContact O-N 3.28Å; L16-L20 HydrophobicContact CD2-CD1 4.17Å; L16-L20 VanDerWaalsContact O-CD1 3.32Å; L16-L20 WeakPolarHBondContact O-CD1 3.27Å; L16-L20 WeakPolarHBondContact O-CG 3.32Å; L16-L20 PolarHBondContact O-N 3.03Å
17	R	53.5	Low	50.6	Low	158 Å²	158	92.7 Å²	92.7	60%	0.596	53%	0.53	S	S	*	.	H	α-helix	trans	-58.9	-42.6	173.7	-77.4	177.2	-168	-147.6	6.8	111.8	D13 A14 V19 L20 T21	D13-R17 WeakPolarHBondContact O-CB 3.33Å; D13-R17 WeakPolarHBondContact O-CG 3.24Å; D13-R17 PolarHBondContact O-N 2.89Å; D13-R17 VanDerWaalsContact O-N 3.07Å; D13-R17 IonicContact OD2-CZ 3.97Å; D13-R17 IonicContact OD2-NE 3.09Å; D13-R17 PolarHBondContact OD2-NE 3.09Å; D13-R17 IonicContact OD2-NH2 3.93Å; D13-R17 PolarHBondContact OD2-NH2 3.24Å; A14-R17 PolarHBondContact O-N 3.4Å; R17-V19 PolarHBondContact O-N 3.46Å; R17-L20 PolarHBondContact O-N 3.25Å; R17-T21 PolarHBondContact O-N 3.12Å; R17-T21 PolarHBondContact O-OG1 3.29Å
18	T	55.3	Low	52.2	Low	98 Å²	98	93.2 Å²	93.2	60%	0.601	52%	0.524	S	S	*	.	H	α-helix	trans	-61.1	-43.8	177.3	-52.5	0	0	0	0	111.9	A14 E15 L16 L20 S22	A14-T18 PolarHBondContact O-N 3.5Å; A14-T18 PolarHBondContact O-OG1 2.95Å; E15-T18 WeakPolarHBondContact O-CB 3.38Å; E15-T18 PolarHBondContact O-N 3.24Å; L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 3.1Å; T18-L20 VanDerWaalsContact C-N 3.29Å; T18-L20 PolarHBondContact O-N 2.58Å; T18-S22 WeakPolarHBondContact O-CB 3.09Å; T18-S22 PolarHBondContact O-N 3.45Å; T18-S22 PolarHBondContact O-OG 3.19Å
19	V	48.9	Very low	53.7	Low	51 Å²	51	91.8 Å²	91.8	31%	0.309	51%	0.507	S	S	.	.	H	α-helix	trans	-65	-32	176.4	172.7	0	0	0	0	112.3	E15 L16 R17 S22 G23 L138 L142	E15-V19 WeakPolarHBondContact O-CG2 3.43Å; E15-V19 PolarHBondContact O-N 2.94Å; L16-V19 PolarHBondContact O-N 3.28Å; R17-V19 PolarHBondContact O-N 3.46Å; V19-S22 WeakPolarHBondContact CA-OG 3.45Å; V19-S22 PolarHBondContact O-OG 3.14Å; V19-G23 PolarHBondContact O-N 3.15Å; V19-L138 HydrophobicContact CG1-CD2 4.47Å; V19-L142 HydrophobicContact CG1-CD1 4Å; V19-L142 HydrophobicContact CG1-CD2 4.33Å
20	L	51	Low	55.2	Low	53 Å²	53	84.9 Å²	84.9	28%	0.277	48%	0.478	S	S	.	.	H	α-helix	trans	-77.6	-41.1	179.4	-68.9	163.8	0	0	0	112.7	L16 R17 T18 S22 G23 N24 T211	L16-L20 HydrophobicContact CD2-CD1 4.17Å; L16-L20 VanDerWaalsContact O-CD1 3.32Å; L16-L20 WeakPolarHBondContact O-CD1 3.27Å; L16-L20 WeakPolarHBondContact O-CG 3.32Å; L16-L20 PolarHBondContact O-N 3.03Å; R17-L20 PolarHBondContact O-N 3.25Å; T18-L20 VanDerWaalsContact C-N 3.29Å; T18-L20 PolarHBondContact O-N 2.58Å; L20-S22 VanDerWaalsContact C-N 3.29Å; L20-G23 PolarHBondContact O-N 3.2Å; L20-N24 PolarHBondContact O-N 3.43Å; L20-T211 HydrophobicContact CD1-CG2 3.46Å; L20-T211 VanDerWaalsContact CD1-CG2 3.46Å; L20-T211 HydrophobicContact CD2-CG2 3.13Å; L20-T211 HydrophobicContact CG-CG2 3.8Å
21	T	58.8	Low	56.9	Low	77 Å²	77	83.3 Å²	83.3	47%	0.472	47%	0.466	S	S	.	.	H	α-helix	trans	-60.5	-45.2	172.8	-49.4	0	0	0	0	109.3	R17 G23 N24 E25	R17-T21 PolarHBondContact O-N 3.12Å; R17-T21 PolarHBondContact O-OG1 3.29Å; T21-G23 PolarHBondContact O-N 3Å; T21-N24 PolarHBondContact O-N 2.96Å; T21-E25 WeakPolarHBondContact O-CB 3.27Å; T21-E25 WeakPolarHBondContact O-CG 3.48Å; T21-E25 PolarHBondContact O-N 3.06Å
22	S	63.4	Low	58.4	Low	37 Å²	37	84.2 Å²	84.2	26%	0.259	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-39.3	176.3	70	0	0	0	0	112.6	T18 V19 L20 E25 I26	T18-S22 WeakPolarHBondContact O-CB 3.09Å; T18-S22 PolarHBondContact O-N 3.45Å; T18-S22 PolarHBondContact O-OG 3.19Å; V19-S22 WeakPolarHBondContact CA-OG 3.45Å; V19-S22 PolarHBondContact O-OG 3.14Å; L20-S22 VanDerWaalsContact C-N 3.29Å; S22-E25 PolarHBondContact O-N 2.92Å; S22-I26 WeakPolarHBondContact O-CB 3.41Å; S22-I26 WeakPolarHBondContact O-CD1 3.27Å; S22-I26 WeakPolarHBondContact O-CG1 3.15Å; S22-I26 PolarHBondContact O-N 3.34Å
23	G	60	Low	59.3	Low	30 Å²	30	82 Å²	82	31%	0.309	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-45.7	176	0	0	0	0	0	113.8	V19 L20 T21 I26 A27	V19-G23 PolarHBondContact O-N 3.15Å; L20-G23 PolarHBondContact O-N 3.2Å; T21-G23 PolarHBondContact O-N 3Å; G23-I26 PolarHBondContact O-N 3.48Å; G23-A27 WeakPolarHBondContact O-CB 3.17Å; G23-A27 PolarHBondContact O-N 3.26Å
24	N	62	Low	60.4	Low	118 Å²	118	83 Å²	83	63%	0.631	45%	0.446	S	S	*	.	H	α-helix	trans	-67.8	-36.4	176.7	-82.7	-13.7	0	0	0	112.4	L20 T21 S28	L20-N24 PolarHBondContact O-N 3.43Å; T21-N24 PolarHBondContact O-N 2.96Å; N24-S28 WeakPolarHBondContact O-CB 3.13Å; N24-S28 PolarHBondContact O-N 3.45Å; N24-S28 PolarHBondContact O-OG 3.08Å
25	E	65.9	Low	61.4	Low	113 Å²	113	82.1 Å²	82.1	53%	0.528	44%	0.443	S	S	.	.	H	α-helix	trans	-63.9	-43.9	172.2	-76.1	172.8	-177.6	0	0	111	T21 S22 R29	T21-E25 WeakPolarHBondContact O-CB 3.27Å; T21-E25 WeakPolarHBondContact O-CG 3.48Å; T21-E25 PolarHBondContact O-N 3.06Å; S22-E25 PolarHBondContact O-N 2.92Å; E25-R29 WeakPolarHBondContact O-CB 3.29Å; E25-R29 WeakPolarHBondContact O-CG 3.36Å; E25-R29 PolarHBondContact O-N 3.4Å
26	I	64.2	Low	62.5	Low	40 Å²	40	78.6 Å²	78.6	21%	0.205	43%	0.428	C	S	.	.	H	α-helix	trans	-62.3	-47.7	176.6	-71	162.2	0	0	0	110.6	S22 G23 R29 V30 Y131 L138	S22-I26 WeakPolarHBondContact O-CB 3.41Å; S22-I26 WeakPolarHBondContact O-CD1 3.27Å; S22-I26 WeakPolarHBondContact O-CG1 3.15Å; S22-I26 PolarHBondContact O-N 3.34Å; G23-I26 PolarHBondContact O-N 3.48Å; I26-R29 PolarHBondContact O-N 2.73Å; I26-V30 HydrophobicContact CG2-CG2 4.38Å; I26-V30 VanDerWaalsContact O-CG2 3.31Å; I26-V30 WeakPolarHBondContact O-CG2 3.41Å; I26-V30 PolarHBondContact O-N 3.26Å; I26-Y131 HydrophobicContact CG1-CE1 4.29Å; I26-Y131 HydrophobicContact CG2-CD1 3.87Å; I26-Y131 HydrophobicContact CG2-CE1 4.06Å; I26-L138 HydrophobicContact CD1-CD1 3.83Å
27	A	62.3	Low	63.7	Low	47 Å²	47	77.9 Å²	77.9	39%	0.388	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-49.5	179	0	0	0	0	0	111.8	G23 R29 V30 E31	G23-A27 WeakPolarHBondContact O-CB 3.17Å; G23-A27 PolarHBondContact O-N 3.26Å; A27-R29 VanDerWaalsContact C-N 3.29Å; A27-R29 PolarHBondContact O-N 3.14Å; A27-V30 PolarHBondContact O-N 2.88Å; A27-V30 VanDerWaalsContact O-N 3.14Å; A27-E31 PolarHBondContact O-N 2.89Å
28	S	65.3	Low	64.9	Low	68 Å²	68	72.4 Å²	72.4	48%	0.476	41%	0.413	S	S	.	.	H	α-helix	trans	-57.7	-41.7	176.1	-58.1	0	0	0	0	111.8	N24 E31 V32	N24-S28 WeakPolarHBondContact O-CB 3.13Å; N24-S28 PolarHBondContact O-N 3.45Å; N24-S28 PolarHBondContact O-OG 3.08Å; S28-E31 PolarHBondContact O-N 3.46Å; S28-V32 VanDerWaalsContact O-CG2 3.31Å; S28-V32 WeakPolarHBondContact O-CG2 3.4Å; S28-V32 PolarHBondContact O-N 3.34Å
29	R	66.8	Low	65.8	Low	130 Å²	130	73.9 Å²	73.9	49%	0.491	41%	0.412	S	S	.	.	H	α-helix	trans	-68.2	-38	177.7	-71.5	175.1	87.4	-169.9	1.7	112.1	E25 I26 A27 V32 F33 Y131	E25-R29 WeakPolarHBondContact O-CB 3.29Å; E25-R29 WeakPolarHBondContact O-CG 3.36Å; E25-R29 PolarHBondContact O-N 3.4Å; I26-R29 PolarHBondContact O-N 2.73Å; A27-R29 VanDerWaalsContact C-N 3.29Å; A27-R29 PolarHBondContact O-N 3.14Å; R29-V32 PolarHBondContact O-N 2.77Å; R29-F33 HydrophobicContact CB-CD2 4.5Å; R29-F33 HydrophobicContact CB-CE2 4.36Å; R29-F33 WeakPolarHBondContact O-CD2 3.46Å; R29-F33 WeakPolarHBondContact O-CG 3.44Å; R29-F33 PolarHBondContact O-N 2.86Å; R29-Y131 VanDerWaalsContact CB-OH 3.31Å; R29-Y131 WeakPolarHBondContact CB-OH 3.44Å; R29-Y131 WeakPolarHBondContact CD-OH 3.3Å; R29-Y131 PolarHBondContact NE-OH 2.95Å
30	V	66.4	Low	66.8	Low	49 Å²	49	73.6 Å²	73.6	30%	0.297	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-44.3	175.3	169.1	0	0	0	0	111	I26 A27 F33 Q34 Y131	I26-V30 HydrophobicContact CG2-CG2 4.38Å; I26-V30 VanDerWaalsContact O-CG2 3.31Å; I26-V30 WeakPolarHBondContact O-CG2 3.41Å; I26-V30 PolarHBondContact O-N 3.26Å; A27-V30 PolarHBondContact O-N 2.88Å; A27-V30 VanDerWaalsContact O-N 3.14Å; V30-F33 PolarHBondContact O-N 3.17Å; V30-Q34 HydrophobicContact CG1-CG 4.43Å; V30-Q34 WeakPolarHBondContact O-CG 3.39Å; V30-Q34 PolarHBondContact O-N 3.48Å; V30-Y131 HydrophobicContact CG2-CD1 4.48Å; V30-Y131 HydrophobicContact CG2-CG 4.39Å
31	E	70.1	Confident	67.9	Low	133 Å²	133	76.4 Å²	76.4	62%	0.621	42%	0.421	S	S	*	.	H	α-helix	trans	-60.9	-45.3	175.7	-73.3	-179.5	177.4	0	0	111.7	A27 S28 F33 Q34 G35	A27-E31 PolarHBondContact O-N 2.89Å; S28-E31 PolarHBondContact O-N 3.46Å; E31-F33 VanDerWaalsContact C-N 3.33Å; E31-F33 PolarHBondContact O-N 3.14Å; E31-Q34 PolarHBondContact O-N 3.49Å; E31-G35 PolarHBondContact O-N 3.38Å
32	V	70.8	Confident	68.9	Low	89 Å²	89	78 Å²	78	54%	0.539	43%	0.426	S	S	.	.	H	α-helix	trans	-58.9	-44.5	174.6	170.4	0	0	0	0	111	S28 R29 G35 I36	S28-V32 VanDerWaalsContact O-CG2 3.31Å; S28-V32 WeakPolarHBondContact O-CG2 3.4Å; S28-V32 PolarHBondContact O-N 3.34Å; R29-V32 PolarHBondContact O-N 2.77Å; V32-G35 PolarHBondContact O-N 3.36Å; V32-I36 HydrophobicContact CG1-CD1 3.78Å; V32-I36 HydrophobicContact CG1-CG1 4.5Å; V32-I36 VanDerWaalsContact O-CG1 3.27Å; V32-I36 WeakPolarHBondContact O-CG1 3.47Å; V32-I36 PolarHBondContact O-N 2.68Å
33	F	66.7	Low	69.4	Low	52 Å²	52	81.5 Å²	81.5	23%	0.228	43%	0.434	C	S	.	.	H	α-helix	trans	-66.9	-37	177.8	-76.4	-54.9	0	0	0	113.1	R29 V30 E31 G35 I36 I37 I127 Y131	R29-F33 HydrophobicContact CB-CD2 4.5Å; R29-F33 HydrophobicContact CB-CE2 4.36Å; R29-F33 WeakPolarHBondContact O-CD2 3.46Å; R29-F33 WeakPolarHBondContact O-CG 3.44Å; R29-F33 PolarHBondContact O-N 2.86Å; V30-F33 PolarHBondContact O-N 3.17Å; E31-F33 VanDerWaalsContact C-N 3.33Å; E31-F33 PolarHBondContact O-N 3.14Å; F33-G35 VanDerWaalsContact C-N 3.35Å; F33-I36 HydrophobicContact CD1-CD1 4.22Å; F33-I36 PolarHBondContact O-N 3.13Å; F33-I37 WeakPolarHBondContact O-CB 3.43Å; F33-I37 WeakPolarHBondContact O-CD1 3.3Å; F33-I37 WeakPolarHBondContact O-CG1 3.33Å; F33-I37 PolarHBondContact O-N 2.72Å; F33-I127 HydrophobicContact CD1-CD1 4.09Å; F33-I127 HydrophobicContact CD1-CG2 4.19Å; F33-I127 HydrophobicContact CD2-CG2 3.74Å; F33-I127 HydrophobicContact CE1-CD1 3.67Å; F33-I127 HydrophobicContact CE1-CG2 4.23Å; F33-I127 HydrophobicContact CE2-CG2 3.79Å; F33-I127 HydrophobicContact CG-CG2 3.97Å; F33-I127 HydrophobicContact CZ-CD1 4.13Å; F33-I127 HydrophobicContact CZ-CG2 4.03Å; F33-Y131 AromaticContact CD2-CE2 3.68Å; F33-Y131 HydrophobicContact CD2-CE2 3.68Å; F33-Y131 AromaticContact CE2-CE2 3.56Å; F33-Y131 HydrophobicContact CE2-CE2 3.56Å
34	Q	74.2	Confident	70	Confident	120 Å²	120	83.3 Å²	83.3	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-62.6	-43	173.9	-75.2	175.1	-11.6	0	0	111.4	V30 E31 I37 A38	V30-Q34 HydrophobicContact CG1-CG 4.43Å; V30-Q34 WeakPolarHBondContact O-CG 3.39Å; V30-Q34 PolarHBondContact O-N 3.48Å; E31-Q34 PolarHBondContact O-N 3.49Å; Q34-I37 PolarHBondContact O-N 3.35Å; Q34-A38 PolarHBondContact O-N 2.86Å
35	G	72.8	Confident	70.7	Confident	45 Å²	45	81.1 Å²	81.1	46%	0.464	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-42.5	174	0	0	0	0	0	112.6	E31 V32 F33 A38 H39	E31-G35 PolarHBondContact O-N 3.38Å; V32-G35 PolarHBondContact O-N 3.36Å; F33-G35 VanDerWaalsContact C-N 3.35Å; G35-A38 PolarHBondContact O-N 3.08Å; G35-H39 WeakPolarHBondContact O-CB 3.36Å; G35-H39 PolarHBondContact O-N 2.86Å
36	I	69.4	Low	71.3	Confident	75 Å²	75	78 Å²	78	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-62.6	-44.6	175	-70.3	165.7	0	0	0	110.9	V32 F33 H39 L40	V32-I36 HydrophobicContact CG1-CD1 3.78Å; V32-I36 HydrophobicContact CG1-CG1 4.5Å; V32-I36 VanDerWaalsContact O-CG1 3.27Å; V32-I36 WeakPolarHBondContact O-CG1 3.47Å; V32-I36 PolarHBondContact O-N 2.68Å; F33-I36 HydrophobicContact CD1-CD1 4.22Å; F33-I36 PolarHBondContact O-N 3.13Å; I36-H39 PolarHBondContact O-N 3.37Å; I36-L40 HydrophobicContact CG2-CD1 3.57Å; I36-L40 HydrophobicContact CG2-CG 4.31Å; I36-L40 WeakPolarHBondContact O-CB 3.44Å; I36-L40 WeakPolarHBondContact O-CD1 3.44Å; I36-L40 WeakPolarHBondContact O-CG 3.01Å; I36-L40 PolarHBondContact O-N 2.92Å
37	I	70.6	Confident	71.7	Confident	53 Å²	53	78.5 Å²	78.5	27%	0.272	42%	0.419	S	S	.	.	H	α-helix	trans	-61	-47.6	178.4	-70.6	162.9	0	0	0	110.9	F33 Q34 H39 L40 Q41 V124	F33-I37 WeakPolarHBondContact O-CB 3.43Å; F33-I37 WeakPolarHBondContact O-CD1 3.3Å; F33-I37 WeakPolarHBondContact O-CG1 3.33Å; F33-I37 PolarHBondContact O-N 2.72Å; Q34-I37 PolarHBondContact O-N 3.35Å; I37-H39 VanDerWaalsContact C-N 3.35Å; I37-H39 PolarHBondContact O-N 3.33Å; I37-L40 PolarHBondContact O-N 2.91Å; I37-Q41 HydrophobicContact CG2-CG 4.45Å; I37-Q41 WeakPolarHBondContact O-CG 3.15Å; I37-Q41 PolarHBondContact O-N 3.24Å; I37-V124 HydrophobicContact CD1-CG1 3.51Å; I37-V124 HydrophobicContact CD1-CG2 4.44Å; I37-V124 HydrophobicContact CG1-CB 4.47Å; I37-V124 HydrophobicContact CG1-CG1 3.74Å; I37-V124 HydrophobicContact CG1-CG2 3.82Å
38	A	77.6	Confident	72.3	Confident	43 Å²	43	80.5 Å²	80.5	36%	0.355	42%	0.423	S	S	.	.	H	α-helix	trans	-59.6	-46.9	178.1	0	0	0	0	0	111.1	Q34 G35 L40 Q41 D42	Q34-A38 PolarHBondContact O-N 2.86Å; G35-A38 PolarHBondContact O-N 3.08Å; A38-L40 VanDerWaalsContact C-N 3.31Å; A38-L40 PolarHBondContact O-N 2.98Å; A38-Q41 PolarHBondContact O-N 2.99Å; A38-D42 PolarHBondContact O-N 3.21Å
39	H	74.4	Confident	72.9	Confident	128 Å²	128	81.7 Å²	81.7	59%	0.593	42%	0.424	S	S	*	.	H	α-helix	trans	-59.9	-40.2	177.3	-175.8	65	0	0	0	112.9	G35 I36 I37 D42 W43	G35-H39 WeakPolarHBondContact O-CB 3.36Å; G35-H39 PolarHBondContact O-N 2.86Å; I36-H39 PolarHBondContact O-N 3.37Å; I37-H39 VanDerWaalsContact C-N 3.35Å; I37-H39 PolarHBondContact O-N 3.33Å; H39-D42 PolarHBondContact O-N 3.46Å; H39-W43 VanDerWaalsContact O-CB 3.27Å; H39-W43 WeakPolarHBondContact O-CB 3.47Å; H39-W43 PolarHBondContact O-N 2.94Å
40	L	70.9	Confident	73.3	Confident	45 Å²	45	82.4 Å²	82.4	24%	0.236	43%	0.43	C	S	.	.	H	α-helix	trans	-68.9	-37.5	177.8	-71.7	162.7	0	0	0	112.3	I36 I37 A38 W43 Q44 T120	I36-L40 HydrophobicContact CG2-CD1 3.57Å; I36-L40 HydrophobicContact CG2-CG 4.31Å; I36-L40 WeakPolarHBondContact O-CB 3.44Å; I36-L40 WeakPolarHBondContact O-CD1 3.44Å; I36-L40 WeakPolarHBondContact O-CG 3.01Å; I36-L40 PolarHBondContact O-N 2.92Å; I37-L40 PolarHBondContact O-N 2.91Å; A38-L40 VanDerWaalsContact C-N 3.31Å; A38-L40 PolarHBondContact O-N 2.98Å; L40-W43 PolarHBondContact O-N 3.26Å; L40-Q44 VanDerWaalsContact O-CB 3.3Å; L40-Q44 WeakPolarHBondContact O-CB 3.44Å; L40-Q44 PolarHBondContact O-N 3.04Å; L40-T120 HydrophobicContact CB-CG2 4.35Å; L40-T120 HydrophobicContact CD1-CG2 3.33Å; L40-T120 HydrophobicContact CD2-CG2 3.94Å; L40-T120 HydrophobicContact CG-CG2 4.06Å
41	Q	74.3	Confident	73.5	Confident	112 Å²	112	81 Å²	81	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-42.1	174.6	-73.7	176.8	-35.7	0	0	111.6	I37 A38 Q44 T45	I37-Q41 HydrophobicContact CG2-CG 4.45Å; I37-Q41 WeakPolarHBondContact O-CG 3.15Å; I37-Q41 PolarHBondContact O-N 3.24Å; A38-Q41 PolarHBondContact O-N 2.99Å; Q41-Q44 PolarHBondContact O-N 3.37Å; Q41-T45 WeakPolarHBondContact O-CB 3.31Å; Q41-T45 PolarHBondContact O-N 3.49Å; Q41-T45 PolarHBondContact O-OG1 3.16Å
42	D	78.1	Confident	73.7	Confident	111 Å²	111	77.4 Å²	77.4	59%	0.594	42%	0.416	S	S	*	.	H	α-helix	trans	-64	-44.4	175.1	-72.1	-16.8	0	0	0	111.3	A38 H39 T45 S46	A38-D42 PolarHBondContact O-N 3.21Å; H39-D42 PolarHBondContact O-N 3.46Å; D42-T45 PolarHBondContact O-N 3.49Å; D42-S46 WeakPolarHBondContact O-CB 3.37Å; D42-S46 PolarHBondContact O-N 2.94Å
43	W	73.8	Confident	74.1	Confident	110 Å²	110	78.3 Å²	78.3	42%	0.417	42%	0.419	S	S	.	.	H	α-helix	trans	-61.9	-44.9	176.6	-179.2	74.2	0	0	0	112	H39 L40 S46 I47	H39-W43 VanDerWaalsContact O-CB 3.27Å; H39-W43 WeakPolarHBondContact O-CB 3.47Å; H39-W43 PolarHBondContact O-N 2.94Å; L40-W43 PolarHBondContact O-N 3.26Å; W43-S46 PolarHBondContact O-N 2.85Å; W43-I47 HydrophobicContact CD2-CD1 3.74Å; W43-I47 HydrophobicContact CE3-CD1 4.18Å; W43-I47 HydrophobicContact CG-CD1 4.39Å; W43-I47 HydrophobicContact CH2-CD1 3.7Å; W43-I47 HydrophobicContact CZ2-CD1 3.21Å; W43-I47 HydrophobicContact CZ3-CD1 4.16Å; W43-I47 WeakPolarHBondContact O-CG1 3.39Å; W43-I47 PolarHBondContact O-N 3.47Å
44	Q	73	Confident	74.4	Confident	68 Å²	68	78.8 Å²	78.8	32%	0.318	42%	0.421	S	S	.	.	H	α-helix	trans	-59.9	-47	175.7	-177.6	179.5	-0.6	0	0	111.3	L40 Q41 S46 I47 L48 A117	L40-Q44 VanDerWaalsContact O-CB 3.3Å; L40-Q44 WeakPolarHBondContact O-CB 3.44Å; L40-Q44 PolarHBondContact O-N 3.04Å; Q41-Q44 PolarHBondContact O-N 3.37Å; Q44-S46 VanDerWaalsContact C-N 3.35Å; Q44-S46 PolarHBondContact O-N 3.27Å; Q44-I47 PolarHBondContact O-N 3.44Å; Q44-L48 HydrophobicContact CG-CD1 4.05Å; Q44-L48 WeakPolarHBondContact O-CB 3.46Å; Q44-L48 WeakPolarHBondContact O-CG 3.37Å; Q44-L48 PolarHBondContact O-N 3.47Å; Q44-A117 HydrophobicContact CG-CB 4.45Å
45	T	77.9	Confident	74.3	Confident	73 Å²	73	76.4 Å²	76.4	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-42.5	178.5	-54.8	0	0	0	0	111.2	Q41 D42 I47 L48 N49	Q41-T45 WeakPolarHBondContact O-CB 3.31Å; Q41-T45 PolarHBondContact O-N 3.49Å; Q41-T45 PolarHBondContact O-OG1 3.16Å; D42-T45 PolarHBondContact O-N 3.49Å; T45-I47 PolarHBondContact O-N 3.03Å; T45-L48 PolarHBondContact O-N 3.36Å; T45-N49 WeakPolarHBondContact O-CB 3.45Å; T45-N49 VanDerWaalsContact O-CG 3.26Å; T45-N49 PolarHBondContact O-N 3.38Å; T45-N49 PolarHBondContact O-ND2 3.33Å
46	S	78.3	Confident	74.6	Confident	48 Å²	48	80.2 Å²	80.2	34%	0.336	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-42	177.6	178.8	0	0	0	0	112.7	D42 W43 Q44 K50	D42-S46 WeakPolarHBondContact O-CB 3.37Å; D42-S46 PolarHBondContact O-N 2.94Å; W43-S46 PolarHBondContact O-N 2.85Å; Q44-S46 VanDerWaalsContact C-N 3.35Å; Q44-S46 PolarHBondContact O-N 3.27Å; S46-K50 WeakPolarHBondContact O-CG 3.38Å; S46-K50 PolarHBondContact O-N 2.92Å; S46-K50 VanDerWaalsContact O-N 3.1Å
47	I	72.4	Confident	75.1	Confident	50 Å²	50	81.2 Å²	81.2	26%	0.256	42%	0.418	S	S	.	.	H	α-helix	trans	-66.9	-45.4	178.1	-72.2	177.4	0	0	0	110.9	W43 Q44 T45 N49 K50 A51 A113	W43-I47 HydrophobicContact CD2-CD1 3.74Å; W43-I47 HydrophobicContact CE3-CD1 4.18Å; W43-I47 HydrophobicContact CG-CD1 4.39Å; W43-I47 HydrophobicContact CH2-CD1 3.7Å; W43-I47 HydrophobicContact CZ2-CD1 3.21Å; W43-I47 HydrophobicContact CZ3-CD1 4.16Å; W43-I47 WeakPolarHBondContact O-CG1 3.39Å; W43-I47 PolarHBondContact O-N 3.47Å; Q44-I47 PolarHBondContact O-N 3.44Å; T45-I47 PolarHBondContact O-N 3.03Å; I47-N49 VanDerWaalsContact C-N 3.34Å; I47-N49 PolarHBondContact O-N 2.85Å; I47-K50 PolarHBondContact O-N 2.99Å; I47-A51 WeakPolarHBondContact O-CB 3.42Å; I47-A51 PolarHBondContact O-N 2.9Å; I47-A113 HydrophobicContact CG2-CB 4.15Å
48	L	73.8	Confident	75.2	Confident	89 Å²	89	79.2 Å²	79.2	47%	0.466	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-42.1	179.4	-73.5	172.6	0	0	0	111.8	Q44 T45 A51 A52	Q44-L48 HydrophobicContact CG-CD1 4.05Å; Q44-L48 WeakPolarHBondContact O-CB 3.46Å; Q44-L48 WeakPolarHBondContact O-CG 3.37Å; Q44-L48 PolarHBondContact O-N 3.47Å; T45-L48 PolarHBondContact O-N 3.36Å; L48-A51 PolarHBondContact O-N 3.36Å; L48-A52 WeakPolarHBondContact O-CB 3.41Å; L48-A52 PolarHBondContact O-N 2.98Å
49	N	77.7	Confident	75	Confident	93 Å²	93	84.5 Å²	84.5	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-46.4	176.7	-71.8	-14	0	0	0	111.7	T45 I47 A51 A52 D53	T45-N49 WeakPolarHBondContact O-CB 3.45Å; T45-N49 VanDerWaalsContact O-CG 3.26Å; T45-N49 PolarHBondContact O-N 3.38Å; T45-N49 PolarHBondContact O-ND2 3.33Å; I47-N49 VanDerWaalsContact C-N 3.34Å; I47-N49 PolarHBondContact O-N 2.85Å; N49-A51 VanDerWaalsContact C-N 3.3Å; N49-A51 PolarHBondContact O-N 3.33Å; N49-A52 PolarHBondContact O-N 2.93Å; N49-D53 WeakPolarHBondContact O-CB 3.35Å; N49-D53 VanDerWaalsContact O-CG 3.28Å; N49-D53 PolarHBondContact O-N 2.7Å
50	K	76.6	Confident	75.2	Confident	145 Å²	145	83.2 Å²	83.2	63%	0.63	42%	0.417	S	S	*	.	H	α-helix	trans	-60	-40.6	176.6	-74.6	176.6	-179.1	179.4	0	112.3	S46 I47 E54	S46-K50 WeakPolarHBondContact O-CG 3.38Å; S46-K50 PolarHBondContact O-N 2.92Å; S46-K50 VanDerWaalsContact O-N 3.1Å; I47-K50 PolarHBondContact O-N 2.99Å; K50-E54 WeakPolarHBondContact O-CB 3.35Å; K50-E54 PolarHBondContact O-N 2.96Å; K50-E54 VanDerWaalsContact O-N 3.09Å
51	A	69.1	Low	75.3	Confident	18 Å²	18	85.1 Å²	85.1	15%	0.149	42%	0.424	C	S	.	.	H	α-helix	trans	-67.3	-41.5	176.7	0	0	0	0	0	111.9	I47 L48 N49 E54 V55 V110	I47-A51 WeakPolarHBondContact O-CB 3.42Å; I47-A51 PolarHBondContact O-N 2.9Å; L48-A51 PolarHBondContact O-N 3.36Å; N49-A51 VanDerWaalsContact C-N 3.3Å; N49-A51 PolarHBondContact O-N 3.33Å; A51-E54 PolarHBondContact O-N 2.88Å; A51-V55 VanDerWaalsContact O-CG2 3.31Å; A51-V55 WeakPolarHBondContact O-CG2 3.49Å; A51-V55 PolarHBondContact O-N 3.46Å; A51-V110 HydrophobicContact CB-CG2 3.75Å
52	A	75.9	Confident	74.9	Confident	58 Å²	58	82 Å²	82	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-64.2	-42.5	177	0	0	0	0	0	112.1	L48 N49 V55 K56	L48-A52 WeakPolarHBondContact O-CB 3.41Å; L48-A52 PolarHBondContact O-N 2.98Å; N49-A52 PolarHBondContact O-N 2.93Å; A52-V55 PolarHBondContact O-N 2.6Å; A52-K56 WeakPolarHBondContact O-CB 3.33Å; A52-K56 PolarHBondContact O-N 3.27Å
53	D	79	Confident	74.5	Confident	109 Å²	109	80.1 Å²	80.1	58%	0.583	41%	0.407	S	S	*	.	H	α-helix	trans	-62.8	-43.1	176.8	-70.8	-23.4	0	0	0	111.5	N49 K56 R57	N49-D53 WeakPolarHBondContact O-CB 3.35Å; N49-D53 VanDerWaalsContact O-CG 3.28Å; N49-D53 PolarHBondContact O-N 2.7Å; D53-K56 PolarHBondContact O-N 3.36Å; D53-R57 WeakPolarHBondContact O-CB 3.31Å; D53-R57 PolarHBondContact O-N 3.09Å
54	E	73	Confident	74.2	Confident	61 Å²	61	78.9 Å²	78.9	29%	0.285	41%	0.412	S	S	.	.	H	α-helix	trans	-67.4	-41.9	178.8	-176.5	63.5	-178	0	0	112.3	K50 A51 K56 R57 L58	K50-E54 WeakPolarHBondContact O-CB 3.35Å; K50-E54 PolarHBondContact O-N 2.96Å; K50-E54 VanDerWaalsContact O-N 3.09Å; A51-E54 PolarHBondContact O-N 2.88Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.33Å; E54-R57 PolarHBondContact O-N 3.49Å; E54-R57 IonicContact OE1-CZ 3.85Å; E54-R57 IonicContact OE1-NE 3.77Å; E54-R57 IonicContact OE1-NH2 3.69Å; E54-R57 PolarHBondContact OE1-NH2 3.09Å; E54-R57 IonicContact OE2-CZ 2.98Å; E54-R57 IonicContact OE2-NE 2.9Å; E54-R57 PolarHBondContact OE2-NE 2.95Å; E54-R57 IonicContact OE2-NH2 2.6Å; E54-R57 PolarHBondContact OE2-NH2 3.44Å; E54-L58 HydrophobicContact CG-CD1 4.29Å; E54-L58 WeakPolarHBondContact O-CG 3.45Å; E54-L58 PolarHBondContact O-N 2.89Å
55	V	70.7	Confident	73.7	Confident	71 Å²	71	78.3 Å²	78.3	43%	0.43	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-40	174.4	168.5	0	0	0	0	111.1	A51 A52 K59	A51-V55 VanDerWaalsContact O-CG2 3.31Å; A51-V55 WeakPolarHBondContact O-CG2 3.49Å; A51-V55 PolarHBondContact O-N 3.46Å; A52-V55 PolarHBondContact O-N 2.6Å; V55-K59 WeakPolarHBondContact O-CB 3.5Å; V55-K59 PolarHBondContact O-N 3.46Å
56	K	79	Confident	72.8	Confident	125 Å²	125	77.5 Å²	77.5	54%	0.543	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-47.7	176.4	-177.3	-179	171.6	-171.5	0	111.2	A52 D53 E54 L58 K59 E60	A52-K56 WeakPolarHBondContact O-CB 3.33Å; A52-K56 PolarHBondContact O-N 3.27Å; D53-K56 PolarHBondContact O-N 3.36Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.33Å; K56-L58 PolarHBondContact O-N 3.43Å; K56-K59 PolarHBondContact O-N 3.03Å; K56-E60 WeakPolarHBondContact CE-OE1 3.42Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3Å
57	R	80.1	Confident	72.1	Confident	95 Å²	95	80.3 Å²	80.3	36%	0.358	41%	0.414	S	S	.	.	H	α-helix	trans	-57.3	-49.7	177.5	-173.2	-173.9	70.4	79.1	3.8	111.8	D53 E54 K59 E60 E61	D53-R57 WeakPolarHBondContact O-CB 3.31Å; D53-R57 PolarHBondContact O-N 3.09Å; E54-R57 PolarHBondContact O-N 3.49Å; E54-R57 IonicContact OE1-CZ 3.85Å; E54-R57 IonicContact OE1-NE 3.77Å; E54-R57 IonicContact OE1-NH2 3.69Å; E54-R57 PolarHBondContact OE1-NH2 3.09Å; E54-R57 IonicContact OE2-CZ 2.98Å; E54-R57 IonicContact OE2-NE 2.9Å; E54-R57 PolarHBondContact OE2-NE 2.95Å; E54-R57 IonicContact OE2-NH2 2.6Å; E54-R57 PolarHBondContact OE2-NH2 3.44Å; R57-K59 VanDerWaalsContact C-N 3.29Å; R57-K59 PolarHBondContact O-N 2.94Å; R57-E60 PolarHBondContact O-N 3.03Å; R57-E61 IonicContact CZ-OE1 3.8Å; R57-E61 IonicContact CZ-OE2 3.64Å; R57-E61 IonicContact NH1-OE1 3.12Å; R57-E61 PolarHBondContact NH1-OE1 3.05Å; R57-E61 IonicContact NH1-OE2 2.76Å; R57-E61 PolarHBondContact NH1-OE2 3.49Å; R57-E61 WeakPolarHBondContact O-CG 3.36Å; R57-E61 PolarHBondContact O-N 3.23Å
58	L	73.7	Confident	71.7	Confident	12 Å²	12	82.6 Å²	82.6	6%	0.063	43%	0.427	C	S	.	.	H	α-helix	trans	-63	-35.9	178.8	-71.4	171.5	0	0	0	112.3	E54 K56 C62 L103	E54-L58 HydrophobicContact CG-CD1 4.29Å; E54-L58 WeakPolarHBondContact O-CG 3.45Å; E54-L58 PolarHBondContact O-N 2.89Å; K56-L58 PolarHBondContact O-N 3.43Å; L58-C62 PolarHBondContact O-N 3.37Å; L58-C62 PolarHBondContact O-SG 3.2Å; L58-L103 HydrophobicContact CD1-CD1 4.28Å
59	K	73.7	Confident	71.1	Confident	153 Å²	153	80.1 Å²	80.1	67%	0.665	41%	0.414	S	S	*	.	H	α-helix	trans	-67.2	-42	176.2	-171.8	177.8	-179.5	-178.8	0	111.8	V55 K56 R57 C62 T63	V55-K59 WeakPolarHBondContact O-CB 3.5Å; V55-K59 PolarHBondContact O-N 3.46Å; K56-K59 PolarHBondContact O-N 3.03Å; R57-K59 VanDerWaalsContact C-N 3.29Å; R57-K59 PolarHBondContact O-N 2.94Å; K59-C62 PolarHBondContact O-N 2.9Å; K59-T63 WeakPolarHBondContact O-CG2 3.47Å; K59-T63 PolarHBondContact O-N 2.89Å; K59-T63 VanDerWaalsContact O-N 3.08Å; K59-T63 PolarHBondContact O-OG1 3.02Å
60	E	77.3	Confident	70.2	Confident	101 Å²	101	80.6 Å²	80.6	47%	0.472	42%	0.416	S	S	.	.	H	α-helix	trans	-62.7	-45.9	176.1	-72.7	170.2	179.8	0	0	110.8	K56 R57 C62 T63 V64	K56-E60 WeakPolarHBondContact CE-OE1 3.42Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3Å; R57-E60 PolarHBondContact O-N 3.03Å; E60-C62 PolarHBondContact O-N 3.43Å; E60-T63 WeakPolarHBondContact CA-OG1 3.44Å; E60-T63 PolarHBondContact O-N 2.92Å; E60-T63 VanDerWaalsContact O-N 3.17Å; E60-T63 PolarHBondContact O-OG1 3.14Å; E60-V64 WeakPolarHBondContact O-CG2 3.42Å; E60-V64 PolarHBondContact O-N 3.39Å; E60-V64 VanDerWaalsContact O-N 3.08Å
61	E	74.7	Confident	69.5	Low	85 Å²	85	78.1 Å²	78.1	40%	0.397	41%	0.41	S	S	.	.	H	α-helix	trans	-57.2	-48.6	175	-75	171	-173.8	0	0	112.1	R57 T63 V64 E65	R57-E61 IonicContact CZ-OE1 3.8Å; R57-E61 IonicContact CZ-OE2 3.64Å; R57-E61 IonicContact NH1-OE1 3.12Å; R57-E61 PolarHBondContact NH1-OE1 3.05Å; R57-E61 IonicContact NH1-OE2 2.76Å; R57-E61 PolarHBondContact NH1-OE2 3.49Å; R57-E61 WeakPolarHBondContact O-CG 3.36Å; R57-E61 PolarHBondContact O-N 3.23Å; E61-T63 VanDerWaalsContact C-N 3.31Å; E61-T63 PolarHBondContact O-N 3.44Å; E61-V64 PolarHBondContact O-N 3.23Å; E61-E65 WeakPolarHBondContact O-CG 3.3Å; E61-E65 PolarHBondContact O-N 3.33Å; E61-E65 VanDerWaalsContact O-N 3.14Å
62	C	65.5	Low	69	Low	46 Å²	46	79.2 Å²	79.2	31%	0.311	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-33.5	177.1	-73.7	0	0	0	0	113.5	L58 K59 E60 T66	L58-C62 PolarHBondContact O-N 3.37Å; L58-C62 PolarHBondContact O-SG 3.2Å; K59-C62 PolarHBondContact O-N 2.9Å; E60-C62 PolarHBondContact O-N 3.43Å; C62-T66 WeakPolarHBondContact O-CB 3.47Å; C62-T66 PolarHBondContact O-N 2.99Å; C62-T66 VanDerWaalsContact O-N 3.13Å; C62-T66 PolarHBondContact O-OG1 3.45Å
63	T	69.1	Low	68.1	Low	72 Å²	72	81 Å²	81	44%	0.442	42%	0.424	S	S	.	.	H	α-helix	trans	-72.1	-40.1	179.1	50.3	0	0	0	0	113	K59 E60 E61 T66 L67	K59-T63 WeakPolarHBondContact O-CG2 3.47Å; K59-T63 PolarHBondContact O-N 2.89Å; K59-T63 VanDerWaalsContact O-N 3.08Å; K59-T63 PolarHBondContact O-OG1 3.02Å; E60-T63 WeakPolarHBondContact CA-OG1 3.44Å; E60-T63 PolarHBondContact O-N 2.92Å; E60-T63 VanDerWaalsContact O-N 3.17Å; E60-T63 PolarHBondContact O-OG1 3.14Å; E61-T63 VanDerWaalsContact C-N 3.31Å; E61-T63 PolarHBondContact O-N 3.44Å; T63-T66 PolarHBondContact O-N 3.42Å; T63-L67 PolarHBondContact O-N 3.43Å; T63-L67 VanDerWaalsContact O-N 3.14Å
64	V	68.3	Low	67	Low	85 Å²	85	79.9 Å²	79.9	52%	0.515	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-51	177	173.9	0	0	0	0	109.7	E60 E61 T66 L67 D68	E60-V64 WeakPolarHBondContact O-CG2 3.42Å; E60-V64 PolarHBondContact O-N 3.39Å; E60-V64 VanDerWaalsContact O-N 3.08Å; E61-V64 PolarHBondContact O-N 3.23Å; V64-T66 PolarHBondContact O-N 3.45Å; V64-L67 PolarHBondContact O-N 3.1Å; V64-L67 VanDerWaalsContact O-N 3.14Å; V64-D68 PolarHBondContact O-N 2.93Å; V64-D68 VanDerWaalsContact O-N 3.12Å
65	E	61.3	Low	66.2	Low	56 Å²	56	84 Å²	84	26%	0.262	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-30.4	178.4	-70.4	-178.4	169.9	0	0	113.1	E61 L69	E61-E65 WeakPolarHBondContact O-CG 3.3Å; E61-E65 PolarHBondContact O-N 3.33Å; E61-E65 VanDerWaalsContact O-N 3.14Å; E65-L69 WeakPolarHBondContact O-CB 3.44Å; E65-L69 PolarHBondContact O-N 2.97Å; E65-L69 VanDerWaalsContact O-N 3.15Å
66	T	60.4	Low	65.3	Low	56 Å²	56	83.2 Å²	83.2	34%	0.344	44%	0.444	S	S	.	.	H	α-helix	trans	-73.2	-37.9	177.7	-60.8	0	0	0	0	112.1	C62 T63 V64 L69 I70	C62-T66 WeakPolarHBondContact O-CB 3.47Å; C62-T66 PolarHBondContact O-N 2.99Å; C62-T66 VanDerWaalsContact O-N 3.13Å; C62-T66 PolarHBondContact O-OG1 3.45Å; T63-T66 PolarHBondContact O-N 3.42Å; V64-T66 PolarHBondContact O-N 3.45Å; T66-L69 PolarHBondContact O-N 3.19Å; T66-I70 HydrophobicContact CG2-CD1 3.95Å; T66-I70 VanDerWaalsContact O-CG1 3.27Å; T66-I70 WeakPolarHBondContact O-CG1 3.43Å; T66-I70 PolarHBondContact O-N 2.95Å
67	L	62.8	Low	63.8	Low	106 Å²	106	85 Å²	85	56%	0.555	46%	0.459	S	S	*	.	H	α-helix	trans	-65.3	-42.4	175	-80.4	163.7	0	0	0	111.3	T63 V64 L69 I70 N71	T63-L67 PolarHBondContact O-N 3.43Å; T63-L67 VanDerWaalsContact O-N 3.14Å; V64-L67 PolarHBondContact O-N 3.1Å; V64-L67 VanDerWaalsContact O-N 3.14Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.01Å; L67-I70 PolarHBondContact O-N 3.49Å; L67-N71 VanDerWaalsContact O-CG 3.28Å; L67-N71 PolarHBondContact O-N 3.39Å; L67-N71 PolarHBondContact O-ND2 3.41Å
68	D	63.2	Low	62.6	Low	99 Å²	99	84 Å²	84	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-41.7	177.5	-66.8	-22.5	0	0	0	111.5	V64 N71 A72	V64-D68 PolarHBondContact O-N 2.93Å; V64-D68 VanDerWaalsContact O-N 3.12Å; D68-N71 PolarHBondContact O-N 3.31Å; D68-A72 WeakPolarHBondContact O-CB 3.45Å; D68-A72 PolarHBondContact O-N 3.07Å
69	L	60.9	Low	61.7	Low	37 Å²	37	90.7 Å²	90.7	19%	0.194	50%	0.502	C	S	.	.	H	α-helix	trans	-61.9	-45.1	173.8	-104.8	158.7	0	0	0	113.4	E65 T66 L67 N71 A72 V73 L89 T92	E65-L69 WeakPolarHBondContact O-CB 3.44Å; E65-L69 PolarHBondContact O-N 2.97Å; E65-L69 VanDerWaalsContact O-N 3.15Å; T66-L69 PolarHBondContact O-N 3.19Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.01Å; L69-N71 VanDerWaalsContact C-N 3.32Å; L69-A72 PolarHBondContact O-N 3.36Å; L69-V73 WeakPolarHBondContact O-CB 3.42Å; L69-V73 VanDerWaalsContact O-CG2 3.27Å; L69-V73 WeakPolarHBondContact O-CG2 3.41Å; L69-V73 PolarHBondContact O-N 2.87Å; L69-L89 HydrophobicContact CD2-CD2 3.29Å; L69-T92 HydrophobicContact CD1-CG2 3.37Å; L69-T92 HydrophobicContact CG-CG2 4.05Å
70	I	60.1	Low	60.7	Low	103 Å²	103	92.3 Å²	92.3	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-41.9	179.6	-70.8	166.1	0	0	0	110.1	T66 L67 V73 A74	T66-I70 HydrophobicContact CG2-CD1 3.95Å; T66-I70 VanDerWaalsContact O-CG1 3.27Å; T66-I70 WeakPolarHBondContact O-CG1 3.43Å; T66-I70 PolarHBondContact O-N 2.95Å; L67-I70 PolarHBondContact O-N 3.49Å; I70-V73 PolarHBondContact O-N 3.48Å; I70-A74 WeakPolarHBondContact O-CB 3.34Å; I70-A74 PolarHBondContact O-N 3.33Å; I70-A74 VanDerWaalsContact O-N 3.1Å
71	N	61.4	Low	59.4	Low	93 Å²	93	93.9 Å²	93.9	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-43.8	176.8	-68.9	-24	0	0	0	111.5	L67 D68 L69 V73 A74 E75	L67-N71 VanDerWaalsContact O-CG 3.28Å; L67-N71 PolarHBondContact O-N 3.39Å; L67-N71 PolarHBondContact O-ND2 3.41Å; D68-N71 PolarHBondContact O-N 3.31Å; L69-N71 VanDerWaalsContact C-N 3.32Å; N71-V73 PolarHBondContact O-N 3.38Å; N71-A74 PolarHBondContact O-N 3.13Å; N71-E75 PolarHBondContact O-N 3.35Å
72	A	58.2	Low	58.5	Low	41 Å²	41	94.2 Å²	94.2	34%	0.339	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-39.9	177.5	0	0	0	0	0	112.4	D68 L69 A74 E75 V76	D68-A72 WeakPolarHBondContact O-CB 3.45Å; D68-A72 PolarHBondContact O-N 3.07Å; L69-A72 PolarHBondContact O-N 3.36Å; A72-A74 VanDerWaalsContact C-N 3.34Å; A72-E75 PolarHBondContact O-N 2.81Å; A72-V76 WeakPolarHBondContact O-CG2 3.46Å
73	V	57.4	Low	58.2	Low	96 Å²	96	96.8 Å²	96.8	58%	0.582	53%	0.533	S	S	*	.	H	α-helix	trans	-68.8	-32.3	176.7	170.9	0	0	0	0	112	L69 I70 N71 E75	L69-V73 WeakPolarHBondContact O-CB 3.42Å; L69-V73 VanDerWaalsContact O-CG2 3.27Å; L69-V73 WeakPolarHBondContact O-CG2 3.41Å; L69-V73 PolarHBondContact O-N 2.87Å; I70-V73 PolarHBondContact O-N 3.48Å; N71-V73 PolarHBondContact O-N 3.38Å; V73-E75 VanDerWaalsContact C-N 3.3Å; V73-E75 PolarHBondContact O-N 2.96Å
74	A	56.3	Low	57.7	Low	84 Å²	84	100.2 Å²	100.2	69%	0.694	54%	0.544	S	S	*	.	H	α-helix	trans	-72.2	-18.3	-179.9	0	0	0	0	0	114.1	I70 N71 A72	I70-A74 WeakPolarHBondContact O-CB 3.34Å; I70-A74 PolarHBondContact O-N 3.33Å; I70-A74 VanDerWaalsContact O-N 3.1Å; N71-A74 PolarHBondContact O-N 3.13Å; A72-A74 VanDerWaalsContact C-N 3.34Å
75	E	56	Low	57.3	Low	147 Å²	147	97.6 Å²	97.6	69%	0.687	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	4.1	-175.5	-70.9	-166.5	172.7	0	0	115.4	N71 A72 V73 D77	N71-E75 PolarHBondContact O-N 3.35Å; A72-E75 PolarHBondContact O-N 2.81Å; V73-E75 VanDerWaalsContact C-N 3.3Å; V73-E75 PolarHBondContact O-N 2.96Å; E75-D77 PolarHBondContact O-N 3.44Å
76	V	51	Low	57.3	Low	56 Å²	56	97.4 Å²	97.4	34%	0.339	53%	0.533	S	S	.	.			trans	-99.4	92.9	-174.2	-177.8	0	0	0	0	111.7	A72 R81 V85	A72-V76 WeakPolarHBondContact O-CG2 3.46Å; V76-R81 HydrophobicContact CG1-CB 4.41Å; V76-V85 HydrophobicContact CG2-CG1 4.42Å; V76-V85 HydrophobicContact CG2-CG2 3.89Å
77	D	48.5	Very low	57.6	Low	162 Å²	162	102 Å²	102	87%	0.866	55%	0.548	S	S	*	.			trans	-120	90.5	161.7	-156.7	13.5	0	0	0	107.4	E75	E75-D77 PolarHBondContact O-N 3.44Å
78	S	54.7	Low	57.9	Low	73 Å²	73	102.5 Å²	102.5	51%	0.51	55%	0.548	S	S	.	.	S	Bend	trans	160.7	127.5	160.5	48.1	0	0	0	0	112.2	E80 R81	S78-E80 PolarHBondContact O-N 3.36Å; S78-R81 PolarHBondContact O-N 2.89Å
79	D	54.3	Low	58.1	Low	154 Å²	154	100.9 Å²	100.9	82%	0.824	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-3.4	-170.4	-76	-45.7	0	0	0	116.8
80	E	53.3	Low	58.6	Low	187 Å²	187	104.6 Å²	104.6	87%	0.874	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-16.8	178.3	-106.5	176	168.3	0	0	114.1	S78 N82	S78-E80 PolarHBondContact O-N 3.36Å; E80-N82 PolarHBondContact O-N 3Å
81	R	50.4	Low	59.2	Low	133 Å²	133	102.8 Å²	102.8	50%	0.502	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.6	-3.2	174.8	-101.5	178	173.6	175.3	-4	114	V76 S78 T83 V85	V76-R81 HydrophobicContact CG1-CB 4.41Å; S78-R81 PolarHBondContact O-N 2.89Å; R81-T83 VanDerWaalsContact C-N 3.32Å; R81-T83 PolarHBondContact O-N 2.85Å; R81-V85 HydrophobicContact CB-CG2 4.1Å; R81-V85 VanDerWaalsContact O-CB 3.32Å; R81-V85 WeakPolarHBondContact O-CB 3.36Å; R81-V85 VanDerWaalsContact O-CG2 3.24Å; R81-V85 WeakPolarHBondContact O-CG2 3.47Å; R81-V85 PolarHBondContact O-N 3.2Å; R81-V85 VanDerWaalsContact O-N 3.09Å
82	N	54.8	Low	59.7	Low	93 Å²	93	99.9 Å²	99.9	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-63.4	-29.1	-169.5	-111.4	-23.9	0	0	0	114.3	E80 S86	E80-N82 PolarHBondContact O-N 3Å; N82-S86 WeakPolarHBondContact O-CB 3.5Å; N82-S86 PolarHBondContact O-N 3.35Å; N82-S86 PolarHBondContact O-OG 2.95Å
83	T	59.7	Low	60.1	Low	99 Å²	99	101.5 Å²	101.5	61%	0.607	55%	0.546	S	S	*	.	H	α-helix	trans	-82.2	-45.1	-179.3	43.7	0	0	0	0	112.9	R81 S86 F87	R81-T83 VanDerWaalsContact C-N 3.32Å; R81-T83 PolarHBondContact O-N 2.85Å; T83-S86 WeakPolarHBondContact O-CB 3.27Å; T83-S86 PolarHBondContact O-N 3.35Å; T83-F87 WeakPolarHBondContact O-CD2 3.34Å; T83-F87 PolarHBondContact O-N 3.46Å
84	E	59.3	Low	60.8	Low	145 Å²	145	104.9 Å²	104.9	68%	0.678	55%	0.549	S	S	*	.	H	α-helix	trans	-70.3	-43.5	-179.8	-167.5	133.3	-149.1	0	0	111.6	S86 F87 E88	E84-S86 PolarHBondContact O-N 3.46Å; E84-F87 PolarHBondContact O-N 3.1Å; E84-E88 PolarHBondContact O-N 3.13Å
85	V	58.4	Low	61.8	Low	29 Å²	29	104 Å²	104	18%	0.176	53%	0.532	C	S	.	.	H	α-helix	trans	-60.5	-37.6	170.9	176.5	0	0	0	0	110.4	V76 R81 E88 L89	V76-V85 HydrophobicContact CG2-CG1 4.42Å; V76-V85 HydrophobicContact CG2-CG2 3.89Å; R81-V85 HydrophobicContact CB-CG2 4.1Å; R81-V85 VanDerWaalsContact O-CB 3.32Å; R81-V85 WeakPolarHBondContact O-CB 3.36Å; R81-V85 VanDerWaalsContact O-CG2 3.24Å; R81-V85 WeakPolarHBondContact O-CG2 3.47Å; R81-V85 PolarHBondContact O-N 3.2Å; R81-V85 VanDerWaalsContact O-N 3.09Å; V85-E88 PolarHBondContact O-N 2.97Å; V85-L89 HydrophobicContact CG1-CD1 3.9Å; V85-L89 HydrophobicContact CG1-CG 4.2Å; V85-L89 VanDerWaalsContact O-CB 3.27Å; V85-L89 WeakPolarHBondContact O-CB 3.31Å; V85-L89 WeakPolarHBondContact O-CG 3.23Å; V85-L89 PolarHBondContact O-N 3.32Å
86	S	62.5	Low	62.6	Low	53 Å²	53	99.6 Å²	99.6	37%	0.371	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-39	173.3	-70.6	0	0	0	0	112.8	N82 T83 E84 L90	N82-S86 WeakPolarHBondContact O-CB 3.5Å; N82-S86 PolarHBondContact O-N 3.35Å; N82-S86 PolarHBondContact O-OG 2.95Å; T83-S86 WeakPolarHBondContact O-CB 3.27Å; T83-S86 PolarHBondContact O-N 3.35Å; E84-S86 PolarHBondContact O-N 3.46Å; S86-L90 VanDerWaalsContact O-CB 3.29Å; S86-L90 WeakPolarHBondContact O-CB 3.37Å; S86-L90 WeakPolarHBondContact O-CG 3.38Å; S86-L90 PolarHBondContact O-N 2.97Å
87	F	65.9	Low	63.6	Low	152 Å²	152	101.3 Å²	101.3	67%	0.667	52%	0.517	S	S	*	.	H	α-helix	trans	-66.2	-43.1	176.1	-83	-68.7	0	0	0	112.1	T83 E84 L90 S91	T83-F87 WeakPolarHBondContact O-CD2 3.34Å; T83-F87 PolarHBondContact O-N 3.46Å; E84-F87 PolarHBondContact O-N 3.1Å; F87-L90 PolarHBondContact O-N 3.43Å; F87-S91 WeakPolarHBondContact O-CB 3.22Å; F87-S91 PolarHBondContact O-N 2.91Å
88	E	70.7	Confident	64.9	Low	117 Å²	117	97 Å²	97	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-42.6	175.4	-71.6	-170.3	160	0	0	112	E84 V85 L90 S91 T92	E84-E88 PolarHBondContact O-N 3.13Å; V85-E88 PolarHBondContact O-N 2.97Å; E88-L90 PolarHBondContact O-N 3.36Å; E88-S91 PolarHBondContact O-N 2.92Å; E88-T92 WeakPolarHBondContact O-CB 3.41Å; E88-T92 PolarHBondContact O-N 3.17Å; E88-T92 PolarHBondContact O-OG1 3.26Å
89	L	67.1	Low	65.9	Low	65 Å²	65	94.6 Å²	94.6	34%	0.34	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-43.6	174	-74.6	174.2	0	0	0	111.8	L69 V85 T92 T93	L69-L89 HydrophobicContact CD2-CD2 3.29Å; V85-L89 HydrophobicContact CG1-CD1 3.9Å; V85-L89 HydrophobicContact CG1-CG 4.2Å; V85-L89 VanDerWaalsContact O-CB 3.27Å; V85-L89 WeakPolarHBondContact O-CB 3.31Å; V85-L89 WeakPolarHBondContact O-CG 3.23Å; V85-L89 PolarHBondContact O-N 3.32Å; L89-T92 PolarHBondContact O-N 2.94Å; L89-T93 VanDerWaalsContact O-CB 3.3Å; L89-T93 WeakPolarHBondContact O-CB 3.37Å; L89-T93 PolarHBondContact O-N 2.93Å; L89-T93 PolarHBondContact O-OG1 3.11Å
90	L	71.5	Confident	66.7	Low	115 Å²	115	95 Å²	95	60%	0.602	47%	0.467	S	S	*	.	H	α-helix	trans	-65.3	-43.4	176.6	-75.9	170.8	0	0	0	111.7	S86 F87 E88 T93 R94	S86-L90 VanDerWaalsContact O-CB 3.29Å; S86-L90 WeakPolarHBondContact O-CB 3.37Å; S86-L90 WeakPolarHBondContact O-CG 3.38Å; S86-L90 PolarHBondContact O-N 2.97Å; F87-L90 PolarHBondContact O-N 3.43Å; E88-L90 PolarHBondContact O-N 3.36Å; L90-T93 PolarHBondContact O-N 3.48Å; L90-R94 WeakPolarHBondContact O-CB 3.42Å; L90-R94 PolarHBondContact O-N 3.48Å
91	S	71.1	Confident	67.7	Low	64 Å²	64	91.8 Å²	91.8	45%	0.448	45%	0.452	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.8	-174.4	0	0	0	0	111.3	F87 E88 R94 N95	F87-S91 WeakPolarHBondContact O-CB 3.22Å; F87-S91 PolarHBondContact O-N 2.91Å; E88-S91 PolarHBondContact O-N 2.92Å; S91-R94 WeakPolarHBondContact O-CB 3.49Å; S91-R94 PolarHBondContact O-N 3.48Å; S91-N95 PolarHBondContact O-N 3.48Å; S91-N95 PolarHBondContact O-OD1 3.38Å
92	T	71.9	Confident	69.2	Low	32 Å²	32	91 Å²	91	20%	0.196	45%	0.452	C	S	.	.	H	α-helix	trans	-67.4	-39	178.6	-49.3	0	0	0	0	111.6	L69 E88 L89 R94 N95 K96	L69-T92 HydrophobicContact CD1-CG2 3.37Å; L69-T92 HydrophobicContact CG-CG2 4.05Å; E88-T92 WeakPolarHBondContact O-CB 3.41Å; E88-T92 PolarHBondContact O-N 3.17Å; E88-T92 PolarHBondContact O-OG1 3.26Å; L89-T92 PolarHBondContact O-N 2.94Å; T92-R94 VanDerWaalsContact C-N 3.31Å; T92-R94 PolarHBondContact O-N 3.2Å; T92-N95 PolarHBondContact O-N 2.94Å; T92-K96 WeakPolarHBondContact O-CG 3.48Å; T92-K96 PolarHBondContact O-N 3.34Å
93	T	67.5	Low	70.1	Confident	75 Å²	75	89.4 Å²	89.4	46%	0.46	44%	0.443	S	S	.	.	H	α-helix	trans	-62.1	-41.1	174.5	-59.4	0	0	0	0	111	L89 L90 K96 I97	L89-T93 VanDerWaalsContact O-CB 3.3Å; L89-T93 WeakPolarHBondContact O-CB 3.37Å; L89-T93 PolarHBondContact O-N 2.93Å; L89-T93 PolarHBondContact O-OG1 3.11Å; L90-T93 PolarHBondContact O-N 3.48Å; T93-K96 PolarHBondContact O-N 2.94Å; T93-I97 HydrophobicContact CG2-CD1 4.09Å; T93-I97 VanDerWaalsContact O-CG1 3.31Å; T93-I97 WeakPolarHBondContact O-CG1 3.2Å; T93-I97 PolarHBondContact O-N 3.25Å
94	R	72	Confident	71	Confident	168 Å²	168	92.3 Å²	92.3	63%	0.634	45%	0.448	S	S	*	.	H	α-helix	trans	-62	-48.3	174.4	-178	-178.8	179.7	145.7	3	111.8	L90 S91 T92 K96 I97 E98	L90-R94 WeakPolarHBondContact O-CB 3.42Å; L90-R94 PolarHBondContact O-N 3.48Å; S91-R94 WeakPolarHBondContact O-CB 3.49Å; S91-R94 PolarHBondContact O-N 3.48Å; T92-R94 VanDerWaalsContact C-N 3.31Å; T92-R94 PolarHBondContact O-N 3.2Å; R94-K96 VanDerWaalsContact C-N 3.29Å; R94-K96 PolarHBondContact O-N 3.02Å; R94-I97 PolarHBondContact O-N 3.33Å; R94-I97 VanDerWaalsContact O-N 3.16Å; R94-E98 IonicContact CZ-OE1 3.37Å; R94-E98 IonicContact NE-OE1 3.02Å; R94-E98 PolarHBondContact NE-OE1 3.23Å; R94-E98 VanDerWaalsContact NE-OE1 3.09Å; R94-E98 IonicContact NH2-OE1 2.9Å; R94-E98 WeakPolarHBondContact O-CG 3.43Å; R94-E98 PolarHBondContact O-N 2.74Å
95	N	78.2	Confident	72	Confident	64 Å²	64	90.4 Å²	90.4	34%	0.342	44%	0.442	S	S	.	.	H	α-helix	trans	-58.3	-41.7	176.8	-70.5	-4.8	0	0	0	111.6	S91 T92 E98 A99	S91-N95 PolarHBondContact O-N 3.48Å; S91-N95 PolarHBondContact O-OD1 3.38Å; T92-N95 PolarHBondContact O-N 2.94Å; N95-E98 PolarHBondContact O-N 3.01Å; N95-A99 WeakPolarHBondContact O-CB 3.37Å; N95-A99 PolarHBondContact O-N 3.49Å
96	K	71.3	Confident	72.9	Confident	55 Å²	55	90.4 Å²	90.4	24%	0.239	44%	0.442	C	S	.	.	H	α-helix	trans	-62.1	-45.7	174.6	-75.5	-178.9	178	-174.9	0	112.3	T92 T93 R94 E98 A99 Y100	T92-K96 WeakPolarHBondContact O-CG 3.48Å; T92-K96 PolarHBondContact O-N 3.34Å; T93-K96 PolarHBondContact O-N 2.94Å; R94-K96 VanDerWaalsContact C-N 3.29Å; R94-K96 PolarHBondContact O-N 3.02Å; K96-E98 VanDerWaalsContact C-N 3.33Å; K96-E98 PolarHBondContact O-N 3Å; K96-A99 PolarHBondContact O-N 3.45Å; K96-Y100 WeakPolarHBondContact O-CB 3.39Å; K96-Y100 WeakPolarHBondContact O-CD2 3.41Å; K96-Y100 PolarHBondContact O-N 3.34Å
97	I	72	Confident	73.6	Confident	92 Å²	92	91 Å²	91	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-58.9	-46.9	176.2	-69.7	166.2	0	0	0	110	T93 R94 A99 Y100 E101	T93-I97 HydrophobicContact CG2-CD1 4.09Å; T93-I97 VanDerWaalsContact O-CG1 3.31Å; T93-I97 WeakPolarHBondContact O-CG1 3.2Å; T93-I97 PolarHBondContact O-N 3.25Å; R94-I97 PolarHBondContact O-N 3.33Å; R94-I97 VanDerWaalsContact O-N 3.16Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.06Å; I97-Y100 PolarHBondContact O-N 3.48Å; I97-E101 WeakPolarHBondContact O-CG 3.49Å; I97-E101 PolarHBondContact O-N 2.96Å
98	E	76.8	Confident	74.4	Confident	73 Å²	73	86 Å²	86	34%	0.341	43%	0.431	S	S	.	.	H	α-helix	trans	-62.2	-39.2	177.5	-69.9	179.4	-166.5	0	0	112.2	R94 N95 K96 E101 K102	R94-E98 IonicContact CZ-OE1 3.37Å; R94-E98 IonicContact NE-OE1 3.02Å; R94-E98 PolarHBondContact NE-OE1 3.23Å; R94-E98 VanDerWaalsContact NE-OE1 3.09Å; R94-E98 IonicContact NH2-OE1 2.9Å; R94-E98 WeakPolarHBondContact O-CG 3.43Å; R94-E98 PolarHBondContact O-N 2.74Å; N95-E98 PolarHBondContact O-N 3.01Å; K96-E98 VanDerWaalsContact C-N 3.33Å; K96-E98 PolarHBondContact O-N 3Å; E98-E101 PolarHBondContact O-N 2.85Å; E98-K102 WeakPolarHBondContact O-CG 3.33Å; E98-K102 PolarHBondContact O-N 3.49Å
99	A	75.4	Confident	75	Confident	22 Å²	22	86.3 Å²	86.3	18%	0.182	44%	0.435	C	S	.	.	H	α-helix	trans	-67.2	-41.6	175.1	0	0	0	0	0	112.4	N95 K96 I97 E101 K102 L103	N95-A99 WeakPolarHBondContact O-CB 3.37Å; N95-A99 PolarHBondContact O-N 3.49Å; K96-A99 PolarHBondContact O-N 3.45Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.06Å; A99-E101 VanDerWaalsContact C-N 3.35Å; A99-K102 PolarHBondContact O-N 3Å; A99-L103 WeakPolarHBondContact O-CB 3.36Å; A99-L103 PolarHBondContact O-N 3.36Å
100	Y	71.3	Confident	75.6	Confident	163 Å²	163	85.7 Å²	85.7	64%	0.639	43%	0.434	S	S	*	.	H	α-helix	trans	-62.9	-40	174.9	-87.5	-66.4	0	0	0	112	K96 I97 L103 K104	K96-Y100 WeakPolarHBondContact O-CB 3.39Å; K96-Y100 WeakPolarHBondContact O-CD2 3.41Å; K96-Y100 PolarHBondContact O-N 3.34Å; I97-Y100 PolarHBondContact O-N 3.48Å; Y100-L103 PolarHBondContact O-N 2.93Å; Y100-K104 WeakPolarHBondContact O-CB 3.27Å; Y100-K104 PolarHBondContact O-N 3.46Å
101	E	75.1	Confident	76.1	Confident	118 Å²	118	85.9 Å²	85.9	55%	0.551	43%	0.432	S	S	*	.	H	α-helix	trans	-64.5	-43.8	174.8	-74.2	-177.8	170.1	0	0	111.8	I97 E98 A99 K104 N105	I97-E101 WeakPolarHBondContact O-CG 3.49Å; I97-E101 PolarHBondContact O-N 2.96Å; E98-E101 PolarHBondContact O-N 2.85Å; A99-E101 VanDerWaalsContact C-N 3.35Å; E101-K104 PolarHBondContact O-N 3.41Å; E101-N105 VanDerWaalsContact O-CG 3.27Å; E101-N105 PolarHBondContact O-N 3.06Å; E101-N105 PolarHBondContact O-ND2 3.18Å
102	K	80	Confident	76.8	Confident	116 Å²	116	86.5 Å²	86.5	50%	0.504	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-47.1	173.7	-74.1	172.8	-174.8	170.1	0	111.6	E98 A99 K104 N105 T106	E98-K102 WeakPolarHBondContact O-CG 3.33Å; E98-K102 PolarHBondContact O-N 3.49Å; A99-K102 PolarHBondContact O-N 3Å; K102-K104 PolarHBondContact O-N 3.3Å; K102-N105 PolarHBondContact O-N 2.86Å; K102-T106 PolarHBondContact O-N 3.39Å; K102-T106 PolarHBondContact O-OG1 3.3Å
103	L	75	Confident	77.1	Confident	60 Å²	60	86 Å²	86	31%	0.314	43%	0.432	S	S	.	.	H	α-helix	trans	-59.8	-45.5	178.5	-177.1	65.5	0	0	0	111.4	L58 A99 Y100 N105 T106 T107	L58-L103 HydrophobicContact CD1-CD1 4.28Å; A99-L103 WeakPolarHBondContact O-CB 3.36Å; A99-L103 PolarHBondContact O-N 3.36Å; Y100-L103 PolarHBondContact O-N 2.93Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-N105 PolarHBondContact O-N 3.48Å; L103-T106 PolarHBondContact O-N 3.38Å; L103-T107 PolarHBondContact O-N 2.86Å; L103-T107 PolarHBondContact O-OG1 3.21Å; L103-T107 VanDerWaalsContact O-OG1 3.05Å
104	K	78	Confident	77.7	Confident	160 Å²	160	86.6 Å²	86.6	70%	0.696	43%	0.432	S	S	*	.	H	α-helix	trans	-58.7	-43.8	176.9	-175.4	-179.4	178.4	-177.2	0	111.9	Y100 E101 K102 T107 A108	Y100-K104 WeakPolarHBondContact O-CB 3.27Å; Y100-K104 PolarHBondContact O-N 3.46Å; E101-K104 PolarHBondContact O-N 3.41Å; K102-K104 PolarHBondContact O-N 3.3Å; K104-T107 PolarHBondContact O-N 3.36Å; K104-A108 PolarHBondContact O-N 2.92Å; K104-A108 VanDerWaalsContact O-N 3.14Å
105	N	81	Confident	78.3	Confident	105 Å²	105	81.8 Å²	81.8	56%	0.561	42%	0.423	S	S	*	.	H	α-helix	trans	-65.2	-41.8	177.1	-70.1	-22.7	0	0	0	111.8	E101 K102 L103 A108 L109	E101-N105 VanDerWaalsContact O-CG 3.27Å; E101-N105 PolarHBondContact O-N 3.06Å; E101-N105 PolarHBondContact O-ND2 3.18Å; K102-N105 PolarHBondContact O-N 2.86Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-N105 PolarHBondContact O-N 3.48Å; N105-A108 PolarHBondContact O-N 2.98Å; N105-L109 WeakPolarHBondContact O-CG 3.45Å; N105-L109 PolarHBondContact O-N 3.34Å; N105-L109 VanDerWaalsContact O-N 3.07Å
106	T	76.6	Confident	78.5	Confident	29 Å²	29	84.2 Å²	84.2	18%	0.178	43%	0.431	C	S	.	.	H	α-helix	trans	-63.7	-43.9	176.6	-58	0	0	0	0	111.9	K102 L103 A108 L109 V110	K102-T106 PolarHBondContact O-N 3.39Å; K102-T106 PolarHBondContact O-OG1 3.3Å; L103-T106 PolarHBondContact O-N 3.38Å; T106-A108 VanDerWaalsContact C-N 3.32Å; T106-A108 PolarHBondContact O-N 2.92Å; T106-L109 WeakPolarHBondContact O-CB 3.31Å; T106-L109 PolarHBondContact O-N 3.41Å; T106-L109 VanDerWaalsContact O-N 3.13Å; T106-V110 WeakPolarHBondContact O-CG2 3.44Å; T106-V110 PolarHBondContact O-N 2.85Å
107	T	76.8	Confident	78.7	Confident	66 Å²	66	82.1 Å²	82.1	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-58.1	-45	175.7	-59.6	0	0	0	0	111.3	L103 K104 L109 V110 E111	L103-T107 PolarHBondContact O-N 2.86Å; L103-T107 PolarHBondContact O-OG1 3.21Å; L103-T107 VanDerWaalsContact O-OG1 3.05Å; K104-T107 PolarHBondContact O-N 3.36Å; T107-L109 VanDerWaalsContact C-N 3.32Å; T107-L109 PolarHBondContact O-N 2.97Å; T107-V110 PolarHBondContact O-N 3.42Å; T107-E111 WeakPolarHBondContact O-CG 3.18Å; T107-E111 PolarHBondContact O-N 2.94Å
108	A	83.4	Confident	79.1	Confident	47 Å²	47	82.4 Å²	82.4	39%	0.388	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-38.3	176.4	0	0	0	0	0	112.5	K104 N105 T106 V112	K104-A108 PolarHBondContact O-N 2.92Å; K104-A108 VanDerWaalsContact O-N 3.14Å; N105-A108 PolarHBondContact O-N 2.98Å; T106-A108 VanDerWaalsContact C-N 3.32Å; T106-A108 PolarHBondContact O-N 2.92Å; A108-V112 WeakPolarHBondContact O-CG2 3.45Å; A108-V112 PolarHBondContact O-N 2.97Å; A108-V112 VanDerWaalsContact O-N 3.13Å
109	L	82.6	Confident	79.4	Confident	124 Å²	124	85.2 Å²	85.2	65%	0.649	44%	0.436	S	S	*	.	H	α-helix	trans	-66	-39.7	175	-71	172.5	0	0	0	112.4	N105 T106 T107 V112 A113	N105-L109 WeakPolarHBondContact O-CG 3.45Å; N105-L109 PolarHBondContact O-N 3.34Å; N105-L109 VanDerWaalsContact O-N 3.07Å; T106-L109 WeakPolarHBondContact O-CB 3.31Å; T106-L109 PolarHBondContact O-N 3.41Å; T106-L109 VanDerWaalsContact O-N 3.13Å; T107-L109 VanDerWaalsContact C-N 3.32Å; T107-L109 PolarHBondContact O-N 2.97Å; L109-V112 PolarHBondContact O-N 3.24Å; L109-A113 WeakPolarHBondContact O-CB 3.47Å; L109-A113 PolarHBondContact O-N 3.39Å
110	V	79.3	Confident	79.4	Confident	52 Å²	52	86 Å²	86	32%	0.315	44%	0.438	S	S	.	.	H	α-helix	trans	-65	-43.5	176.9	171.5	0	0	0	0	111	A51 T106 T107 V112 A113 L114	A51-V110 HydrophobicContact CB-CG2 3.75Å; T106-V110 WeakPolarHBondContact O-CG2 3.44Å; T106-V110 PolarHBondContact O-N 2.85Å; T107-V110 PolarHBondContact O-N 3.42Å; V110-V112 VanDerWaalsContact C-N 3.35Å; V110-V112 PolarHBondContact O-N 3.24Å; V110-A113 PolarHBondContact O-N 3.32Å; V110-L114 WeakPolarHBondContact O-CB 3.46Å; V110-L114 PolarHBondContact O-N 2.9Å
111	E	83.3	Confident	79.6	Confident	119 Å²	119	82.7 Å²	82.7	56%	0.556	44%	0.435	S	S	*	.	H	α-helix	trans	-59.6	-44.8	176	-72.8	174.6	175.4	0	0	111.6	T107 A113 L114 C115	T107-E111 WeakPolarHBondContact O-CG 3.18Å; T107-E111 PolarHBondContact O-N 2.94Å; E111-A113 VanDerWaalsContact C-N 3.35Å; E111-A113 PolarHBondContact O-N 3.01Å; E111-L114 PolarHBondContact O-N 3.5Å; E111-C115 WeakPolarHBondContact O-CB 3.37Å; E111-C115 PolarHBondContact O-N 3.2Å; E111-C115 PolarHBondContact O-SG 3.36Å; E111-C115 VanDerWaalsContact O-SG 3.32Å
112	V	86	Confident	80	Confident	77 Å²	77	83.1 Å²	83.1	47%	0.467	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-41.7	175.2	171.5	0	0	0	0	111.6	A108 L109 V110 K116	A108-V112 WeakPolarHBondContact O-CG2 3.45Å; A108-V112 PolarHBondContact O-N 2.97Å; A108-V112 VanDerWaalsContact O-N 3.13Å; L109-V112 PolarHBondContact O-N 3.24Å; V110-V112 VanDerWaalsContact C-N 3.35Å; V110-V112 PolarHBondContact O-N 3.24Å; V112-K116 HydrophobicContact CG1-CD 4.43Å; V112-K116 WeakPolarHBondContact O-CG 3.45Å; V112-K116 PolarHBondContact O-N 2.91Å; V112-K116 VanDerWaalsContact O-N 3.1Å
113	A	77.2	Confident	80.1	Confident	21 Å²	21	82.3 Å²	82.3	17%	0.174	44%	0.436	C	S	.	.	H	α-helix	trans	-66	-40.6	178.3	0	0	0	0	0	112.1	I47 L109 V110 E111 K116 A117	I47-A113 HydrophobicContact CG2-CB 4.15Å; L109-A113 WeakPolarHBondContact O-CB 3.47Å; L109-A113 PolarHBondContact O-N 3.39Å; V110-A113 PolarHBondContact O-N 3.32Å; E111-A113 VanDerWaalsContact C-N 3.35Å; E111-A113 PolarHBondContact O-N 3.01Å; A113-K116 PolarHBondContact O-N 3.32Å; A113-A117 PolarHBondContact O-N 3.44Å
114	L	80.6	Confident	80.2	Confident	87 Å²	87	81.3 Å²	81.3	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-46.7	176.3	-173.6	66.9	0	0	0	111	V110 E111 K116 A117 E118	V110-L114 WeakPolarHBondContact O-CB 3.46Å; V110-L114 PolarHBondContact O-N 2.9Å; E111-L114 PolarHBondContact O-N 3.5Å; L114-K116 VanDerWaalsContact C-N 3.32Å; L114-K116 PolarHBondContact O-N 2.9Å; L114-A117 WeakPolarHBondContact O-CB 3.29Å; L114-A117 PolarHBondContact O-N 3.11Å; L114-A117 VanDerWaalsContact O-N 3.11Å; L114-E118 WeakPolarHBondContact O-CG 3.43Å; L114-E118 PolarHBondContact O-N 3.03Å
115	C	84.6	Confident	80.2	Confident	68 Å²	68	75.1 Å²	75.1	46%	0.459	41%	0.413	S	S	.	.	H	α-helix	trans	-55.6	-45.7	174.9	-74.3	0	0	0	0	111.9	E111 A117 E118 E119	E111-C115 WeakPolarHBondContact O-CB 3.37Å; E111-C115 PolarHBondContact O-N 3.2Å; E111-C115 PolarHBondContact O-SG 3.36Å; E111-C115 VanDerWaalsContact O-SG 3.32Å; C115-A117 PolarHBondContact O-N 2.93Å; C115-E118 PolarHBondContact O-N 3.15Å; C115-E119 WeakPolarHBondContact O-CG 3.5Å; C115-E119 PolarHBondContact O-N 2.9Å
116	K	82.7	Confident	80.3	Confident	114 Å²	114	78.8 Å²	78.8	50%	0.496	42%	0.419	S	S	.	.	H	α-helix	trans	-63.8	-39.3	176.3	-73	177.7	179.7	179.9	0	112.7	V112 A113 L114 E119 T120	V112-K116 HydrophobicContact CG1-CD 4.43Å; V112-K116 WeakPolarHBondContact O-CG 3.45Å; V112-K116 PolarHBondContact O-N 2.91Å; V112-K116 VanDerWaalsContact O-N 3.1Å; A113-K116 PolarHBondContact O-N 3.32Å; L114-K116 VanDerWaalsContact C-N 3.32Å; L114-K116 PolarHBondContact O-N 2.9Å; K116-E119 PolarHBondContact O-N 3.28Å; K116-T120 WeakPolarHBondContact O-CB 3.39Å; K116-T120 PolarHBondContact O-N 2.98Å; K116-T120 PolarHBondContact O-OG1 3.44Å
117	A	74.5	Confident	80.4	Confident	11 Å²	11	79.2 Å²	79.2	9%	0.091	42%	0.42	C	S	.	.	H	α-helix	trans	-64.3	-43.1	176.6	0	0	0	0	0	111.3	Q44 A113 L114 C115 T120 V121	Q44-A117 HydrophobicContact CG-CB 4.45Å; A113-A117 PolarHBondContact O-N 3.44Å; L114-A117 WeakPolarHBondContact O-CB 3.29Å; L114-A117 PolarHBondContact O-N 3.11Å; L114-A117 VanDerWaalsContact O-N 3.11Å; C115-A117 PolarHBondContact O-N 2.93Å; A117-T120 WeakPolarHBondContact O-CB 3.41Å; A117-T120 PolarHBondContact O-N 3.08Å; A117-V121 WeakPolarHBondContact O-CG2 3.47Å; A117-V121 PolarHBondContact O-N 2.72Å
118	E	81	Confident	80.4	Confident	99 Å²	99	85.3 Å²	85.3	46%	0.463	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-42.9	176.2	-71.2	-175.9	176	0	0	112.8	L114 C115 T120 V121 K122	L114-E118 WeakPolarHBondContact O-CG 3.43Å; L114-E118 PolarHBondContact O-N 3.03Å; C115-E118 PolarHBondContact O-N 3.15Å; E118-T120 VanDerWaalsContact C-N 3.28Å; E118-T120 PolarHBondContact O-N 3.32Å; E118-V121 PolarHBondContact O-N 2.73Å; E118-K122 WeakPolarHBondContact O-CG 3.31Å; E118-K122 PolarHBondContact O-N 2.89Å
119	E	83.2	Confident	80.2	Confident	131 Å²	131	87.8 Å²	87.8	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-59.4	-42.3	174	-74.7	178.1	173.6	0	0	111.7	C115 K116 K122 L123	C115-E119 WeakPolarHBondContact O-CG 3.5Å; C115-E119 PolarHBondContact O-N 2.9Å; K116-E119 PolarHBondContact O-N 3.28Å; E119-K122 WeakPolarHBondContact O-CB 3.31Å; E119-K122 PolarHBondContact O-N 2.83Å; E119-L123 PolarHBondContact O-N 3.4Å
120	T	75.6	Confident	80.3	Confident	38 Å²	38	87.5 Å²	87.5	23%	0.233	43%	0.434	C	S	.	.	H	α-helix	trans	-63.3	-46.4	178.3	-60.7	0	0	0	0	111.5	L40 K116 A117 E118 K122 L123 V124	L40-T120 HydrophobicContact CB-CG2 4.35Å; L40-T120 HydrophobicContact CD1-CG2 3.33Å; L40-T120 HydrophobicContact CD2-CG2 3.94Å; L40-T120 HydrophobicContact CG-CG2 4.06Å; K116-T120 WeakPolarHBondContact O-CB 3.39Å; K116-T120 PolarHBondContact O-N 2.98Å; K116-T120 PolarHBondContact O-OG1 3.44Å; A117-T120 WeakPolarHBondContact O-CB 3.41Å; A117-T120 PolarHBondContact O-N 3.08Å; E118-T120 VanDerWaalsContact C-N 3.28Å; E118-T120 PolarHBondContact O-N 3.32Å; T120-K122 VanDerWaalsContact C-N 3.31Å; T120-K122 PolarHBondContact O-N 2.79Å; T120-L123 PolarHBondContact O-N 2.82Å; T120-V124 WeakPolarHBondContact O-CG2 3.48Å; T120-V124 PolarHBondContact O-N 2.85Å
121	V	76.2	Confident	80.2	Confident	94 Å²	94	86.1 Å²	86.1	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-60.2	-42.3	175.7	170.7	0	0	0	0	111	A117 E118 L123 V124 G125	A117-V121 WeakPolarHBondContact O-CG2 3.47Å; A117-V121 PolarHBondContact O-N 2.72Å; E118-V121 PolarHBondContact O-N 2.73Å; V121-L123 PolarHBondContact O-N 3.35Å; V121-V124 PolarHBondContact O-N 2.77Å; V121-G125 PolarHBondContact O-N 3Å
122	K	82.1	Confident	80	Confident	128 Å²	128	83.2 Å²	83.2	56%	0.557	42%	0.419	S	S	*	.	H	α-helix	trans	-61.3	-42.6	175.4	-73.2	169.7	-174.4	164.9	0	111.7	E118 E119 T120 G125 R126	E118-K122 WeakPolarHBondContact O-CG 3.31Å; E118-K122 PolarHBondContact O-N 2.89Å; E119-K122 WeakPolarHBondContact O-CB 3.31Å; E119-K122 PolarHBondContact O-N 2.83Å; T120-K122 VanDerWaalsContact C-N 3.31Å; T120-K122 PolarHBondContact O-N 2.79Å; K122-G125 PolarHBondContact O-N 3.14Å; K122-R126 WeakPolarHBondContact O-CG 3.5Å; K122-R126 PolarHBondContact O-N 2.73Å
123	L	81.6	Confident	79.8	Confident	99 Å²	99	86.9 Å²	86.9	52%	0.518	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-47	177.5	-178.5	63.2	0	0	0	111.7	E119 T120 V121 G125 R126 I127	E119-L123 PolarHBondContact O-N 3.4Å; T120-L123 PolarHBondContact O-N 2.82Å; V121-L123 PolarHBondContact O-N 3.35Å; L123-G125 VanDerWaalsContact C-N 3.29Å; L123-G125 PolarHBondContact O-N 3.34Å; L123-R126 WeakPolarHBondContact O-CB 2.99Å; L123-R126 PolarHBondContact O-N 3.06Å; L123-R126 VanDerWaalsContact O-N 3.11Å; L123-I127 HydrophobicContact CD1-CD1 4.32Å; L123-I127 HydrophobicContact CG-CD1 3.97Å; L123-I127 WeakPolarHBondContact O-CG1 3.41Å; L123-I127 PolarHBondContact O-N 2.93Å
124	V	77.6	Confident	80	Confident	39 Å²	39	89.3 Å²	89.3	24%	0.236	44%	0.437	C	S	.	.	H	α-helix	trans	-57.7	-43.3	175.5	168.3	0	0	0	0	111	I37 T120 V121 R126 I127 R128	I37-V124 HydrophobicContact CD1-CG1 3.51Å; I37-V124 HydrophobicContact CD1-CG2 4.44Å; I37-V124 HydrophobicContact CG1-CB 4.47Å; I37-V124 HydrophobicContact CG1-CG1 3.74Å; I37-V124 HydrophobicContact CG1-CG2 3.82Å; T120-V124 WeakPolarHBondContact O-CG2 3.48Å; T120-V124 PolarHBondContact O-N 2.85Å; V121-V124 PolarHBondContact O-N 2.77Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.46Å; V124-I127 PolarHBondContact O-N 3.25Å; V124-R128 WeakPolarHBondContact O-CB 3.49Å; V124-R128 PolarHBondContact O-N 2.84Å
125	G	77.8	Confident	80	Confident	29 Å²	29	90.1 Å²	90.1	30%	0.299	44%	0.441	S	S	.	.	H	α-helix	trans	-59.3	-42.1	175	0	0	0	0	0	113.1	V121 K122 L123 R128 N129	V121-G125 PolarHBondContact O-N 3Å; K122-G125 PolarHBondContact O-N 3.14Å; L123-G125 VanDerWaalsContact C-N 3.29Å; L123-G125 PolarHBondContact O-N 3.34Å; G125-R128 PolarHBondContact O-N 2.84Å; G125-N129 WeakPolarHBondContact O-CB 3.35Å; G125-N129 VanDerWaalsContact O-CG 3.24Å; G125-N129 PolarHBondContact O-N 2.84Å; G125-N129 PolarHBondContact O-ND2 3.41Å
126	R	83	Confident	79.7	Confident	182 Å²	182	88.8 Å²	88.8	69%	0.687	44%	0.439	S	S	*	.	H	α-helix	trans	-63.8	-43.9	175.6	-70.4	174.8	-176.5	-178.8	1.7	112	K122 L123 V124 N129 Y130	K122-R126 WeakPolarHBondContact O-CG 3.5Å; K122-R126 PolarHBondContact O-N 2.73Å; L123-R126 WeakPolarHBondContact O-CB 2.99Å; L123-R126 PolarHBondContact O-N 3.06Å; L123-R126 VanDerWaalsContact O-N 3.11Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.46Å; R126-N129 PolarHBondContact O-N 3.44Å; R126-Y130 PolarHBondContact O-N 2.87Å
127	I	79	Confident	79.6	Confident	39 Å²	39	86.6 Å²	86.6	20%	0.2	44%	0.437	C	S	.	.	H	α-helix	trans	-62.9	-46.9	178.5	-67.7	165.1	0	0	0	110.5	F33 L123 V124 N129 Y130 Y131	F33-I127 HydrophobicContact CD1-CD1 4.09Å; F33-I127 HydrophobicContact CD1-CG2 4.19Å; F33-I127 HydrophobicContact CD2-CG2 3.74Å; F33-I127 HydrophobicContact CE1-CD1 3.67Å; F33-I127 HydrophobicContact CE1-CG2 4.23Å; F33-I127 HydrophobicContact CE2-CG2 3.79Å; F33-I127 HydrophobicContact CG-CG2 3.97Å; F33-I127 HydrophobicContact CZ-CD1 4.13Å; F33-I127 HydrophobicContact CZ-CG2 4.03Å; L123-I127 HydrophobicContact CD1-CD1 4.32Å; L123-I127 HydrophobicContact CG-CD1 3.97Å; L123-I127 WeakPolarHBondContact O-CG1 3.41Å; L123-I127 PolarHBondContact O-N 2.93Å; V124-I127 PolarHBondContact O-N 3.25Å; I127-N129 VanDerWaalsContact C-N 3.31Å; I127-N129 PolarHBondContact O-N 3.38Å; I127-Y130 WeakPolarHBondContact O-CB 3.31Å; I127-Y130 PolarHBondContact O-N 2.85Å; I127-Y131 HydrophobicContact CG2-CD2 3.76Å; I127-Y131 HydrophobicContact CG2-CE2 3.66Å; I127-Y131 VanDerWaalsContact O-CD2 3.3Å; I127-Y131 WeakPolarHBondContact O-CD2 3.37Å; I127-Y131 PolarHBondContact O-N 2.81Å
128	R	77.9	Confident	79.8	Confident	193 Å²	193	87.4 Å²	87.4	73%	0.728	44%	0.44	S	S	*	.	H	α-helix	trans	-57.1	-45.5	175.7	-177.7	-179.5	178	177.7	0.2	111.6	V124 G125 Y131 A132	V124-R128 WeakPolarHBondContact O-CB 3.49Å; V124-R128 PolarHBondContact O-N 2.84Å; G125-R128 PolarHBondContact O-N 2.84Å; R128-Y131 PolarHBondContact O-N 2.89Å; R128-A132 VanDerWaalsContact O-CB 3.31Å; R128-A132 WeakPolarHBondContact O-CB 3.26Å; R128-A132 PolarHBondContact O-N 3.06Å
129	N	79.5	Confident	79.9	Confident	100 Å²	100	84.8 Å²	84.8	54%	0.535	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-37.3	178.8	-73.7	-18	0	0	0	112.5	G125 R126 I127 K133	G125-N129 WeakPolarHBondContact O-CB 3.35Å; G125-N129 VanDerWaalsContact O-CG 3.24Å; G125-N129 PolarHBondContact O-N 2.84Å; G125-N129 PolarHBondContact O-ND2 3.41Å; R126-N129 PolarHBondContact O-N 3.44Å; I127-N129 VanDerWaalsContact C-N 3.31Å; I127-N129 PolarHBondContact O-N 3.38Å; N129-K133 WeakPolarHBondContact O-CG 3.48Å; N129-K133 PolarHBondContact O-N 2.9Å; N129-K133 VanDerWaalsContact O-N 3.11Å
130	Y	83	Confident	79.9	Confident	118 Å²	118	81.4 Å²	81.4	46%	0.463	43%	0.425	S	S	.	.	H	α-helix	trans	-60.4	-53.6	174.2	175.3	-101.2	0	0	0	110.9	R126 I127 A132 K133 E134	R126-Y130 PolarHBondContact O-N 2.87Å; I127-Y130 WeakPolarHBondContact O-CB 3.31Å; I127-Y130 PolarHBondContact O-N 2.85Å; Y130-A132 VanDerWaalsContact C-N 3.34Å; Y130-A132 PolarHBondContact O-N 3.34Å; Y130-K133 WeakPolarHBondContact O-CB 3.38Å; Y130-K133 PolarHBondContact O-N 3.42Å; Y130-K133 VanDerWaalsContact O-N 3.14Å; Y130-E134 HydrophobicContact CD1-CG 4.33Å; Y130-E134 HydrophobicContact CE1-CG 3.86Å; Y130-E134 HydrophobicContact CE2-CG 4.04Å; Y130-E134 WeakPolarHBondContact O-CG 3.31Å; Y130-E134 PolarHBondContact O-N 3.45Å; Y130-E134 PolarHBondContact OH-OE1 2.99Å
131	Y	77.7	Confident	80.2	Confident	22 Å²	22	85.7 Å²	85.7	9%	0.086	44%	0.444	C	S	.	.	H	α-helix	trans	-65.8	-33.7	179.1	-75.7	-66.2	0	0	0	113.7	I26 R29 V30 F33 I127 R128 K133 E134 L135	I26-Y131 HydrophobicContact CG1-CE1 4.29Å; I26-Y131 HydrophobicContact CG2-CD1 3.87Å; I26-Y131 HydrophobicContact CG2-CE1 4.06Å; R29-Y131 VanDerWaalsContact CB-OH 3.31Å; R29-Y131 WeakPolarHBondContact CB-OH 3.44Å; R29-Y131 WeakPolarHBondContact CD-OH 3.3Å; R29-Y131 PolarHBondContact NE-OH 2.95Å; V30-Y131 HydrophobicContact CG2-CD1 4.48Å; V30-Y131 HydrophobicContact CG2-CG 4.39Å; F33-Y131 AromaticContact CD2-CE2 3.68Å; F33-Y131 HydrophobicContact CD2-CE2 3.68Å; F33-Y131 AromaticContact CE2-CE2 3.56Å; F33-Y131 HydrophobicContact CE2-CE2 3.56Å; I127-Y131 HydrophobicContact CG2-CD2 3.76Å; I127-Y131 HydrophobicContact CG2-CE2 3.66Å; I127-Y131 VanDerWaalsContact O-CD2 3.3Å; I127-Y131 WeakPolarHBondContact O-CD2 3.37Å; I127-Y131 PolarHBondContact O-N 2.81Å; R128-Y131 PolarHBondContact O-N 2.89Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.14Å; Y131-E134 PolarHBondContact O-N 3.15Å; Y131-L135 WeakPolarHBondContact O-CB 3.19Å; Y131-L135 PolarHBondContact O-N 3.2Å
132	A	79.1	Confident	80.7	Confident	58 Å²	58	84.7 Å²	84.7	48%	0.479	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-38.4	174.2	0	0	0	0	0	111.8	R128 Y130 G136	R128-A132 VanDerWaalsContact O-CB 3.31Å; R128-A132 WeakPolarHBondContact O-CB 3.26Å; R128-A132 PolarHBondContact O-N 3.06Å; Y130-A132 VanDerWaalsContact C-N 3.34Å; Y130-A132 PolarHBondContact O-N 3.34Å; A132-G136 PolarHBondContact O-N 2.96Å
133	K	82.2	Confident	81.1	Confident	154 Å²	154	78.6 Å²	78.6	67%	0.67	41%	0.409	S	S	*	.	H	α-helix	trans	-68.3	-48.5	174.6	-72.8	177	179.8	-174.4	0	111.8	N129 Y130 Y131 L135 G136 C137	N129-K133 WeakPolarHBondContact O-CG 3.48Å; N129-K133 PolarHBondContact O-N 2.9Å; N129-K133 VanDerWaalsContact O-N 3.11Å; Y130-K133 WeakPolarHBondContact O-CB 3.38Å; Y130-K133 PolarHBondContact O-N 3.42Å; Y130-K133 VanDerWaalsContact O-N 3.14Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.14Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 3.13Å; K133-G136 PolarHBondContact O-N 3.44Å; K133-G136 VanDerWaalsContact O-N 3.15Å; K133-C137 PolarHBondContact O-N 3.11Å; K133-C137 PolarHBondContact O-SG 2.76Å; K133-C137 VanDerWaalsContact O-SG 3.34Å
134	E	81.8	Confident	81.6	Confident	72 Å²	72	75.1 Å²	75.1	34%	0.336	39%	0.39	S	S	.	.	H	α-helix	trans	-58	-46.1	177.2	-69.6	-61.5	148.8	0	0	111.5	Y130 Y131 G136 C137 L138	Y130-E134 HydrophobicContact CD1-CG 4.33Å; Y130-E134 HydrophobicContact CE1-CG 3.86Å; Y130-E134 HydrophobicContact CE2-CG 4.04Å; Y130-E134 WeakPolarHBondContact O-CG 3.31Å; Y130-E134 PolarHBondContact O-N 3.45Å; Y130-E134 PolarHBondContact OH-OE1 2.99Å; Y131-E134 PolarHBondContact O-N 3.15Å; E134-G136 VanDerWaalsContact C-N 3.35Å; E134-G136 PolarHBondContact O-N 3.23Å; E134-C137 WeakPolarHBondContact O-CB 3.27Å; E134-C137 PolarHBondContact O-N 2.96Å; E134-L138 WeakPolarHBondContact O-CG 3.5Å; E134-L138 PolarHBondContact O-N 3.23Å
135	L	79.1	Confident	82.2	Confident	105 Å²	105	77.6 Å²	77.6	55%	0.55	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-41.8	175.7	-173.9	66	0	0	0	111.4	Y131 K133 C137 L138 V139	Y131-L135 WeakPolarHBondContact O-CB 3.19Å; Y131-L135 PolarHBondContact O-N 3.2Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 3.13Å; L135-C137 VanDerWaalsContact C-N 3.34Å; L135-C137 PolarHBondContact O-N 2.78Å; L135-L138 PolarHBondContact O-N 2.91Å; L135-V139 HydrophobicContact CG-CG2 4.5Å; L135-V139 VanDerWaalsContact O-CG2 3.27Å; L135-V139 WeakPolarHBondContact O-CG2 3.43Å; L135-V139 PolarHBondContact O-N 3.36Å
136	G	79.1	Confident	82.8	Confident	39 Å²	39	79.9 Å²	79.9	40%	0.402	41%	0.407	S	S	.	.	H	α-helix	trans	-59	-43.4	174.6	0	0	0	0	0	112.8	A132 K133 E134 V139 A140	A132-G136 PolarHBondContact O-N 2.96Å; K133-G136 PolarHBondContact O-N 3.44Å; K133-G136 VanDerWaalsContact O-N 3.15Å; E134-G136 VanDerWaalsContact C-N 3.35Å; E134-G136 PolarHBondContact O-N 3.23Å; G136-V139 PolarHBondContact O-N 2.75Å; G136-A140 WeakPolarHBondContact O-CB 3.5Å; G136-A140 PolarHBondContact O-N 2.87Å
137	C	80.8	Confident	83.1	Confident	68 Å²	68	73 Å²	73	46%	0.459	39%	0.389	S	S	.	.	H	α-helix	trans	-61.4	-47.2	173.8	-68	0	0	0	0	111.5	K133 E134 L135 V139 A140 M141	K133-C137 PolarHBondContact O-N 3.11Å; K133-C137 PolarHBondContact O-SG 2.76Å; K133-C137 VanDerWaalsContact O-SG 3.34Å; E134-C137 WeakPolarHBondContact O-CB 3.27Å; E134-C137 PolarHBondContact O-N 2.96Å; L135-C137 VanDerWaalsContact C-N 3.34Å; L135-C137 PolarHBondContact O-N 2.78Å; C137-V139 PolarHBondContact O-N 2.85Å; C137-A140 PolarHBondContact O-N 2.79Å; C137-M141 HydrophobicContact CB-CE 4.38Å; C137-M141 WeakPolarHBondContact O-CB 3.49Å; C137-M141 VanDerWaalsContact O-CG 3.29Å; C137-M141 WeakPolarHBondContact O-CG 3.47Å; C137-M141 PolarHBondContact O-N 2.98Å
138	L	79.5	Confident	83.5	Confident	29 Å²	29	77.6 Å²	77.6	15%	0.152	41%	0.412	C	S	.	.	H	α-helix	trans	-60.6	-44.9	178.2	-73	170.5	0	0	0	112.2	V19 I26 E134 L135 A140 M141 L142	V19-L138 HydrophobicContact CG1-CD2 4.47Å; I26-L138 HydrophobicContact CD1-CD1 3.83Å; E134-L138 WeakPolarHBondContact O-CG 3.5Å; E134-L138 PolarHBondContact O-N 3.23Å; L135-L138 PolarHBondContact O-N 2.91Å; L138-A140 VanDerWaalsContact C-N 3.33Å; L138-A140 PolarHBondContact O-N 3.45Å; L138-M141 HydrophobicContact CD2-CE 3.9Å; L138-M141 HydrophobicContact CG-CE 4.45Å; L138-M141 PolarHBondContact O-N 2.94Å; L138-L142 WeakPolarHBondContact O-CB 3.35Å; L138-L142 WeakPolarHBondContact O-CG 3.41Å; L138-L142 PolarHBondContact O-N 3.33Å
139	V	82.8	Confident	83.8	Confident	44 Å²	44	69.7 Å²	69.7	27%	0.267	39%	0.392	S	S	.	.	H	α-helix	trans	-60	-44.4	176.3	171.2	0	0	0	0	110.7	L135 G136 C137 G143 L144 H145	L135-V139 HydrophobicContact CG-CG2 4.5Å; L135-V139 VanDerWaalsContact O-CG2 3.27Å; L135-V139 WeakPolarHBondContact O-CG2 3.43Å; L135-V139 PolarHBondContact O-N 3.36Å; G136-V139 PolarHBondContact O-N 2.75Å; C137-V139 PolarHBondContact O-N 2.85Å; V139-G143 WeakPolarHBondContact O-CA 3.46Å; V139-G143 PolarHBondContact O-N 2.76Å; V139-L144 PolarHBondContact O-N 3.39Å; V139-H145 HydrophobicContact CG1-CB 4.26Å
140	A	81.9	Confident	83.9	Confident	60 Å²	60	70.3 Å²	70.3	50%	0.496	40%	0.401	S	S	.	.	H	α-helix	trans	-67.1	-40.9	179.4	0	0	0	0	0	112.9	G136 C137 L138 R164	G136-A140 WeakPolarHBondContact O-CB 3.5Å; G136-A140 PolarHBondContact O-N 2.87Å; C137-A140 PolarHBondContact O-N 2.79Å; L138-A140 VanDerWaalsContact C-N 3.33Å; L138-A140 PolarHBondContact O-N 3.45Å; A140-R164 PolarHBondContact O-NH1 2.84Å
141	M	83.1	Confident	83.8	Confident	127 Å²	127	66.3 Å²	66.3	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-68.4	-48.8	178.7	-74	-172.6	-63.3	0	0	111.7	C137 L138	C137-M141 HydrophobicContact CB-CE 4.38Å; C137-M141 WeakPolarHBondContact O-CB 3.49Å; C137-M141 VanDerWaalsContact O-CG 3.29Å; C137-M141 WeakPolarHBondContact O-CG 3.47Å; C137-M141 PolarHBondContact O-N 2.98Å; L138-M141 HydrophobicContact CD2-CE 3.9Å; L138-M141 HydrophobicContact CG-CE 4.45Å; L138-M141 PolarHBondContact O-N 2.94Å
142	L	86.8	Confident	83.7	Confident	73 Å²	73	72.7 Å²	72.7	38%	0.382	42%	0.424	S	S	.	.	H	α-helix	trans	-82.3	-19.8	-174.9	-62.8	173.9	0	0	0	112.9	V19 L138 L144 R218	V19-L142 HydrophobicContact CG1-CD1 4Å; V19-L142 HydrophobicContact CG1-CD2 4.33Å; L138-L142 WeakPolarHBondContact O-CB 3.35Å; L138-L142 WeakPolarHBondContact O-CG 3.41Å; L138-L142 PolarHBondContact O-N 3.33Å; L142-L144 HydrophobicContact CB-CB 4.05Å; L142-L144 PolarHBondContact O-N 3.5Å; L142-R218 PolarHBondContact O-NH1 3.07Å; L142-R218 PolarHBondContact O-NH2 3.3Å
143	G	89.8	Confident	83.4	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.01	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	41.5	-166.9	0	0	0	0	0	110.7	V139 F162 T163	V139-G143 WeakPolarHBondContact O-CA 3.46Å; V139-G143 PolarHBondContact O-N 2.76Å; G143-F162 CarbonylContact O-C 3.55Å; G143-F162 WeakPolarHBondContact O-CA 3.35Å; G143-T163 VanDerWaalsContact CA-OG1 3.29Å; G143-T163 WeakPolarHBondContact CA-OG1 3.33Å; G143-T163 PolarHBondContact O-N 3.14Å; G143-T163 PolarHBondContact O-OG1 3.46Å
144	L	92.1	Very high	83.1	Confident	26 Å²	26	69.9 Å²	69.9	14%	0.136	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.1	-180	175.8	62.1	0	0	0	108.8	V139 L142 V146 T161 F162 L214	V139-L144 PolarHBondContact O-N 3.39Å; L142-L144 HydrophobicContact CB-CB 4.05Å; L142-L144 PolarHBondContact O-N 3.5Å; L144-V146 HydrophobicContact CD2-CG2 4.45Å; L144-V146 HydrophobicContact CG-CG2 4.2Å; L144-T161 WeakPolarHBondContact CA-O 3.37Å; L144-F162 HydrophobicContact CD1-CD1 3.89Å; L144-F162 HydrophobicContact CD1-CD2 4.22Å; L144-F162 HydrophobicContact CD1-CE1 3.75Å; L144-F162 HydrophobicContact CD1-CE2 4.08Å; L144-F162 HydrophobicContact CD1-CG 4.13Å; L144-F162 HydrophobicContact CD1-CZ 3.84Å; L144-L214 HydrophobicContact CD2-CD1 4.19Å; L144-L214 HydrophobicContact CD2-CD2 4.34Å
145	H	90.8	Very high	83.1	Confident	91 Å²	91	68.7 Å²	68.7	42%	0.421	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131	173.4	175.2	-84.8	0	0	0	109.7	V139 T161	V139-H145 HydrophobicContact CG1-CB 4.26Å; H145-T161 PolarHBondContact N-O 3.49Å; H145-T161 PolarHBondContact O-N 3.38Å
146	V	90.2	Very high	83.3	Confident	76 Å²	76	65.6 Å²	65.6	46%	0.461	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.7	179.3	-174.9	0	0	0	0	108.7	L144 I158 T159 L160	L144-V146 HydrophobicContact CD2-CG2 4.45Å; L144-V146 HydrophobicContact CG-CG2 4.2Å; V146-I158 HydrophobicContact CG1-CG2 4.03Å; V146-T159 CarbonylContact C-O 3.6Å; V146-T159 WeakPolarHBondContact CA-O 3.33Å; V146-L160 HydrophobicContact CB-CD2 4.36Å; V146-L160 HydrophobicContact CG1-CD2 4.01Å; V146-L160 HydrophobicContact CG2-CD2 3.78Å
147	A	88.4	Confident	83.9	Confident	37 Å²	37	63.7 Å²	63.7	31%	0.306	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.4	172.8	0	0	0	0	0	110.4	I158 T159	A147-I158 CarbonylContact O-C 3.6Å; A147-I158 WeakPolarHBondContact O-CA 3.32Å; A147-T159 PolarHBondContact N-O 3.46Å; A147-T159 PolarHBondContact O-N 3.26Å
148	I	87.3	Confident	84.5	Confident	136 Å²	136	61.6 Å²	61.6	70%	0.697	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	125.7	175.6	-56.5	174.8	0	0	0	107.6	C157	I148-C157 WeakPolarHBondContact CA-O 3.16Å
149	G	83.7	Confident	85.2	Confident	28 Å²	28	61 Å²	61	29%	0.289	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	173.1	-178.3	0	0	0	0	0	112.5	C157	G149-C157 PolarHBondContact N-O 2.95Å; G149-C157 WeakPolarHBondContact O-CA 3.49Å; G149-C157 VanDerWaalsContact O-CB 3.22Å; G149-C157 WeakPolarHBondContact O-CB 3.3Å; G149-C157 PolarHBondContact O-N 3.47Å
150	P	83.3	Confident	85.9	Confident	112 Å²	112	59.1 Å²	59.1	73%	0.727	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	143.2	172.3	29.9	-33.1	0	0	0	110.8	A154	P150-A154 VanDerWaalsContact CA-O 3.23Å; P150-A154 WeakPolarHBondContact CA-O 3.34Å
151	V	80.9	Confident	86.5	Confident	35 Å²	35	57.7 Å²	57.7	21%	0.212	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.5	171.2	179.3	0	0	0	0	107.3	S153 A154 C157 I177	V151-S153 VanDerWaalsContact C-N 3.32Å; V151-S153 PolarHBondContact O-N 2.9Å; V151-S153 VanDerWaalsContact O-N 3.17Å; V151-A154 PolarHBondContact N-O 3.46Å; V151-A154 VanDerWaalsContact O-CB 3.31Å; V151-A154 WeakPolarHBondContact O-CB 3.49Å; V151-A154 PolarHBondContact O-N 3.48Å; V151-C157 HydrophobicContact CB-CB 4.21Å; V151-C157 HydrophobicContact CG2-CB 3.83Å; V151-I177 HydrophobicContact CG1-CD1 4.19Å; V151-I177 HydrophobicContact CG2-CG2 4.29Å
152	D	74.1	Confident	87	Confident	156 Å²	156	51.8 Å²	51.8	83%	0.834	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	48.5	174.5	-54.9	-30.7	0	0	0	114.5	A154	D152-A154 VanDerWaalsContact C-N 3.26Å; D152-A154 PolarHBondContact O-N 3.38Å
153	S	74.6	Confident	87.3	Confident	133 Å²	133	50.4 Å²	50.4	93%	0.93	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-9.6	-176.7	-37.3	0	0	0	0	116.3	V151 G155	V151-S153 VanDerWaalsContact C-N 3.32Å; V151-S153 PolarHBondContact O-N 2.9Å; V151-S153 VanDerWaalsContact O-N 3.17Å; S153-G155 PolarHBondContact O-N 3.48Å
154	A	74.3	Confident	87.3	Confident	20 Å²	20	57.8 Å²	57.8	17%	0.165	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	117.5	174.1	0	0	0	0	0	110.9	P150 V151 D152 C157 L188	P150-A154 VanDerWaalsContact CA-O 3.23Å; P150-A154 WeakPolarHBondContact CA-O 3.34Å; V151-A154 PolarHBondContact N-O 3.46Å; V151-A154 VanDerWaalsContact O-CB 3.31Å; V151-A154 WeakPolarHBondContact O-CB 3.49Å; V151-A154 PolarHBondContact O-N 3.48Å; D152-A154 VanDerWaalsContact C-N 3.26Å; D152-A154 PolarHBondContact O-N 3.38Å; A154-C157 VanDerWaalsContact CB-SG 3.57Å; A154-C157 PolarHBondContact O-SG 2.9Å; A154-L188 HydrophobicContact CB-CD1 4.15Å
155	G	81.8	Confident	87.3	Confident	47 Å²	47	57 Å²	57	49%	0.485	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	157.5	168.9	0	0	0	0	0	112.2	S153 C157 Q179	S153-G155 PolarHBondContact O-N 3.48Å; G155-C157 PolarHBondContact O-N 3.26Å; G155-Q179 PolarHBondContact O-NE2 2.84Å
156	G	84.1	Confident	87.2	Confident	39 Å²	39	53.7 Å²	53.7	40%	0.402	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69.4	30.8	173.6	0	0	0	0	0	114.7	K180	G156-K180 PolarHBondContact O-N 3.45Å
157	C	91.7	Very high	87	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	139.6	177.9	-57.3	0	0	0	0	111.5	I148 G149 V151 A154 G155 I177 I178 L188	I148-C157 WeakPolarHBondContact CA-O 3.16Å; G149-C157 PolarHBondContact N-O 2.95Å; G149-C157 WeakPolarHBondContact O-CA 3.49Å; G149-C157 VanDerWaalsContact O-CB 3.22Å; G149-C157 WeakPolarHBondContact O-CB 3.3Å; G149-C157 PolarHBondContact O-N 3.47Å; V151-C157 HydrophobicContact CB-CB 4.21Å; V151-C157 HydrophobicContact CG2-CB 3.83Å; A154-C157 VanDerWaalsContact CB-SG 3.57Å; A154-C157 PolarHBondContact O-SG 2.9Å; G155-C157 PolarHBondContact O-N 3.26Å; C157-I177 HydrophobicContact CB-CG2 4.19Å; C157-I178 CarbonylContact C-O 3.55Å; C157-I178 WeakPolarHBondContact CA-O 3.29Å; C157-L188 VanDerWaalsContact SG-CD1 3.6Å
158	I	94	Very high	87	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	111.6	175.4	-54.5	171.1	0	0	0	106.6	V146 A147 L160 I177 I178 W210	V146-I158 HydrophobicContact CG1-CG2 4.03Å; A147-I158 CarbonylContact O-C 3.6Å; A147-I158 WeakPolarHBondContact O-CA 3.32Å; I158-L160 HydrophobicContact CG2-CD2 3.96Å; I158-L160 HydrophobicContact CG2-CG 4.25Å; I158-I177 WeakPolarHBondContact O-CA 3.45Å; I158-I178 PolarHBondContact N-O 3.27Å; I158-I178 PolarHBondContact O-N 2.73Å; I158-W210 HydrophobicContact CD1-CH2 3.89Å; I158-W210 HydrophobicContact CD1-CZ2 3.87Å
159	T	94.4	Very high	87	Confident	18 Å²	18	56.6 Å²	56.6	11%	0.11	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.2	171.4	-70.5	0	0	0	0	109.3	V146 A147 K175 L176	V146-T159 CarbonylContact C-O 3.6Å; V146-T159 WeakPolarHBondContact CA-O 3.33Å; A147-T159 PolarHBondContact N-O 3.46Å; A147-T159 PolarHBondContact O-N 3.26Å; T159-K175 HydrophobicContact CG2-CD 4.09Å; T159-K175 VanDerWaalsContact CG2-CE 3.42Å; T159-K175 HydrophobicContact CG2-CG 4.15Å; T159-L176 WeakPolarHBondContact CA-O 3.44Å
160	L	95.6	Very high	87	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.3	174.1	-56.9	172.5	0	0	0	108.6	V146 I158 F162 K175 L176 I178 W210 F213 L214	V146-L160 HydrophobicContact CB-CD2 4.36Å; V146-L160 HydrophobicContact CG1-CD2 4.01Å; V146-L160 HydrophobicContact CG2-CD2 3.78Å; I158-L160 HydrophobicContact CG2-CD2 3.96Å; I158-L160 HydrophobicContact CG2-CG 4.25Å; L160-F162 HydrophobicContact CB-CD2 4.49Å; L160-F162 HydrophobicContact CB-CE2 3.82Å; L160-K175 CarbonylContact O-C 3.58Å; L160-K175 VanDerWaalsContact O-CA 3.26Å; L160-K175 WeakPolarHBondContact O-CA 3.33Å; L160-L176 HydrophobicContact CB-CB 4.34Å; L160-L176 HydrophobicContact CD1-CD2 4.26Å; L160-L176 PolarHBondContact N-O 3.42Å; L160-L176 PolarHBondContact O-N 3.31Å; L160-I178 HydrophobicContact CD1-CD1 4.28Å; L160-W210 HydrophobicContact CD1-CZ3 4.25Å; L160-F213 HydrophobicContact CD1-CE1 4.02Å; L160-L214 HydrophobicContact CD1-CD2 3.65Å; L160-L214 HydrophobicContact CD2-CD2 4.12Å; L160-L214 HydrophobicContact CG-CD2 4.46Å
161	T	95	Very high	87.1	Confident	30 Å²	30	60.4 Å²	60.4	18%	0.184	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.9	176.5	-55	0	0	0	0	109.1	L144 H145 T163 A173 C174	L144-T161 WeakPolarHBondContact CA-O 3.37Å; H145-T161 PolarHBondContact N-O 3.49Å; H145-T161 PolarHBondContact O-N 3.38Å; T161-T163 HydrophobicContact CG2-CG2 4.39Å; T161-A173 HydrophobicContact CG2-CB 3.92Å; T161-C174 CarbonylContact C-O 3.53Å; T161-C174 WeakPolarHBondContact CA-O 3.11Å
162	F	95.2	Very high	87.5	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.009	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.1	176.7	-63	-99.2	0	0	0	109.8	G143 L144 L160 L165 A173 C174 L214 V217 R218 F221	G143-F162 CarbonylContact O-C 3.55Å; G143-F162 WeakPolarHBondContact O-CA 3.35Å; L144-F162 HydrophobicContact CD1-CD1 3.89Å; L144-F162 HydrophobicContact CD1-CD2 4.22Å; L144-F162 HydrophobicContact CD1-CE1 3.75Å; L144-F162 HydrophobicContact CD1-CE2 4.08Å; L144-F162 HydrophobicContact CD1-CG 4.13Å; L144-F162 HydrophobicContact CD1-CZ 3.84Å; L160-F162 HydrophobicContact CB-CD2 4.49Å; L160-F162 HydrophobicContact CB-CE2 3.82Å; F162-L165 HydrophobicContact CB-CD1 3.91Å; F162-L165 HydrophobicContact CB-CD2 4.07Å; F162-L165 HydrophobicContact CB-CG 4.23Å; F162-A173 CarbonylContact O-C 3.57Å; F162-A173 WeakPolarHBondContact O-CA 3.42Å; F162-C174 PolarHBondContact N-O 3.19Å; F162-C174 PolarHBondContact O-N 3.03Å; F162-L214 HydrophobicContact CE1-CD2 4.5Å; F162-L214 HydrophobicContact CZ-CD2 3.8Å; F162-V217 HydrophobicContact CD2-CG1 4.32Å; F162-V217 HydrophobicContact CE1-CG1 4.41Å; F162-V217 HydrophobicContact CE2-CG1 3.57Å; F162-V217 HydrophobicContact CZ-CB 4.2Å; F162-V217 HydrophobicContact CZ-CG1 3.62Å; F162-R218 HydrophobicContact CD1-CB 4.1Å; F162-R218 HydrophobicContact CD1-CG 4.23Å; F162-R218 HydrophobicContact CE1-CB 4.02Å; F162-F221 HydrophobicContact CB-CD2 4.43Å; F162-F221 AromaticContact CD2-CD2 3.99Å; F162-F221 HydrophobicContact CD2-CD2 3.99Å; F162-F221 AromaticContact CD2-CE2 3.83Å; F162-F221 HydrophobicContact CD2-CE2 3.83Å; F162-F221 HydrophobicContact CE2-CE2 4.2Å; F162-F221 HydrophobicContact CG-CD2 4.24Å
163	T	92.9	Very high	88.4	Confident	45 Å²	45	56.6 Å²	56.6	28%	0.276	35%	0.348	S	S	.	.			trans	-130.9	174	176.2	62.6	0	0	0	0	109.5	G143 T161 L165 A173 R218	G143-T163 VanDerWaalsContact CA-OG1 3.29Å; G143-T163 WeakPolarHBondContact CA-OG1 3.33Å; G143-T163 PolarHBondContact O-N 3.14Å; G143-T163 PolarHBondContact O-OG1 3.46Å; T161-T163 HydrophobicContact CG2-CG2 4.39Å; T163-L165 PolarHBondContact O-N 2.91Å; T163-A173 HydrophobicContact CG2-CB 4.09Å; T163-R218 PolarHBondContact O-NH2 3.28Å; T163-R218 VanDerWaalsContact O-NH2 3.14Å
164	R	88.9	Confident	89.5	Confident	155 Å²	155	50.2 Å²	50.2	59%	0.585	30%	0.304	S	S	*	.			trans	53.9	42.8	-179.2	-51	-179.5	70.7	-165.7	-0.7	111.6	A140 R218	A140-R164 PolarHBondContact O-NH1 2.84Å; R164-R218 PolarHBondContact O-NH2 3.43Å; R164-R218 VanDerWaalsContact O-NH2 3.14Å
165	L	91.5	Very high	90.5	Very high	10 Å²	10	52.9 Å²	52.9	5%	0.052	31%	0.311	C	S	.	.			trans	-85	-36.6	-178	-70.3	165.7	0	0	0	111.8	F162 T163 C174 R218 F221 Q222 L225	F162-L165 HydrophobicContact CB-CD1 3.91Å; F162-L165 HydrophobicContact CB-CD2 4.07Å; F162-L165 HydrophobicContact CB-CG 4.23Å; T163-L165 PolarHBondContact O-N 2.91Å; L165-C174 HydrophobicContact CD1-CB 3.72Å; L165-C174 WeakPolarHBondContact CD1-SG 3.38Å; L165-R218 HydrophobicContact CD2-CG 3.66Å; L165-F221 HydrophobicContact CD1-CB 3.78Å; L165-F221 HydrophobicContact CD2-CB 4.2Å; L165-Q222 HydrophobicContact CB-CG 4.19Å; L165-Q222 HydrophobicContact CD2-CG 3.74Å; L165-Q222 WeakPolarHBondContact O-CG 3.47Å; L165-Q222 PolarHBondContact O-NE2 3.1Å; L165-L225 HydrophobicContact CB-CD1 3.65Å; L165-L225 HydrophobicContact CD1-CD1 3.86Å; L165-L225 HydrophobicContact CG-CD1 4.44Å
166	N	88.3	Confident	91.2	Very high	22 Å²	22	50.6 Å²	50.6	12%	0.118	29%	0.288	C	S	.	.	S	Bend	trans	-129.1	132	174.8	179.2	-20.5	0	0	0	108.3	D168 I169 P170 L225	N166-D168 VanDerWaalsContact C-N 3.25Å; N166-D168 PolarHBondContact O-N 3.26Å; N166-D168 WeakPolarHBondContact OD1-CB 3.39Å; N166-D168 PolarHBondContact OD1-N 3.02Å; N166-I169 HydrophobicContact CB-CD1 4.34Å; N166-I169 HydrophobicContact CB-CG1 3.74Å; N166-I169 CarbonylContact O-C 3.36Å; N166-I169 PolarHBondContact O-N 2.87Å; N166-P170 WeakPolarHBondContact O-CA 3.42Å; N166-L225 HydrophobicContact CB-CB 4.21Å; N166-L225 PolarHBondContact ND2-O 2.96Å
167	S	86.7	Confident	91.7	Very high	105 Å²	105	49 Å²	49	73%	0.734	27%	0.27	S	S	*	.	S	Bend	trans	-64.6	-27.8	-179.2	48.1	0	0	0	0	113.6	I169	S167-I169 VanDerWaalsContact C-N 3.35Å
168	D	88.1	Confident	91.9	Very high	133 Å²	133	49 Å²	49	71%	0.711	27%	0.27	S	S	*	.	S	Bend	trans	-79.7	-23.8	-176.5	-56.9	-22.9	0	0	0	111.6	N166	N166-D168 VanDerWaalsContact C-N 3.25Å; N166-D168 PolarHBondContact O-N 3.26Å; N166-D168 WeakPolarHBondContact OD1-CB 3.39Å; N166-D168 PolarHBondContact OD1-N 3.02Å
169	I	87.5	Confident	91.9	Very high	72 Å²	72	50 Å²	50	37%	0.369	27%	0.274	S	S	.	.	S	Bend	trans	-133.1	60.9	-180	53.4	178.1	0	0	0	111.1	N166 S167 N171 V172 L225	N166-I169 HydrophobicContact CB-CD1 4.34Å; N166-I169 HydrophobicContact CB-CG1 3.74Å; N166-I169 CarbonylContact O-C 3.36Å; N166-I169 PolarHBondContact O-N 2.87Å; S167-I169 VanDerWaalsContact C-N 3.35Å; I169-N171 PolarHBondContact O-N 3.03Å; I169-V172 HydrophobicContact CB-CG2 3.97Å; I169-V172 HydrophobicContact CD1-CG2 4.1Å; I169-V172 HydrophobicContact CG1-CG2 4.25Å; I169-V172 PolarHBondContact O-N 3.42Å; I169-V172 VanDerWaalsContact O-N 3.14Å; I169-L225 HydrophobicContact CD1-CB 4.41Å; I169-L225 HydrophobicContact CD1-CD2 4.15Å
170	P	83.5	Confident	91.7	Very high	61 Å²	61	55.1 Å²	55.1	40%	0.396	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.3	-167.1	26.7	-35.8	0	0	0	114.1	N166	N166-P170 WeakPolarHBondContact O-CA 3.42Å
171	N	85.5	Confident	91.2	Very high	158 Å²	158	56.8 Å²	56.8	85%	0.845	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.5	-176.2	-62.4	-30.5	0	0	0	113.8	I169 A173	I169-N171 PolarHBondContact O-N 3.03Å; N171-A173 PolarHBondContact O-N 2.98Å
172	V	90.6	Very high	90.7	Very high	56 Å²	56	60.6 Å²	60.6	34%	0.339	33%	0.333	S	S	.	.			trans	-74.3	128.7	177.2	175.1	0	0	0	0	109.8	I169 L225	I169-V172 HydrophobicContact CB-CG2 3.97Å; I169-V172 HydrophobicContact CD1-CG2 4.1Å; I169-V172 HydrophobicContact CG1-CG2 4.25Å; I169-V172 PolarHBondContact O-N 3.42Å; I169-V172 VanDerWaalsContact O-N 3.14Å; V172-L225 HydrophobicContact CG1-CD1 4.09Å; V172-L225 HydrophobicContact CG1-CD2 3.95Å
173	A	93.3	Very high	90.3	Very high	55 Å²	55	66.1 Å²	66.1	46%	0.455	36%	0.363	S	S	.	.			trans	-108.5	129.6	177.5	0	0	0	0	0	110.4	T161 F162 T163 N171	T161-A173 HydrophobicContact CG2-CB 3.92Å; F162-A173 CarbonylContact O-C 3.57Å; F162-A173 WeakPolarHBondContact O-CA 3.42Å; T163-A173 HydrophobicContact CG2-CB 4.09Å; N171-A173 PolarHBondContact O-N 2.98Å
174	C	95.8	Very high	90.3	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.5	169.8	-59.9	0	0	0	0	109.2	T161 F162 L165 Q191 P192 F221	T161-C174 CarbonylContact C-O 3.53Å; T161-C174 WeakPolarHBondContact CA-O 3.11Å; F162-C174 PolarHBondContact N-O 3.19Å; F162-C174 PolarHBondContact O-N 3.03Å; L165-C174 HydrophobicContact CD1-CB 3.72Å; L165-C174 WeakPolarHBondContact CD1-SG 3.38Å; C174-Q191 CarbonylContact C-O 3.6Å; C174-Q191 WeakPolarHBondContact CA-O 3.26Å; C174-P192 VanDerWaalsContact SG-CD 3.57Å; C174-F221 HydrophobicContact CB-CB 4.07Å; C174-F221 HydrophobicContact CB-CD1 3.54Å; C174-F221 HydrophobicContact CB-CD2 3.58Å; C174-F221 HydrophobicContact CB-CE1 3.73Å; C174-F221 HydrophobicContact CB-CE2 3.74Å; C174-F221 HydrophobicContact CB-CG 3.48Å; C174-F221 VanDerWaalsContact CB-CG 3.48Å; C174-F221 HydrophobicContact CB-CZ 3.82Å
175	K	96.1	Very high	90.5	Very high	75 Å²	75	59.9 Å²	59.9	33%	0.326	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.6	-170.8	-178.2	175	166.3	178	0	111.4	T159 L160 M190 Q191	T159-K175 HydrophobicContact CG2-CD 4.09Å; T159-K175 VanDerWaalsContact CG2-CE 3.42Å; T159-K175 HydrophobicContact CG2-CG 4.15Å; L160-K175 CarbonylContact O-C 3.58Å; L160-K175 VanDerWaalsContact O-CA 3.26Å; L160-K175 WeakPolarHBondContact O-CA 3.33Å; K175-M190 CarbonylContact O-C 3.5Å; K175-M190 WeakPolarHBondContact O-CA 3.37Å; K175-Q191 PolarHBondContact N-O 3.41Å; K175-Q191 PolarHBondContact O-N 3.37Å
176	L	96.1	Very high	90.6	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.8	171.7	-165.5	80.5	0	0	0	109.3	T159 L160 I178 L187 M190 I197 F213	T159-L176 WeakPolarHBondContact CA-O 3.44Å; L160-L176 HydrophobicContact CB-CB 4.34Å; L160-L176 HydrophobicContact CD1-CD2 4.26Å; L160-L176 PolarHBondContact N-O 3.42Å; L160-L176 PolarHBondContact O-N 3.31Å; L176-I178 HydrophobicContact CD2-CD1 3.67Å; L176-I178 HydrophobicContact CD2-CG1 3.79Å; L176-I178 HydrophobicContact CG-CG1 4.21Å; L176-L187 HydrophobicContact CD1-CD1 3.24Å; L176-L187 HydrophobicContact CD1-CD2 4.38Å; L176-L187 HydrophobicContact CD1-CG 4.45Å; L176-L187 HydrophobicContact CD2-CD1 4.31Å; L176-L187 HydrophobicContact CG-CD1 3.64Å; L176-M190 HydrophobicContact CD1-CB 3.76Å; L176-M190 HydrophobicContact CD1-CG 3.66Å; L176-M190 HydrophobicContact CD1-SD 3.83Å; L176-I197 HydrophobicContact CD1-CG2 3.74Å; L176-I197 HydrophobicContact CD2-CG2 4.32Å; L176-F213 HydrophobicContact CD2-CE1 4.14Å; L176-F213 HydrophobicContact CD2-CZ 3.62Å
177	I	95.3	Very high	90.9	Very high	6 Å²	6	66 Å²	66	3%	0.031	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.8	174.3	-51.6	-176.9	0	0	0	108.6	V151 C157 I158 L188 N189	V151-I177 HydrophobicContact CG1-CD1 4.19Å; V151-I177 HydrophobicContact CG2-CG2 4.29Å; C157-I177 HydrophobicContact CB-CG2 4.19Å; I158-I177 WeakPolarHBondContact O-CA 3.45Å; I177-L188 HydrophobicContact CB-CB 4.31Å; I177-L188 HydrophobicContact CG2-CB 4.15Å; I177-L188 HydrophobicContact CG2-CD1 4.14Å; I177-L188 PolarHBondContact O-N 3.46Å; I177-N189 HydrophobicContact CB-CB 4.17Å; I177-N189 HydrophobicContact CD1-CB 3.98Å; I177-N189 HydrophobicContact CG1-CB 4.13Å; I177-N189 PolarHBondContact N-O 3.24Å; I177-N189 PolarHBondContact O-N 3.08Å
178	I	94.8	Very high	91.3	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.9	178.2	-62	176.4	0	0	0	109	C157 I158 L160 L176 Y185 K186 L204 W210 F213	C157-I178 CarbonylContact C-O 3.55Å; C157-I178 WeakPolarHBondContact CA-O 3.29Å; I158-I178 PolarHBondContact N-O 3.27Å; I158-I178 PolarHBondContact O-N 2.73Å; L160-I178 HydrophobicContact CD1-CD1 4.28Å; L176-I178 HydrophobicContact CD2-CD1 3.67Å; L176-I178 HydrophobicContact CD2-CG1 3.79Å; L176-I178 HydrophobicContact CG-CG1 4.21Å; I178-Y185 HydrophobicContact CG2-CD1 3.99Å; I178-Y185 HydrophobicContact CG2-CG 4.25Å; I178-K186 CarbonylContact C-O 3.49Å; I178-K186 VanDerWaalsContact CA-O 3.31Å; I178-K186 WeakPolarHBondContact CA-O 3.26Å; I178-L204 HydrophobicContact CD1-CD2 4.38Å; I178-W210 HydrophobicContact CD1-CH2 3.94Å; I178-W210 HydrophobicContact CD1-CZ3 4.04Å; I178-F213 HydrophobicContact CD1-CE1 3.67Å; I178-F213 HydrophobicContact CD1-CZ 3.63Å
179	Q	93.8	Very high	91.6	Very high	43 Å²	43	62.3 Å²	62.3	20%	0.201	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.9	167.7	-166.8	-178.4	22.2	0	0	110.3	G155 Y185 K186 L188	G155-Q179 PolarHBondContact O-NE2 2.84Å; Q179-Y185 WeakPolarHBondContact O-CA 3.29Å; Q179-K186 HydrophobicContact CB-CB 4.41Å; Q179-K186 PolarHBondContact N-O 3.42Å; Q179-K186 PolarHBondContact O-N 3.06Å; Q179-L188 HydrophobicContact CB-CD1 3.85Å; Q179-L188 HydrophobicContact CB-CD2 4.05Å; Q179-L188 HydrophobicContact CB-CG 3.87Å
180	K	90.4	Very high	91.9	Very high	126 Å²	126	59.5 Å²	59.5	55%	0.548	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.9	166.9	-176	-179.6	177.1	-175.2	0	109.1	G156 Y185	G156-K180 PolarHBondContact O-N 3.45Å; K180-Y185 HydrophobicContact CB-CD1 4.25Å; K180-Y185 HydrophobicContact CB-CE1 4.16Å; K180-Y185 HydrophobicContact CD-CE1 4.19Å; K180-Y185 HydrophobicContact CG-CD1 4.3Å; K180-Y185 HydrophobicContact CG-CE1 3.86Å
181	T	87	Confident	92.4	Very high	39 Å²	39	62.7 Å²	62.7	24%	0.239	33%	0.334	C	S	.	.			trans	-100.9	-177.5	167.9	64.3	0	0	0	0	109.8	D183 C184 K186	T181-D183 PolarHBondContact O-N 2.86Å; T181-C184 PolarHBondContact N-O 3.34Å; T181-C184 PolarHBondContact OG1-N 3.09Å; T181-C184 VanDerWaalsContact OG1-N 3.15Å; T181-C184 PolarHBondContact OG1-O 3.42Å; T181-C184 PolarHBondContact OG1-SG 3.42Å; T181-K186 HydrophobicContact CG2-CD 4.18Å; T181-K186 HydrophobicContact CG2-CG 4.49Å
182	S	83.7	Confident	92.9	Very high	109 Å²	109	56.7 Å²	56.7	76%	0.762	30%	0.304	S	S	*	.	S	Bend	trans	-52.4	-45	175.9	47.9	0	0	0	0	112
183	D	87	Confident	93.1	Very high	119 Å²	119	61.3 Å²	61.3	64%	0.636	32%	0.316	S	S	*	.	S	Bend	trans	-120.2	-13.9	-165.5	-53.7	-56.2	0	0	0	113.6	T181 R208	T181-D183 PolarHBondContact O-N 2.86Å; D183-R208 PolarHBondContact O-NH2 2.87Å
184	C	92.2	Very high	93.2	Very high	39 Å²	39	59.2 Å²	59.2	26%	0.264	30%	0.298	S	S	.	.			trans	-148	163.7	-175.9	71.3	0	0	0	0	114.3	T181 N205	T181-C184 PolarHBondContact N-O 3.34Å; T181-C184 PolarHBondContact OG1-N 3.09Å; T181-C184 VanDerWaalsContact OG1-N 3.15Å; T181-C184 PolarHBondContact OG1-O 3.42Å; T181-C184 PolarHBondContact OG1-SG 3.42Å; C184-N205 VanDerWaalsContact CA-OD1 3.29Å; C184-N205 WeakPolarHBondContact CA-OD1 3.34Å; C184-N205 WeakPolarHBondContact CB-OD1 3.39Å
185	Y	94	Very high	93.1	Very high	29 Å²	29	65.8 Å²	65.8	11%	0.114	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	122.8	168.5	-61.6	-66.9	0	0	0	108.4	I178 Q179 K180 V201 L204 N205 W210	I178-Y185 HydrophobicContact CG2-CD1 3.99Å; I178-Y185 HydrophobicContact CG2-CG 4.25Å; Q179-Y185 WeakPolarHBondContact O-CA 3.29Å; K180-Y185 HydrophobicContact CB-CD1 4.25Å; K180-Y185 HydrophobicContact CB-CE1 4.16Å; K180-Y185 HydrophobicContact CD-CE1 4.19Å; K180-Y185 HydrophobicContact CG-CD1 4.3Å; K180-Y185 HydrophobicContact CG-CE1 3.86Å; Y185-V201 WeakPolarHBondContact O-CG1 3.41Å; Y185-L204 HydrophobicContact CD2-CD2 3.85Å; Y185-L204 HydrophobicContact CD2-CG 3.75Å; Y185-L204 HydrophobicContact CE2-CD2 4.34Å; Y185-L204 HydrophobicContact CE2-CG 4.1Å; Y185-L204 HydrophobicContact CG-CD2 4.04Å; Y185-L204 HydrophobicContact CG-CG 4.44Å; Y185-N205 WeakPolarHBondContact CD2-OD1 3.5Å; Y185-N205 PolarHBondContact N-OD1 3.1Å; Y185-N205 PolarHBondContact O-ND2 3.32Å; Y185-W210 HydrophobicContact CD1-CH2 4.39Å; Y185-W210 AromaticContact CD1-CZ2 3.8Å; Y185-W210 HydrophobicContact CD1-CZ2 3.8Å; Y185-W210 HydrophobicContact CE1-CH2 4.38Å; Y185-W210 AromaticContact CE1-CZ2 3.41Å; Y185-W210 HydrophobicContact CE1-CZ2 3.41Å; Y185-W210 VanDerWaalsContact CE1-CZ2 3.41Å; Y185-W210 HydrophobicContact CE2-CZ2 4.29Å; Y185-W210 HydrophobicContact CG-CZ2 4.41Å; Y185-W210 AromaticContact CZ-CE2 3.86Å; Y185-W210 AromaticContact CZ-CZ2 3.67Å; Y185-W210 AromaticContact CZ-NE1 3.56Å; Y185-W210 PolarHBondContact OH-NE1 3.43Å; Y185-W210 VanDerWaalsContact OH-NE1 3.13Å
186	K	93.5	Very high	93.1	Very high	110 Å²	110	64.7 Å²	64.7	48%	0.478	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.2	177.2	-64.5	-175.8	-180	-178.8	0	109.8	I178 Q179 T181 L188	I178-K186 CarbonylContact C-O 3.49Å; I178-K186 VanDerWaalsContact CA-O 3.31Å; I178-K186 WeakPolarHBondContact CA-O 3.26Å; Q179-K186 HydrophobicContact CB-CB 4.41Å; Q179-K186 PolarHBondContact N-O 3.42Å; Q179-K186 PolarHBondContact O-N 3.06Å; T181-K186 HydrophobicContact CG2-CD 4.18Å; T181-K186 HydrophobicContact CG2-CG 4.49Å; K186-L188 PolarHBondContact O-N 3.21Å
187	L	94.9	Very high	93.1	Very high	51 Å²	51	64.7 Å²	64.7	27%	0.267	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	116.5	171	-179.1	55.3	0	0	0	109.3	L176 N189 M190 V198 V201	L176-L187 HydrophobicContact CD1-CD1 3.24Å; L176-L187 HydrophobicContact CD1-CD2 4.38Å; L176-L187 HydrophobicContact CD1-CG 4.45Å; L176-L187 HydrophobicContact CD2-CD1 4.31Å; L176-L187 HydrophobicContact CG-CD1 3.64Å; L187-N189 WeakPolarHBondContact CD1-O 3.37Å; L187-M190 HydrophobicContact CD2-CE 4.38Å; L187-V198 HydrophobicContact CD2-CG2 4.11Å; L187-V201 HydrophobicContact CB-CG1 4.45Å; L187-V201 HydrophobicContact CB-CG2 4.23Å
188	L	93.5	Very high	93.1	Very high	78 Å²	78	66.9 Å²	66.9	41%	0.408	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-43	177.3	-63.7	-172.6	0	0	0	112.2	A154 C157 I177 Q179 K186	A154-L188 HydrophobicContact CB-CD1 4.15Å; C157-L188 VanDerWaalsContact SG-CD1 3.6Å; I177-L188 HydrophobicContact CB-CB 4.31Å; I177-L188 HydrophobicContact CG2-CB 4.15Å; I177-L188 HydrophobicContact CG2-CD1 4.14Å; I177-L188 PolarHBondContact O-N 3.46Å; Q179-L188 HydrophobicContact CB-CD1 3.85Å; Q179-L188 HydrophobicContact CB-CD2 4.05Å; Q179-L188 HydrophobicContact CB-CG 3.87Å; K186-L188 PolarHBondContact O-N 3.21Å
189	N	94.2	Very high	93.1	Very high	82 Å²	82	73.3 Å²	73.3	44%	0.439	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	152.1	-176.1	-168.2	11.3	0	0	0	111	I177 L187	I177-N189 HydrophobicContact CB-CB 4.17Å; I177-N189 HydrophobicContact CD1-CB 3.98Å; I177-N189 HydrophobicContact CG1-CB 4.13Å; I177-N189 PolarHBondContact N-O 3.24Å; I177-N189 PolarHBondContact O-N 3.08Å; L187-N189 WeakPolarHBondContact CD1-O 3.37Å
190	M	95.6	Very high	93.2	Very high	13 Å²	13	72 Å²	72	6%	0.064	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	128.1	178.4	-177	170.5	46.5	0	0	109.7	K175 L176 L187 P192 Y193 V194 I197 V198 F221	K175-M190 CarbonylContact O-C 3.5Å; K175-M190 WeakPolarHBondContact O-CA 3.37Å; L176-M190 HydrophobicContact CD1-CB 3.76Å; L176-M190 HydrophobicContact CD1-CG 3.66Å; L176-M190 HydrophobicContact CD1-SD 3.83Å; L187-M190 HydrophobicContact CD2-CE 4.38Å; M190-P192 VanDerWaalsContact CG-O 3.32Å; M190-P192 WeakPolarHBondContact CG-O 3.46Å; M190-Y193 HydrophobicContact CE-CD2 3.4Å; M190-Y193 VanDerWaalsContact CE-CD2 3.4Å; M190-Y193 HydrophobicContact CE-CE2 3.63Å; M190-Y193 HydrophobicContact CE-CG 3.94Å; M190-V194 VanDerWaalsContact CE-O 3.3Å; M190-V194 WeakPolarHBondContact CE-O 3.48Å; M190-V194 HydrophobicContact SD-CB 4.33Å; M190-I197 HydrophobicContact CE-CB 4.33Å; M190-I197 HydrophobicContact SD-CB 3.51Å; M190-I197 VanDerWaalsContact SD-CB 3.51Å; M190-I197 HydrophobicContact SD-CD1 3.65Å; M190-I197 HydrophobicContact SD-CG1 4.08Å; M190-I197 HydrophobicContact SD-CG2 3.58Å; M190-I197 VanDerWaalsContact SD-CG2 3.58Å; M190-V198 HydrophobicContact CE-CG2 4.36Å; M190-F221 HydrophobicContact CG-CE1 4.37Å; M190-F221 HydrophobicContact CG-CZ 4.22Å
191	Q	94.1	Very high	93.5	Very high	128 Å²	128	66.2 Å²	66.2	60%	0.598	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140	118.1	-179.2	-173.9	176.4	7.1	0	0	110.3	C174 K175	C174-Q191 CarbonylContact C-O 3.6Å; C174-Q191 WeakPolarHBondContact CA-O 3.26Å; K175-Q191 PolarHBondContact N-O 3.41Å; K175-Q191 PolarHBondContact O-N 3.37Å
192	P	94.5	Very high	93.8	Very high	33 Å²	33	69.2 Å²	69.2	21%	0.214	36%	0.357	C	S	.	.	S	Bend	cis	-66.8	158	-8.2	30.9	-34.9	0	0	0	111.6	C174 M190 V194 F221 F224	C174-P192 VanDerWaalsContact SG-CD 3.57Å; M190-P192 VanDerWaalsContact CG-O 3.32Å; M190-P192 WeakPolarHBondContact CG-O 3.46Å; P192-V194 HydrophobicContact CG-CG2 4.45Å; P192-V194 PolarHBondContact O-N 3.16Å; P192-F221 HydrophobicContact CG-CD1 4.47Å; P192-F221 HydrophobicContact CG-CE1 4.45Å; P192-F224 HydrophobicContact CB-CD1 4.23Å; P192-F224 HydrophobicContact CB-CE1 3.54Å; P192-F224 HydrophobicContact CB-CE2 4.45Å; P192-F224 HydrophobicContact CB-CZ 3.67Å; P192-F224 HydrophobicContact CG-CD1 3.5Å; P192-F224 HydrophobicContact CG-CE1 3.28Å; P192-F224 HydrophobicContact CG-CG 4.32Å; P192-F224 HydrophobicContact CG-CZ 3.9Å
193	Y	95.5	Very high	94.3	Very high	152 Å²	152	66 Å²	66	60%	0.596	33%	0.331	S	S	*	.			trans	-71	121.8	176.2	-176.7	-93.3	0	0	0	110.7	M190 E195 V198	M190-Y193 HydrophobicContact CE-CD2 3.4Å; M190-Y193 VanDerWaalsContact CE-CD2 3.4Å; M190-Y193 HydrophobicContact CE-CE2 3.63Å; M190-Y193 HydrophobicContact CE-CG 3.94Å; Y193-E195 HydrophobicContact CE1-CB 3.97Å; Y193-V198 HydrophobicContact CE2-CG2 4.38Å
194	V	95	Very high	94.7	Very high	12 Å²	12	60.3 Å²	60.3	7%	0.073	30%	0.301	C	S	.	.			trans	-127.9	100.1	177.7	-179.1	0	0	0	0	109	M190 P192 P196 I197 Q220 F221 F224	M190-V194 VanDerWaalsContact CE-O 3.3Å; M190-V194 WeakPolarHBondContact CE-O 3.48Å; M190-V194 HydrophobicContact SD-CB 4.33Å; P192-V194 HydrophobicContact CG-CG2 4.45Å; P192-V194 PolarHBondContact O-N 3.16Å; V194-P196 VanDerWaalsContact C-CD 3.45Å; V194-P196 HydrophobicContact CG1-CG 4.45Å; V194-P196 VanDerWaalsContact O-N 3.16Å; V194-I197 HydrophobicContact CB-CD1 3.84Å; V194-I197 HydrophobicContact CB-CG1 4.15Å; V194-I197 HydrophobicContact CG1-CD1 4.21Å; V194-I197 HydrophobicContact CG1-CG1 4.17Å; V194-I197 HydrophobicContact CG2-CD1 4.47Å; V194-I197 WeakPolarHBondContact O-CB 3.37Å; V194-I197 PolarHBondContact O-N 3.04Å; V194-Q220 HydrophobicContact CG1-CB 4.02Å; V194-F221 HydrophobicContact CG2-CD1 3.87Å; V194-F221 HydrophobicContact CG2-CE1 3.94Å; V194-F224 HydrophobicContact CG2-CB 3.99Å; V194-F224 HydrophobicContact CG2-CD2 3.86Å; V194-F224 HydrophobicContact CG2-CG 3.87Å
195	E	94.7	Very high	94.8	Very high	138 Å²	138	60.2 Å²	60.2	65%	0.645	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-43.1	-172.2	-179.6	179.9	-163.3	0	0	115	Y193 I197 V198	Y193-E195 HydrophobicContact CE1-CB 3.97Å; E195-I197 PolarHBondContact O-N 2.93Å; E195-V198 WeakPolarHBondContact O-CB 3.42Å; E195-V198 WeakPolarHBondContact O-CG2 3.34Å; E195-V198 PolarHBondContact O-N 3.44Å
196	P	95.8	Very high	94.8	Very high	52 Å²	52	68 Å²	68	34%	0.338	33%	0.327	S	S	.	.	H	α-helix	trans	-55.3	-25.9	176.5	-29.5	35.6	0	0	0	115.3	V194 V198 Q199 L200 Q220	V194-P196 VanDerWaalsContact C-CD 3.45Å; V194-P196 HydrophobicContact CG1-CG 4.45Å; V194-P196 VanDerWaalsContact O-N 3.16Å; P196-V198 VanDerWaalsContact C-N 3.28Å; P196-V198 PolarHBondContact O-N 2.87Å; P196-Q199 PolarHBondContact O-N 3.23Å; P196-L200 PolarHBondContact O-N 3.04Å; P196-Q220 HydrophobicContact CB-CG 4.16Å
197	I	95.7	Very high	94.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.9	-27.7	-179.4	-65.7	179.3	0	0	0	111.7	L176 M190 V194 E195 Q199 L200 V201 V217 Q220 F221	L176-I197 HydrophobicContact CD1-CG2 3.74Å; L176-I197 HydrophobicContact CD2-CG2 4.32Å; M190-I197 HydrophobicContact CE-CB 4.33Å; M190-I197 HydrophobicContact SD-CB 3.51Å; M190-I197 VanDerWaalsContact SD-CB 3.51Å; M190-I197 HydrophobicContact SD-CD1 3.65Å; M190-I197 HydrophobicContact SD-CG1 4.08Å; M190-I197 HydrophobicContact SD-CG2 3.58Å; M190-I197 VanDerWaalsContact SD-CG2 3.58Å; V194-I197 HydrophobicContact CB-CD1 3.84Å; V194-I197 HydrophobicContact CB-CG1 4.15Å; V194-I197 HydrophobicContact CG1-CD1 4.21Å; V194-I197 HydrophobicContact CG1-CG1 4.17Å; V194-I197 HydrophobicContact CG2-CD1 4.47Å; V194-I197 WeakPolarHBondContact O-CB 3.37Å; V194-I197 PolarHBondContact O-N 3.04Å; E195-I197 PolarHBondContact O-N 2.93Å; I197-Q199 VanDerWaalsContact C-N 3.32Å; I197-Q199 PolarHBondContact O-N 3.41Å; I197-L200 HydrophobicContact CG1-CD1 4.41Å; I197-L200 WeakPolarHBondContact O-CB 3.32Å; I197-L200 PolarHBondContact O-N 3.4Å; I197-L200 VanDerWaalsContact O-N 3.08Å; I197-V201 PolarHBondContact O-N 3.36Å; I197-V217 HydrophobicContact CD1-CG1 4.09Å; I197-V217 HydrophobicContact CG2-CG2 4.09Å; I197-Q220 HydrophobicContact CD1-CB 4.09Å; I197-Q220 HydrophobicContact CG1-CB 3.83Å; I197-Q220 HydrophobicContact CG1-CG 4.16Å; I197-F221 HydrophobicContact CD1-CD1 3.95Å; I197-F221 HydrophobicContact CD1-CD2 4.25Å; I197-F221 HydrophobicContact CD1-CE1 3.56Å; I197-F221 HydrophobicContact CD1-CE2 3.9Å; I197-F221 HydrophobicContact CD1-CG 4.27Å; I197-F221 HydrophobicContact CD1-CZ 3.54Å
198	V	95.4	Very high	94.6	Very high	52 Å²	52	69.3 Å²	69.3	32%	0.315	33%	0.332	S	S	.	.	H	α-helix	trans	-58.9	-46.9	176.8	-177.1	0	0	0	0	110.1	L187 M190 Y193 E195 P196 L200 V201 D202	L187-V198 HydrophobicContact CD2-CG2 4.11Å; M190-V198 HydrophobicContact CE-CG2 4.36Å; Y193-V198 HydrophobicContact CE2-CG2 4.38Å; E195-V198 WeakPolarHBondContact O-CB 3.42Å; E195-V198 WeakPolarHBondContact O-CG2 3.34Å; E195-V198 PolarHBondContact O-N 3.44Å; P196-V198 VanDerWaalsContact C-N 3.28Å; P196-V198 PolarHBondContact O-N 2.87Å; V198-L200 VanDerWaalsContact C-N 3.26Å; V198-L200 PolarHBondContact O-N 3.33Å; V198-V201 WeakPolarHBondContact O-CB 3.2Å; V198-V201 PolarHBondContact O-N 2.85Å; V198-V201 VanDerWaalsContact O-N 3.1Å; V198-D202 PolarHBondContact O-N 3Å
199	Q	94.9	Very high	94.6	Very high	135 Å²	135	71.7 Å²	71.7	63%	0.631	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-29.7	176.8	-62.8	177.8	-0.9	0	0	112.6	P196 I197 V201 D202 D203	P196-Q199 PolarHBondContact O-N 3.23Å; I197-Q199 VanDerWaalsContact C-N 3.32Å; I197-Q199 PolarHBondContact O-N 3.41Å; Q199-V201 VanDerWaalsContact C-N 3.29Å; Q199-V201 PolarHBondContact O-N 3.47Å; Q199-D202 PolarHBondContact O-N 3.39Å; Q199-D203 PolarHBondContact O-N 2.87Å
200	L	96.5	Very high	94.5	Very high	15 Å²	15	70.8 Å²	70.8	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-31.3	175.5	-62.9	-179.8	0	0	0	112.1	P196 I197 V198 D203 L204 F213 R216 V217 Q220	P196-L200 PolarHBondContact O-N 3.04Å; I197-L200 HydrophobicContact CG1-CD1 4.41Å; I197-L200 WeakPolarHBondContact O-CB 3.32Å; I197-L200 PolarHBondContact O-N 3.4Å; I197-L200 VanDerWaalsContact O-N 3.08Å; V198-L200 VanDerWaalsContact C-N 3.26Å; V198-L200 PolarHBondContact O-N 3.33Å; L200-D203 WeakPolarHBondContact O-CB 3.47Å; L200-D203 PolarHBondContact O-N 3.49Å; L200-L204 WeakPolarHBondContact O-CB 3.44Å; L200-L204 PolarHBondContact O-N 3.48Å; L200-F213 HydrophobicContact CB-CD2 3.85Å; L200-F213 HydrophobicContact CB-CE2 3.79Å; L200-F213 VanDerWaalsContact O-CD2 3.26Å; L200-F213 WeakPolarHBondContact O-CD2 3.2Å; L200-R216 HydrophobicContact CD1-CB 3.64Å; L200-R216 HydrophobicContact CD2-CB 3.84Å; L200-R216 HydrophobicContact CD2-CG 4.38Å; L200-R216 HydrophobicContact CG-CB 4.4Å; L200-V217 HydrophobicContact CB-CG2 4.48Å; L200-V217 HydrophobicContact CD1-CG2 3.79Å; L200-Q220 HydrophobicContact CD1-CG 4.1Å
201	V	95.1	Very high	94.3	Very high	5 Å²	5	72.6 Å²	72.6	3%	0.03	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-36.7	175.4	178.2	0	0	0	0	110.7	Y185 L187 I197 V198 Q199 L204 N205 F213	Y185-V201 WeakPolarHBondContact O-CG1 3.41Å; L187-V201 HydrophobicContact CB-CG1 4.45Å; L187-V201 HydrophobicContact CB-CG2 4.23Å; I197-V201 PolarHBondContact O-N 3.36Å; V198-V201 WeakPolarHBondContact O-CB 3.2Å; V198-V201 PolarHBondContact O-N 2.85Å; V198-V201 VanDerWaalsContact O-N 3.1Å; Q199-V201 VanDerWaalsContact C-N 3.29Å; Q199-V201 PolarHBondContact O-N 3.47Å; V201-L204 WeakPolarHBondContact O-CB 3.34Å; V201-L204 PolarHBondContact O-N 2.93Å; V201-N205 PolarHBondContact O-N 3.31Å; V201-N205 PolarHBondContact O-ND2 3.17Å; V201-F213 HydrophobicContact CG2-CE2 3.77Å; V201-F213 HydrophobicContact CG2-CZ 3.97Å
202	D	93.9	Very high	94.1	Very high	101 Å²	101	69 Å²	69	54%	0.54	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-42.7	172	-63.8	-30.5	0	0	0	111.6	V198 Q199 L204 N205 R206	V198-D202 PolarHBondContact O-N 3Å; Q199-D202 PolarHBondContact O-N 3.39Å; D202-L204 VanDerWaalsContact C-N 3.3Å; D202-L204 PolarHBondContact O-N 3.19Å; D202-N205 WeakPolarHBondContact O-CB 3.41Å; D202-N205 PolarHBondContact O-N 3.02Å; D202-R206 PolarHBondContact O-N 3.32Å
203	D	94.5	Very high	94.2	Very high	41 Å²	41	67.7 Å²	67.7	22%	0.219	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-38.1	172	-94.8	-13.3	0	0	0	112.2	Q199 L200 R206 T207 R216	Q199-D203 PolarHBondContact O-N 2.87Å; L200-D203 WeakPolarHBondContact O-CB 3.47Å; L200-D203 PolarHBondContact O-N 3.49Å; D203-R206 PolarHBondContact O-N 3.41Å; D203-R206 IonicContact OD1-CZ 3.64Å; D203-R206 IonicContact OD1-NE 2.7Å; D203-R206 IonicContact OD1-NH2 3.56Å; D203-R206 PolarHBondContact OD1-NH2 3.41Å; D203-T207 WeakPolarHBondContact O-CB 3.49Å; D203-T207 WeakPolarHBondContact O-CG2 3.3Å; D203-T207 PolarHBondContact O-N 2.92Å; D203-T207 PolarHBondContact O-OG1 3.3Å; D203-R216 IonicContact OD2-NH1 3.36Å; D203-R216 PolarHBondContact OD2-NH1 3.05Å; D203-R216 VanDerWaalsContact OD2-NH1 3.12Å
204	L	95.5	Very high	94.2	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-41.3	175.3	176.7	63.8	0	0	0	111.3	I178 Y185 L200 V201 D202 R206 R208 W210 F213	I178-L204 HydrophobicContact CD1-CD2 4.38Å; Y185-L204 HydrophobicContact CD2-CD2 3.85Å; Y185-L204 HydrophobicContact CD2-CG 3.75Å; Y185-L204 HydrophobicContact CE2-CD2 4.34Å; Y185-L204 HydrophobicContact CE2-CG 4.1Å; Y185-L204 HydrophobicContact CG-CD2 4.04Å; Y185-L204 HydrophobicContact CG-CG 4.44Å; L200-L204 WeakPolarHBondContact O-CB 3.44Å; L200-L204 PolarHBondContact O-N 3.48Å; V201-L204 WeakPolarHBondContact O-CB 3.34Å; V201-L204 PolarHBondContact O-N 2.93Å; D202-L204 VanDerWaalsContact C-N 3.3Å; D202-L204 PolarHBondContact O-N 3.19Å; L204-R206 VanDerWaalsContact C-N 3.3Å; L204-R206 PolarHBondContact O-N 3Å; L204-R208 VanDerWaalsContact O-CA 3.26Å; L204-R208 WeakPolarHBondContact O-CA 3.42Å; L204-R208 PolarHBondContact O-N 2.91Å; L204-W210 HydrophobicContact CD1-CD2 3.91Å; L204-W210 HydrophobicContact CD1-CE3 4.31Å; L204-W210 HydrophobicContact CD1-CG 4.01Å; L204-W210 HydrophobicContact CD2-CD2 4.16Å; L204-W210 HydrophobicContact CD2-CE3 4Å; L204-W210 HydrophobicContact CD2-CH2 3.76Å; L204-W210 HydrophobicContact CD2-CZ2 3.93Å; L204-W210 HydrophobicContact CD2-CZ3 3.79Å; L204-F213 HydrophobicContact CB-CB 4.3Å; L204-F213 HydrophobicContact CB-CD2 3.87Å; L204-F213 HydrophobicContact CB-CE2 4.45Å; L204-F213 HydrophobicContact CB-CG 4.11Å; L204-F213 HydrophobicContact CD1-CB 3.97Å; L204-F213 HydrophobicContact CD1-CG 4.26Å; L204-F213 HydrophobicContact CD2-CD1 3.96Å; L204-F213 HydrophobicContact CD2-CD2 4.21Å; L204-F213 HydrophobicContact CD2-CE1 4.16Å; L204-F213 HydrophobicContact CD2-CE2 4.4Å; L204-F213 HydrophobicContact CD2-CG 3.98Å; L204-F213 HydrophobicContact CD2-CZ 4.37Å; L204-F213 HydrophobicContact CG-CG 4.33Å
205	N	95	Very high	94.1	Very high	36 Å²	36	65.1 Å²	65.1	19%	0.193	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-40.1	174.6	-81	-46.8	0	0	0	112.2	C184 Y185 V201 D202 R208	C184-N205 VanDerWaalsContact CA-OD1 3.29Å; C184-N205 WeakPolarHBondContact CA-OD1 3.34Å; C184-N205 WeakPolarHBondContact CB-OD1 3.39Å; Y185-N205 WeakPolarHBondContact CD2-OD1 3.5Å; Y185-N205 PolarHBondContact N-OD1 3.1Å; Y185-N205 PolarHBondContact O-ND2 3.32Å; V201-N205 PolarHBondContact O-N 3.31Å; V201-N205 PolarHBondContact O-ND2 3.17Å; D202-N205 WeakPolarHBondContact O-CB 3.41Å; D202-N205 PolarHBondContact O-N 3.02Å; N205-R208 PolarHBondContact O-NE 3.11Å
206	R	93.6	Very high	94.2	Very high	194 Å²	194	64.5 Å²	64.5	73%	0.732	31%	0.31	S	S	*	.	H	α-helix	trans	-75.2	-44.9	179.9	-174.1	175.7	60	157.8	-4	113.4	D202 D203 L204	D202-R206 PolarHBondContact O-N 3.32Å; D203-R206 PolarHBondContact O-N 3.41Å; D203-R206 IonicContact OD1-CZ 3.64Å; D203-R206 IonicContact OD1-NE 2.7Å; D203-R206 IonicContact OD1-NH2 3.56Å; D203-R206 PolarHBondContact OD1-NH2 3.41Å; L204-R206 VanDerWaalsContact C-N 3.3Å; L204-R206 PolarHBondContact O-N 3Å
207	T	93.8	Very high	94.2	Very high	64 Å²	64	62 Å²	62	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-94.7	-24.2	-170.5	63.1	0	0	0	0	113.8	D203 K209	D203-T207 WeakPolarHBondContact O-CB 3.49Å; D203-T207 WeakPolarHBondContact O-CG2 3.3Å; D203-T207 PolarHBondContact O-N 2.92Å; D203-T207 PolarHBondContact O-OG1 3.3Å; T207-K209 PolarHBondContact O-N 2.9Å; T207-K209 VanDerWaalsContact O-N 3.09Å; T207-K209 PolarHBondContact OG1-N 3.01Å
208	R	90.2	Very high	94.2	Very high	124 Å²	124	64.6 Å²	64.6	47%	0.468	30%	0.303	S	S	.	.			trans	55.3	16.8	-168.6	-51.8	-59.8	-175.2	174.7	0.9	114.2	D183 L204 N205 W210	D183-R208 PolarHBondContact O-NH2 2.87Å; L204-R208 VanDerWaalsContact O-CA 3.26Å; L204-R208 WeakPolarHBondContact O-CA 3.42Å; L204-R208 PolarHBondContact O-N 2.91Å; N205-R208 PolarHBondContact O-NE 3.11Å; R208-W210 PolarHBondContact O-N 3.14Å
209	K	92.5	Very high	94.2	Very high	127 Å²	127	63.1 Å²	63.1	55%	0.552	30%	0.299	S	S	*	.			trans	-90.3	83.4	-179.4	-69.1	-177.1	179.9	-177.3	0	111	T207 T211 T212 F213	T207-K209 PolarHBondContact O-N 2.9Å; T207-K209 VanDerWaalsContact O-N 3.09Å; T207-K209 PolarHBondContact OG1-N 3.01Å; K209-T211 PolarHBondContact O-N 3.36Å; K209-T211 VanDerWaalsContact O-N 3.16Å; K209-T212 PolarHBondContact O-N 3.1Å; K209-F213 PolarHBondContact O-N 3.38Å
210	W	93	Very high	94.2	Very high	63 Å²	63	58.6 Å²	58.6	24%	0.239	28%	0.278	C	S	.	.	H	α-helix	trans	-53.2	-34.4	176.5	-86.6	104	0	0	0	113.8	I158 L160 I178 Y185 L204 R208 F213 L214	I158-W210 HydrophobicContact CD1-CH2 3.89Å; I158-W210 HydrophobicContact CD1-CZ2 3.87Å; L160-W210 HydrophobicContact CD1-CZ3 4.25Å; I178-W210 HydrophobicContact CD1-CH2 3.94Å; I178-W210 HydrophobicContact CD1-CZ3 4.04Å; Y185-W210 HydrophobicContact CD1-CH2 4.39Å; Y185-W210 AromaticContact CD1-CZ2 3.8Å; Y185-W210 HydrophobicContact CD1-CZ2 3.8Å; Y185-W210 HydrophobicContact CE1-CH2 4.38Å; Y185-W210 AromaticContact CE1-CZ2 3.41Å; Y185-W210 HydrophobicContact CE1-CZ2 3.41Å; Y185-W210 VanDerWaalsContact CE1-CZ2 3.41Å; Y185-W210 HydrophobicContact CE2-CZ2 4.29Å; Y185-W210 HydrophobicContact CG-CZ2 4.41Å; Y185-W210 AromaticContact CZ-CE2 3.86Å; Y185-W210 AromaticContact CZ-CZ2 3.67Å; Y185-W210 AromaticContact CZ-NE1 3.56Å; Y185-W210 PolarHBondContact OH-NE1 3.43Å; Y185-W210 VanDerWaalsContact OH-NE1 3.13Å; L204-W210 HydrophobicContact CD1-CD2 3.91Å; L204-W210 HydrophobicContact CD1-CE3 4.31Å; L204-W210 HydrophobicContact CD1-CG 4.01Å; L204-W210 HydrophobicContact CD2-CD2 4.16Å; L204-W210 HydrophobicContact CD2-CE3 4Å; L204-W210 HydrophobicContact CD2-CH2 3.76Å; L204-W210 HydrophobicContact CD2-CZ2 3.93Å; L204-W210 HydrophobicContact CD2-CZ3 3.79Å; R208-W210 PolarHBondContact O-N 3.14Å; W210-F213 AromaticContact CE3-CD1 3.8Å; W210-F213 HydrophobicContact CE3-CD1 3.8Å; W210-F213 HydrophobicContact CE3-CE1 4.31Å; W210-F213 AromaticContact CZ3-CD1 3.87Å; W210-F213 HydrophobicContact CZ3-CD1 3.87Å; W210-F213 AromaticContact CZ3-CE1 3.9Å; W210-F213 HydrophobicContact CZ3-CE1 3.9Å; W210-F213 WeakPolarHBondContact O-CB 3.39Å; W210-F213 PolarHBondContact O-N 3.35Å; W210-L214 WeakPolarHBondContact O-CB 3.5Å; W210-L214 WeakPolarHBondContact O-CG 3.4Å; W210-L214 PolarHBondContact O-N 3.41Å
211	T	90.2	Very high	94.2	Very high	51 Å²	51	57.9 Å²	57.9	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-71.3	-48.8	-174	68.3	0	0	0	0	110.9	L20 K209 F213 L214 T215	L20-T211 HydrophobicContact CD1-CG2 3.46Å; L20-T211 VanDerWaalsContact CD1-CG2 3.46Å; L20-T211 HydrophobicContact CD2-CG2 3.13Å; L20-T211 HydrophobicContact CG-CG2 3.8Å; K209-T211 PolarHBondContact O-N 3.36Å; K209-T211 VanDerWaalsContact O-N 3.16Å; T211-F213 VanDerWaalsContact C-N 3.28Å; T211-F213 PolarHBondContact O-N 2.7Å; T211-L214 PolarHBondContact O-N 3.4Å; T211-T215 PolarHBondContact O-N 2.76Å; T211-T215 PolarHBondContact O-OG1 3.14Å; T211-T215 VanDerWaalsContact O-OG1 3.05Å
212	T	91.6	Very high	94.1	Very high	52 Å²	52	61 Å²	61	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-59.2	-41.7	171.9	-52.4	0	0	0	0	111.1	K209 R216	K209-T212 PolarHBondContact O-N 3.1Å; T212-R216 WeakPolarHBondContact O-CB 3.4Å; T212-R216 VanDerWaalsContact O-CG 3.27Å; T212-R216 WeakPolarHBondContact O-CG 3.27Å; T212-R216 PolarHBondContact O-N 3.12Å
213	F	95.6	Very high	94.2	Very high	7 Å²	7	63.5 Å²	63.5	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-54.1	175.7	171.4	-101.8	0	0	0	111.9	L160 L176 I178 L200 V201 L204 K209 W210 T211 T215 R216 V217	L160-F213 HydrophobicContact CD1-CE1 4.02Å; L176-F213 HydrophobicContact CD2-CE1 4.14Å; L176-F213 HydrophobicContact CD2-CZ 3.62Å; I178-F213 HydrophobicContact CD1-CE1 3.67Å; I178-F213 HydrophobicContact CD1-CZ 3.63Å; L200-F213 HydrophobicContact CB-CD2 3.85Å; L200-F213 HydrophobicContact CB-CE2 3.79Å; L200-F213 VanDerWaalsContact O-CD2 3.26Å; L200-F213 WeakPolarHBondContact O-CD2 3.2Å; V201-F213 HydrophobicContact CG2-CE2 3.77Å; V201-F213 HydrophobicContact CG2-CZ 3.97Å; L204-F213 HydrophobicContact CB-CB 4.3Å; L204-F213 HydrophobicContact CB-CD2 3.87Å; L204-F213 HydrophobicContact CB-CE2 4.45Å; L204-F213 HydrophobicContact CB-CG 4.11Å; L204-F213 HydrophobicContact CD1-CB 3.97Å; L204-F213 HydrophobicContact CD1-CG 4.26Å; L204-F213 HydrophobicContact CD2-CD1 3.96Å; L204-F213 HydrophobicContact CD2-CD2 4.21Å; L204-F213 HydrophobicContact CD2-CE1 4.16Å; L204-F213 HydrophobicContact CD2-CE2 4.4Å; L204-F213 HydrophobicContact CD2-CG 3.98Å; L204-F213 HydrophobicContact CD2-CZ 4.37Å; L204-F213 HydrophobicContact CG-CG 4.33Å; K209-F213 PolarHBondContact O-N 3.38Å; W210-F213 AromaticContact CE3-CD1 3.8Å; W210-F213 HydrophobicContact CE3-CD1 3.8Å; W210-F213 HydrophobicContact CE3-CE1 4.31Å; W210-F213 AromaticContact CZ3-CD1 3.87Å; W210-F213 HydrophobicContact CZ3-CD1 3.87Å; W210-F213 AromaticContact CZ3-CE1 3.9Å; W210-F213 HydrophobicContact CZ3-CE1 3.9Å; W210-F213 WeakPolarHBondContact O-CB 3.39Å; W210-F213 PolarHBondContact O-N 3.35Å; T211-F213 VanDerWaalsContact C-N 3.28Å; T211-F213 PolarHBondContact O-N 2.7Å; F213-T215 PolarHBondContact O-N 3.25Å; F213-R216 PolarHBondContact O-N 2.93Å; F213-V217 HydrophobicContact CD1-CG2 4.4Å; F213-V217 HydrophobicContact CD2-CG2 4.03Å; F213-V217 HydrophobicContact CE1-CG2 3.99Å; F213-V217 HydrophobicContact CE2-CG2 3.59Å; F213-V217 HydrophobicContact CG-CG2 4.41Å; F213-V217 HydrophobicContact CZ-CG2 3.56Å; F213-V217 WeakPolarHBondContact O-CB 3.32Å; F213-V217 WeakPolarHBondContact O-CG2 3.13Å; F213-V217 PolarHBondContact O-N 3Å
214	L	95.1	Very high	94.1	Very high	38 Å²	38	66.1 Å²	66.1	20%	0.199	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-43.3	-179	-70.2	171.9	0	0	0	112.2	L144 L160 F162 W210 T211 V217 R218	L144-L214 HydrophobicContact CD2-CD1 4.19Å; L144-L214 HydrophobicContact CD2-CD2 4.34Å; L160-L214 HydrophobicContact CD1-CD2 3.65Å; L160-L214 HydrophobicContact CD2-CD2 4.12Å; L160-L214 HydrophobicContact CG-CD2 4.46Å; F162-L214 HydrophobicContact CE1-CD2 4.5Å; F162-L214 HydrophobicContact CZ-CD2 3.8Å; W210-L214 WeakPolarHBondContact O-CB 3.5Å; W210-L214 WeakPolarHBondContact O-CG 3.4Å; W210-L214 PolarHBondContact O-N 3.41Å; T211-L214 PolarHBondContact O-N 3.4Å; L214-V217 PolarHBondContact O-N 3.05Å; L214-R218 WeakPolarHBondContact O-CB 3.33Å; L214-R218 PolarHBondContact O-N 3.19Å
215	T	94.3	Very high	93.8	Very high	71 Å²	71	67.5 Å²	67.5	44%	0.436	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-43.8	177.4	-58.7	0	0	0	0	111.5	T211 F213 R218 G219	T211-T215 PolarHBondContact O-N 2.76Å; T211-T215 PolarHBondContact O-OG1 3.14Å; T211-T215 VanDerWaalsContact O-OG1 3.05Å; F213-T215 PolarHBondContact O-N 3.25Å; T215-R218 PolarHBondContact O-N 2.98Å; T215-G219 PolarHBondContact O-N 3.47Å
216	R	96.1	Very high	93.3	Very high	125 Å²	125	69.8 Å²	69.8	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-68.4	-42.5	178.4	-72.1	179.8	179.8	-170.9	-0.1	112	L200 D203 T212 F213 R218 G219 Q220	L200-R216 HydrophobicContact CD1-CB 3.64Å; L200-R216 HydrophobicContact CD2-CB 3.84Å; L200-R216 HydrophobicContact CD2-CG 4.38Å; L200-R216 HydrophobicContact CG-CB 4.4Å; D203-R216 IonicContact OD2-NH1 3.36Å; D203-R216 PolarHBondContact OD2-NH1 3.05Å; D203-R216 VanDerWaalsContact OD2-NH1 3.12Å; T212-R216 WeakPolarHBondContact O-CB 3.4Å; T212-R216 VanDerWaalsContact O-CG 3.27Å; T212-R216 WeakPolarHBondContact O-CG 3.27Å; T212-R216 PolarHBondContact O-N 3.12Å; F213-R216 PolarHBondContact O-N 2.93Å; R216-R218 VanDerWaalsContact C-N 3.34Å; R216-R218 PolarHBondContact O-N 3.06Å; R216-G219 PolarHBondContact O-N 3.01Å; R216-Q220 WeakPolarHBondContact O-CG 3.44Å; R216-Q220 PolarHBondContact O-N 3.03Å
217	V	96.3	Very high	92.2	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-46.4	175	166.4	0	0	0	0	110.7	F162 I197 L200 F213 L214 G219 Q220 F221	F162-V217 HydrophobicContact CD2-CG1 4.32Å; F162-V217 HydrophobicContact CE1-CG1 4.41Å; F162-V217 HydrophobicContact CE2-CG1 3.57Å; F162-V217 HydrophobicContact CZ-CB 4.2Å; F162-V217 HydrophobicContact CZ-CG1 3.62Å; I197-V217 HydrophobicContact CD1-CG1 4.09Å; I197-V217 HydrophobicContact CG2-CG2 4.09Å; L200-V217 HydrophobicContact CB-CG2 4.48Å; L200-V217 HydrophobicContact CD1-CG2 3.79Å; F213-V217 HydrophobicContact CD1-CG2 4.4Å; F213-V217 HydrophobicContact CD2-CG2 4.03Å; F213-V217 HydrophobicContact CE1-CG2 3.99Å; F213-V217 HydrophobicContact CE2-CG2 3.59Å; F213-V217 HydrophobicContact CG-CG2 4.41Å; F213-V217 HydrophobicContact CZ-CG2 3.56Å; F213-V217 WeakPolarHBondContact O-CB 3.32Å; F213-V217 WeakPolarHBondContact O-CG2 3.13Å; F213-V217 PolarHBondContact O-N 3Å; L214-V217 PolarHBondContact O-N 3.05Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 2.91Å; V217-Q220 PolarHBondContact O-N 3.47Å; V217-F221 HydrophobicContact CG1-CD2 3.77Å; V217-F221 HydrophobicContact CG1-CE2 3.54Å; V217-F221 HydrophobicContact CG1-CZ 4.48Å; V217-F221 PolarHBondContact O-N 3.11Å
218	R	95.1	Very high	92.2	Very high	55 Å²	55	70.9 Å²	70.9	21%	0.208	33%	0.33	C	S	.	.	H	α-helix	trans	-55.3	-50.2	174.6	-169.3	-174.4	-168.9	86.3	7.2	110.8	L142 F162 T163 R164 L165 L214 T215 R216 Q220 F221 Q222	L142-R218 PolarHBondContact O-NH1 3.07Å; L142-R218 PolarHBondContact O-NH2 3.3Å; F162-R218 HydrophobicContact CD1-CB 4.1Å; F162-R218 HydrophobicContact CD1-CG 4.23Å; F162-R218 HydrophobicContact CE1-CB 4.02Å; T163-R218 PolarHBondContact O-NH2 3.28Å; T163-R218 VanDerWaalsContact O-NH2 3.14Å; R164-R218 PolarHBondContact O-NH2 3.43Å; R164-R218 VanDerWaalsContact O-NH2 3.14Å; L165-R218 HydrophobicContact CD2-CG 3.66Å; L214-R218 WeakPolarHBondContact O-CB 3.33Å; L214-R218 PolarHBondContact O-N 3.19Å; T215-R218 PolarHBondContact O-N 2.98Å; R216-R218 VanDerWaalsContact C-N 3.34Å; R216-R218 PolarHBondContact O-N 3.06Å; R218-Q220 VanDerWaalsContact C-N 3.29Å; R218-Q220 PolarHBondContact O-N 3.21Å; R218-F221 PolarHBondContact O-N 3.4Å; R218-Q222 HydrophobicContact CG-CG 4.35Å; R218-Q222 VanDerWaalsContact O-CG 3.3Å; R218-Q222 WeakPolarHBondContact O-CG 3.4Å; R218-Q222 PolarHBondContact O-N 3.05Å
219	G	94.9	Very high	92.3	Very high	21 Å²	21	68.1 Å²	68.1	22%	0.216	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-37	178.7	0	0	0	0	0	113.6	T215 R216 V217 R223	T215-G219 PolarHBondContact O-N 3.47Å; R216-G219 PolarHBondContact O-N 3.01Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 2.91Å; G219-R223 WeakPolarHBondContact O-CG 3.46Å; G219-R223 PolarHBondContact O-N 3.23Å
220	Q	96	Very high	92.2	Very high	40 Å²	40	64.8 Å²	64.8	19%	0.187	31%	0.31	C	S	.	.	H	α-helix	trans	-67.5	-44.5	175.5	-66.9	-60.7	-16.6	0	0	112.1	V194 P196 I197 L200 R216 V217 R218 R223 F224	V194-Q220 HydrophobicContact CG1-CB 4.02Å; P196-Q220 HydrophobicContact CB-CG 4.16Å; I197-Q220 HydrophobicContact CD1-CB 4.09Å; I197-Q220 HydrophobicContact CG1-CB 3.83Å; I197-Q220 HydrophobicContact CG1-CG 4.16Å; L200-Q220 HydrophobicContact CD1-CG 4.1Å; R216-Q220 WeakPolarHBondContact O-CG 3.44Å; R216-Q220 PolarHBondContact O-N 3.03Å; V217-Q220 PolarHBondContact O-N 3.47Å; R218-Q220 VanDerWaalsContact C-N 3.29Å; R218-Q220 PolarHBondContact O-N 3.21Å; Q220-R223 PolarHBondContact O-N 3.27Å; Q220-F224 WeakPolarHBondContact O-CB 3.47Å; Q220-F224 PolarHBondContact O-N 3.15Å
221	F	95.8	Very high	92.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-36.5	175.2	-72.9	-46.3	0	0	0	112.9	F162 L165 C174 M190 P192 V194 I197 V217 R218 F224 L225	F162-F221 HydrophobicContact CB-CD2 4.43Å; F162-F221 AromaticContact CD2-CD2 3.99Å; F162-F221 HydrophobicContact CD2-CD2 3.99Å; F162-F221 AromaticContact CD2-CE2 3.83Å; F162-F221 HydrophobicContact CD2-CE2 3.83Å; F162-F221 HydrophobicContact CE2-CE2 4.2Å; F162-F221 HydrophobicContact CG-CD2 4.24Å; L165-F221 HydrophobicContact CD1-CB 3.78Å; L165-F221 HydrophobicContact CD2-CB 4.2Å; C174-F221 HydrophobicContact CB-CB 4.07Å; C174-F221 HydrophobicContact CB-CD1 3.54Å; C174-F221 HydrophobicContact CB-CD2 3.58Å; C174-F221 HydrophobicContact CB-CE1 3.73Å; C174-F221 HydrophobicContact CB-CE2 3.74Å; C174-F221 HydrophobicContact CB-CG 3.48Å; C174-F221 VanDerWaalsContact CB-CG 3.48Å; C174-F221 HydrophobicContact CB-CZ 3.82Å; M190-F221 HydrophobicContact CG-CE1 4.37Å; M190-F221 HydrophobicContact CG-CZ 4.22Å; P192-F221 HydrophobicContact CG-CD1 4.47Å; P192-F221 HydrophobicContact CG-CE1 4.45Å; V194-F221 HydrophobicContact CG2-CD1 3.87Å; V194-F221 HydrophobicContact CG2-CE1 3.94Å; I197-F221 HydrophobicContact CD1-CD1 3.95Å; I197-F221 HydrophobicContact CD1-CD2 4.25Å; I197-F221 HydrophobicContact CD1-CE1 3.56Å; I197-F221 HydrophobicContact CD1-CE2 3.9Å; I197-F221 HydrophobicContact CD1-CG 4.27Å; I197-F221 HydrophobicContact CD1-CZ 3.54Å; V217-F221 HydrophobicContact CG1-CD2 3.77Å; V217-F221 HydrophobicContact CG1-CE2 3.54Å; V217-F221 HydrophobicContact CG1-CZ 4.48Å; V217-F221 PolarHBondContact O-N 3.11Å; R218-F221 PolarHBondContact O-N 3.4Å; F221-F224 PolarHBondContact O-N 3.35Å; F221-L225 WeakPolarHBondContact O-CG 3.22Å; F221-L225 PolarHBondContact O-N 2.9Å; F221-L225 VanDerWaalsContact O-N 3.11Å
222	Q	94.2	Very high	92.3	Very high	71 Å²	71	65.8 Å²	65.8	33%	0.332	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-48.8	174.2	-71.3	-179.5	-59.5	0	0	111.1	L165 R218 F224 L225 T226	L165-Q222 HydrophobicContact CB-CG 4.19Å; L165-Q222 HydrophobicContact CD2-CG 3.74Å; L165-Q222 WeakPolarHBondContact O-CG 3.47Å; L165-Q222 PolarHBondContact O-NE2 3.1Å; R218-Q222 HydrophobicContact CG-CG 4.35Å; R218-Q222 VanDerWaalsContact O-CG 3.3Å; R218-Q222 WeakPolarHBondContact O-CG 3.4Å; R218-Q222 PolarHBondContact O-N 3.05Å; Q222-F224 VanDerWaalsContact C-N 3.32Å; Q222-F224 PolarHBondContact O-N 2.89Å; Q222-L225 PolarHBondContact O-N 3.02Å; Q222-L225 VanDerWaalsContact O-N 3.1Å; Q222-T226 WeakPolarHBondContact O-CG2 3.41Å; Q222-T226 PolarHBondContact O-N 3.2Å; Q222-T226 VanDerWaalsContact O-N 3.1Å; Q222-T226 PolarHBondContact O-OG1 3Å; Q222-T226 VanDerWaalsContact O-OG1 3.11Å
223	R	94.2	Very high	92.4	Very high	153 Å²	153	66.7 Å²	66.7	58%	0.577	32%	0.315	S	S	*	.	H	α-helix	trans	-59	-42.1	176.3	-72.7	173	-174	168.2	-0	112.6	G219 Q220 L225 T226 H227	G219-R223 WeakPolarHBondContact O-CG 3.46Å; G219-R223 PolarHBondContact O-N 3.23Å; Q220-R223 PolarHBondContact O-N 3.27Å; R223-L225 PolarHBondContact O-N 3.44Å; R223-T226 WeakPolarHBondContact CA-OG1 3.44Å; R223-T226 PolarHBondContact O-N 3.49Å; R223-T226 PolarHBondContact O-OG1 3.38Å; R223-H227 PolarHBondContact O-CD2 2.97Å; R223-H227 PolarHBondContact O-N 3.23Å
224	F	92.5	Very high	92.1	Very high	95 Å²	95	70.9 Å²	70.9	42%	0.417	34%	0.335	S	S	.	.	H	α-helix	trans	-62.3	-30.4	177	178.3	-90	0	0	0	112.9	P192 V194 Q220 F221 Q222	P192-F224 HydrophobicContact CB-CD1 4.23Å; P192-F224 HydrophobicContact CB-CE1 3.54Å; P192-F224 HydrophobicContact CB-CE2 4.45Å; P192-F224 HydrophobicContact CB-CZ 3.67Å; P192-F224 HydrophobicContact CG-CD1 3.5Å; P192-F224 HydrophobicContact CG-CE1 3.28Å; P192-F224 HydrophobicContact CG-CG 4.32Å; P192-F224 HydrophobicContact CG-CZ 3.9Å; V194-F224 HydrophobicContact CG2-CB 3.99Å; V194-F224 HydrophobicContact CG2-CD2 3.86Å; V194-F224 HydrophobicContact CG2-CG 3.87Å; Q220-F224 WeakPolarHBondContact O-CB 3.47Å; Q220-F224 PolarHBondContact O-N 3.15Å; F221-F224 PolarHBondContact O-N 3.35Å; Q222-F224 VanDerWaalsContact C-N 3.32Å; Q222-F224 PolarHBondContact O-N 2.89Å
225	L	90.1	Very high	91.9	Very high	30 Å²	30	73.5 Å²	73.5	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-93	-9.2	-179.2	-69.1	177.1	0	0	0	114	L165 N166 I169 V172 F221 Q222 R223	L165-L225 HydrophobicContact CB-CD1 3.65Å; L165-L225 HydrophobicContact CD1-CD1 3.86Å; L165-L225 HydrophobicContact CG-CD1 4.44Å; N166-L225 HydrophobicContact CB-CB 4.21Å; N166-L225 PolarHBondContact ND2-O 2.96Å; I169-L225 HydrophobicContact CD1-CB 4.41Å; I169-L225 HydrophobicContact CD1-CD2 4.15Å; V172-L225 HydrophobicContact CG1-CD1 4.09Å; V172-L225 HydrophobicContact CG1-CD2 3.95Å; F221-L225 WeakPolarHBondContact O-CG 3.22Å; F221-L225 PolarHBondContact O-N 2.9Å; F221-L225 VanDerWaalsContact O-N 3.11Å; Q222-L225 PolarHBondContact O-N 3.02Å; Q222-L225 VanDerWaalsContact O-N 3.1Å; R223-L225 PolarHBondContact O-N 3.44Å
226	T	84.4	Confident	91.7	Very high	84 Å²	84	73.7 Å²	73.7	52%	0.515	34%	0.338	S	S	.	.	H	α-helix	trans	-102.4	-11.9	177.9	52.8	0	0	0	0	113.4	Q222 R223	Q222-T226 WeakPolarHBondContact O-CG2 3.41Å; Q222-T226 PolarHBondContact O-N 3.2Å; Q222-T226 VanDerWaalsContact O-N 3.1Å; Q222-T226 PolarHBondContact O-OG1 3Å; Q222-T226 VanDerWaalsContact O-OG1 3.11Å; R223-T226 WeakPolarHBondContact CA-OG1 3.44Å; R223-T226 PolarHBondContact O-N 3.49Å; R223-T226 PolarHBondContact O-OG1 3.38Å
227	H	71.2	Confident	91.3	Very high	210 Å²	210	69 Å²	69	97%	0.972	33%	0.326	S	S	*	.			trans	-117.6	0	179.2	-66.4	-54.7	0	0	0	110.2	R223	R223-H227 PolarHBondContact O-CD2 2.97Å; R223-H227 PolarHBondContact O-N 3.23Å

Retrieved 227 of 227 residues in 212.1 ms (Link to these results)

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