A0A087Y3W6_POEFO Loading...

Ras-related protein Rab-19

The small GTPases Rab are key regulators of intracellular membrane trafficking, from the formation of transport vesicles to their fusion with membranes. Rabs cycle between an inactive GDP-bound form and an active GTP-bound form that is able to recruit to membranes different set of downstream effectors directly responsible for vesicle formation, movement, tethering and fusion.

AlphaFold DB , UniProt , Accession A0A087Y3W6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.1	Very low	29.9	Very low	235 Å²	235	171 Å²	171	100%	1.158	84%	0.835	S	S	*	*				0	103.9	0	-67.6	168.6	-174.3	0	0	106.3
2	Q	24.8	Very low	30.4	Very low	162 Å²	162	164.5 Å²	164.5	76%	0.757	82%	0.82	S	S	*	*				57.9	112.5	90	-110.8	-171.9	3.7	0	0	109.3
3	W	23.6	Very low	30.5	Very low	220 Å²	220	165.8 Å²	165.8	83%	0.833	82%	0.822	S	S	*	*			cis	-166.3	166.3	43.5	-90	82.7	0	0	0	113
4	C	24.6	Very low	31	Very low	107 Å²	107	165.6 Å²	165.6	72%	0.723	82%	0.823	S	S	*	*			trans	-97.1	171	169.3	-73.4	0	0	0	0	113.9
5	K	30.4	Very low	31.2	Very low	173 Å²	173	162.1 Å²	162.1	75%	0.752	82%	0.818	S	S	*	*			trans	92.2	143.4	153.8	-46.9	-170.2	176.6	-175.6	0	115.8
6	W	29.2	Very low	31.5	Very low	228 Å²	228	166.5 Å²	166.5	86%	0.864	82%	0.822	S	S	*	*			cis	-152.2	159.4	36.1	-98.2	80	0	0	0	113.3
7	A	30.7	Very low	31.7	Very low	97 Å²	97	167.1 Å²	167.1	80%	0.802	82%	0.822	S	S	*	*			trans	-64.4	142.4	169.4	0	0	0	0	0	113.1
8	G	31.3	Very low	32.2	Very low	71 Å²	71	163.3 Å²	163.3	73%	0.732	81%	0.814	S	S	*	*			trans	-138.1	104.2	163.4	0	0	0	0	0	109	W10	G8-W10 PolarHBondContact O-N 3.44Å
9	S	36	Very low	32.7	Very low	107 Å²	107	160.4 Å²	160.4	75%	0.748	81%	0.806	S	S	*	*			trans	-67.9	112.5	171.2	153.7	0	0	0	0	109.7
10	W	32	Very low	33.1	Very low	254 Å²	254	162 Å²	162	96%	0.962	81%	0.811	S	S	*	*			trans	-139.3	126.9	150.7	-72.3	93.5	0	0	0	110.1	G8	G8-W10 PolarHBondContact O-N 3.44Å
11	R	33.3	Very low	33.5	Very low	227 Å²	227	157.6 Å²	157.6	86%	0.857	80%	0.796	S	S	*	*			trans	-80.2	154.1	-175.1	-162.4	-179.1	-67.2	-113.4	1.3	109.4
12	S	35.8	Very low	34	Very low	93 Å²	93	155.3 Å²	155.3	65%	0.65	78%	0.782	S	S	*	*			trans	64.5	113.8	167.1	58.7	0	0	0	0	116
13	H	32.1	Very low	35.3	Very low	182 Å²	182	153.7 Å²	153.7	84%	0.843	78%	0.783	S	S	*	*				-177.1	83	114.3	-89	84.9	0	0	0	105.5
14	L	36.8	Very low	36.8	Very low	162 Å²	162	152.1 Å²	152.1	85%	0.848	79%	0.785	S	S	*	*			trans	-60.4	140.7	158	-78	163.1	0	0	0	106.6	R16	L14-R16 PolarHBondContact O-N 2.8Å
15	P	35.1	Very low	38.7	Very low	114 Å²	114	153 Å²	153	74%	0.74	78%	0.782	S	S	*	*			trans	-56.1	120.4	167.9	-10.5	23.7	0	0	0	106	Q17	P15-Q17 VanDerWaalsContact C-N 3.28Å; P15-Q17 PolarHBondContact O-N 2.92Å
16	R	34.8	Very low	41.3	Very low	232 Å²	232	148.3 Å²	148.3	88%	0.875	77%	0.771	S	S	*	*			trans	-56.2	100.7	170.1	-166.3	179.1	-171.7	-162.2	1.8	105.2	L14 S18	L14-R16 PolarHBondContact O-N 2.8Å; R16-S18 PolarHBondContact O-N 3.48Å
17	Q	36.2	Very low	44.2	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	75%	0.746	S	S	*	*			trans	-49.5	117.8	163.7	-85.3	174.1	-26.8	0	0	104.8	P15 V19	P15-Q17 VanDerWaalsContact C-N 3.28Å; P15-Q17 PolarHBondContact O-N 2.92Å; Q17-V19 PolarHBondContact O-N 3.35Å
18	S	40.3	Very low	47.2	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	73%	0.729	S	S	*	*			trans	-50	117.1	169.7	39.9	0	0	0	0	106.5	R16 E20	R16-S18 PolarHBondContact O-N 3.48Å; S18-E20 PolarHBondContact O-N 3.42Å
19	V	41.4	Very low	50.2	Low	109 Å²	109	138.6 Å²	138.6	66%	0.661	70%	0.701	S	S	*	*			trans	-63.9	85.4	168.6	175.1	0	0	0	0	105.6	Q17 S21	Q17-V19 PolarHBondContact O-N 3.35Å; V19-S21 WeakPolarHBondContact CG1-OG 3.39Å; V19-S21 PolarHBondContact O-N 3.29Å; V19-S21 VanDerWaalsContact O-N 3.11Å
20	E	41.5	Very low	53	Low	192 Å²	192	136.1 Å²	136.1	90%	0.897	68%	0.679	S	S	*	*			trans	-77.2	73.1	157.9	-83	178.6	163.9	0	0	106.2	S18	S18-E20 PolarHBondContact O-N 3.42Å
21	S	40.8	Very low	56.1	Low	70 Å²	70	124.2 Å²	124.2	49%	0.49	63%	0.634	S	S	.	*			trans	-125.2	120.3	171.3	73.4	0	0	0	0	109.3	V19	V19-S21 WeakPolarHBondContact CG1-OG 3.39Å; V19-S21 PolarHBondContact O-N 3.29Å; V19-S21 VanDerWaalsContact O-N 3.11Å
22	E	44.2	Very low	59	Low	187 Å²	187	116.1 Å²	116.1	87%	0.874	61%	0.605	S	S	*	*			trans	81.5	64.2	152.6	-55.6	177.4	-176.3	0	0	118.1
23	V	50.8	Low	61.9	Low	127 Å²	127	111.7 Å²	111.7	77%	0.77	57%	0.574	S	S	*	*			trans	-120	22.2	158.1	-161.2	0	0	0	0	112.2
24	E	55.3	Low	64.9	Low	187 Å²	187	103.1 Å²	103.1	87%	0.874	53%	0.534	S	S	*	.	S	Bend	trans	-96.6	-0.6	-178.2	-94.2	-164.6	158.2	0	0	116.1
25	D	64.6	Low	67.7	Low	125 Å²	125	95.4 Å²	95.4	67%	0.668	49%	0.494	S	S	*	.			trans	-108.1	2.7	-173.2	-108.8	-31.6	0	0	0	116.6	F27 K80	D25-F27 WeakPolarHBondContact O-CD1 3.48Å; D25-F27 PolarHBondContact O-N 2.99Å; D25-K80 IonicContact OD1-NZ 2.8Å; D25-K80 PolarHBondContact OD1-NZ 3.01Å
26	S	84.9	Confident	70.5	Confident	76 Å²	76	90 Å²	90	53%	0.531	46%	0.459	S	S	.	.			trans	-77.9	122.1	172.4	71	0	0	0	0	110.8	K78	S26-K78 WeakPolarHBondContact O-CD 3.23Å
27	F	90.9	Very high	73.3	Confident	77 Å²	77	79 Å²	79	34%	0.338	42%	0.417	S	S	.	.			trans	-128.4	147.5	171.3	58.9	-88.3	0	0	0	108.8	D25 F29 L30 K78 K80	D25-F27 WeakPolarHBondContact O-CD1 3.48Å; D25-F27 PolarHBondContact O-N 2.99Å; F27-F29 WeakPolarHBondContact CD2-O 3.25Å; F27-L30 HydrophobicContact CD2-CB 4.06Å; F27-L30 HydrophobicContact CE2-CB 3.57Å; F27-L30 HydrophobicContact CE2-CD1 4.03Å; F27-L30 HydrophobicContact CE2-CG 4.45Å; F27-L30 HydrophobicContact CZ-CB 4.33Å; F27-L30 HydrophobicContact CZ-CD1 3.94Å; F27-K78 HydrophobicContact CB-CB 4.48Å; F27-K80 HydrophobicContact CB-CB 3.93Å; F27-K80 HydrophobicContact CD1-CB 4.22Å; F27-K80 HydrophobicContact CD1-CD 3.68Å; F27-K80 VanDerWaalsContact CD1-NZ 3.26Å; F27-K80 HydrophobicContact CD2-CB 4.05Å; F27-K80 HydrophobicContact CE1-CD 3.79Å; F27-K80 HydrophobicContact CG-CB 3.78Å; F27-K80 HydrophobicContact CG-CD 4.14Å; F27-K80 HydrophobicContact CZ-CD 4.35Å
28	D	93.1	Very high	76	Confident	82 Å²	82	72 Å²	72	44%	0.439	39%	0.386	S	S	.	.	S	Bend	trans	-82.8	-35.1	178.1	-62.5	-79.2	0	0	0	111.4	K77 K78	D28-K77 HydrophobicContact CB-CB 4.47Å; D28-K77 HydrophobicContact CB-CD 4.25Å; D28-K77 WeakPolarHBondContact OD2-CA 3.48Å; D28-K78 PolarHBondContact N-O 3.21Å; D28-K78 PolarHBondContact OD2-N 3.13Å
29	F	94.7	Very high	78.5	Confident	33 Å²	33	69 Å²	69	15%	0.145	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	146.9	-176.3	-65	-90.9	0	0	0	111.4	F27 F31 K77 K78 V79 K80 L193	F27-F29 WeakPolarHBondContact CD2-O 3.25Å; F29-F31 HydrophobicContact CB-CE2 3.96Å; F29-F31 HydrophobicContact CB-CZ 3.94Å; F29-F31 HydrophobicContact CD1-CZ 4.04Å; F29-F31 HydrophobicContact CG-CZ 4.24Å; F29-K77 HydrophobicContact CE2-CD 4.34Å; F29-K77 HydrophobicContact CE2-CG 4.37Å; F29-K78 PolarHBondContact N-O 3.21Å; F29-V79 HydrophobicContact CB-CG1 4.5Å; F29-V79 HydrophobicContact CB-CG2 4.48Å; F29-K80 PolarHBondContact O-N 3.11Å; F29-L193 HydrophobicContact CB-CD2 3.98Å; F29-L193 HydrophobicContact CD1-CD2 3.89Å; F29-L193 HydrophobicContact CD2-CD2 3.19Å; F29-L193 HydrophobicContact CE1-CD2 4.16Å; F29-L193 HydrophobicContact CE2-CD2 3.54Å; F29-L193 HydrophobicContact CG-CD2 3.4Å; F29-L193 HydrophobicContact CZ-CD2 4.01Å
30	L	95.1	Very high	80.9	Confident	54 Å²	54	68.8 Å²	68.8	28%	0.283	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.2	173.5	179.9	151.2	0	0	0	109.5	F27 K32 K80 Q82	F27-L30 HydrophobicContact CD2-CB 4.06Å; F27-L30 HydrophobicContact CE2-CB 3.57Å; F27-L30 HydrophobicContact CE2-CD1 4.03Å; F27-L30 HydrophobicContact CE2-CG 4.45Å; F27-L30 HydrophobicContact CZ-CB 4.33Å; F27-L30 HydrophobicContact CZ-CD1 3.94Å; L30-K32 HydrophobicContact CD2-CG 4.26Å; L30-K80 WeakPolarHBondContact CA-O 3.4Å; L30-K80 HydrophobicContact CD1-CD 4.33Å; L30-Q82 HydrophobicContact CD2-CG 4.49Å; L30-Q82 HydrophobicContact CG-CG 4.39Å
31	F	96.5	Very high	83.5	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.7	179.2	-64	-47.9	0	0	0	111.5	F29 I33 V79 K80 M81 Q82 H104 L192 L193 N196	F29-F31 HydrophobicContact CB-CE2 3.96Å; F29-F31 HydrophobicContact CB-CZ 3.94Å; F29-F31 HydrophobicContact CD1-CZ 4.04Å; F29-F31 HydrophobicContact CG-CZ 4.24Å; F31-I33 HydrophobicContact CB-CD1 4.36Å; F31-V79 HydrophobicContact CD2-CG1 3.49Å; F31-V79 VanDerWaalsContact CD2-CG1 3.49Å; F31-V79 HydrophobicContact CE2-CG1 3.83Å; F31-K80 PolarHBondContact N-O 2.91Å; F31-M81 HydrophobicContact CB-CE 3.81Å; F31-M81 HydrophobicContact CB-SD 4.18Å; F31-M81 HydrophobicContact CD2-SD 4.3Å; F31-Q82 PolarHBondContact O-N 2.71Å; F31-H104 HydrophobicContact CB-CB 4.46Å; F31-H104 HydrophobicContact CD1-CB 4.19Å; F31-H104 AromaticContact CD1-CD2 3.99Å; F31-L192 HydrophobicContact CB-CD1 3.79Å; F31-L192 HydrophobicContact CD1-CB 4.01Å; F31-L192 HydrophobicContact CD1-CD1 4.11Å; F31-L192 HydrophobicContact CD2-CB 3.73Å; F31-L192 HydrophobicContact CD2-CD1 4.01Å; F31-L192 HydrophobicContact CE1-CB 3.86Å; F31-L192 HydrophobicContact CE2-CB 3.57Å; F31-L192 HydrophobicContact CG-CB 3.96Å; F31-L192 HydrophobicContact CG-CD1 3.7Å; F31-L192 HydrophobicContact CG-CG 4.45Å; F31-L192 HydrophobicContact CZ-CB 3.64Å; F31-L193 HydrophobicContact CE2-CD2 3.93Å; F31-L193 HydrophobicContact CE2-CG 4.04Å; F31-L193 HydrophobicContact CZ-CD2 4.12Å; F31-L193 HydrophobicContact CZ-CG 4.49Å; F31-N196 HydrophobicContact CE1-CB 4.24Å; F31-N196 WeakPolarHBondContact CE1-ND2 3.37Å; F31-N196 HydrophobicContact CZ-CB 4.34Å
32	K	95.1	Very high	86	Confident	58 Å²	58	56.9 Å²	56.9	25%	0.252	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.8	174.5	-65.1	173.2	175.3	177	0	109.8	L30 Q82 S102 H104 G105	L30-K32 HydrophobicContact CD2-CG 4.26Å; K32-Q82 CarbonylContact C-O 3.53Å; K32-Q82 WeakPolarHBondContact CA-O 3.49Å; K32-Q82 HydrophobicContact CG-CB 4.27Å; K32-S102 WeakPolarHBondContact CD-O 3.25Å; K32-S102 WeakPolarHBondContact CD-OG 3.43Å; K32-S102 PolarHBondContact NZ-OG 2.83Å; K32-H104 PolarHBondContact N-ND1 2.96Å; K32-H104 PolarHBondContact O-N 2.74Å; K32-G105 PolarHBondContact O-N 2.89Å
33	I	96.3	Very high	88.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134	178.2	-51.1	-48.6	0	0	0	109.1	F31 M81 Q82 V83 W84 G105 M107 M188 L192	F31-I33 HydrophobicContact CB-CD1 4.36Å; I33-M81 HydrophobicContact CB-CE 4.45Å; I33-M81 HydrophobicContact CD1-CE 3.53Å; I33-M81 HydrophobicContact CG1-CE 3.07Å; I33-Q82 PolarHBondContact N-O 3.27Å; I33-V83 CarbonylContact O-C 3.42Å; I33-V83 WeakPolarHBondContact O-CA 3.39Å; I33-W84 PolarHBondContact O-N 3.08Å; I33-G105 VanDerWaalsContact CA-O 3.3Å; I33-G105 WeakPolarHBondContact CA-O 3.31Å; I33-M107 HydrophobicContact CG2-CG 4.2Å; I33-M188 HydrophobicContact CB-SD 4.18Å; I33-M188 HydrophobicContact CD1-CG 3.89Å; I33-M188 HydrophobicContact CD1-SD 3.32Å; I33-M188 WeakPolarHBondContact CD1-SD 3.47Å; I33-M188 HydrophobicContact CG1-SD 3.7Å; I33-M188 HydrophobicContact CG2-CE 4.42Å; I33-M188 HydrophobicContact CG2-SD 3.42Å; I33-M188 WeakPolarHBondContact CG2-SD 3.35Å; I33-L192 HydrophobicContact CD1-CD1 3.65Å
34	I	94.7	Very high	90.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	137.9	169.7	59.9	173.3	0	0	0	109.5	V36 W84 Y100 A103 G105 A106 M107 V128	I34-V36 HydrophobicContact CD1-CG1 4.37Å; I34-W84 HydrophobicContact CG2-CB 4.19Å; I34-Y100 HydrophobicContact CD1-CD1 3.21Å; I34-Y100 HydrophobicContact CD1-CE1 3.48Å; I34-Y100 VanDerWaalsContact CD1-CE1 3.48Å; I34-Y100 HydrophobicContact CD1-CG 3.9Å; I34-A103 HydrophobicContact CD1-CB 4.09Å; I34-A103 HydrophobicContact CG1-CB 4.05Å; I34-A103 HydrophobicContact CG2-CB 3.89Å; I34-G105 PolarHBondContact N-O 2.82Å; I34-A106 HydrophobicContact CD1-CB 3.98Å; I34-A106 HydrophobicContact CG1-CB 3.59Å; I34-A106 CarbonylContact O-C 3.59Å; I34-A106 WeakPolarHBondContact O-CA 3.45Å; I34-M107 PolarHBondContact O-N 3.48Å; I34-V128 HydrophobicContact CD1-CG2 4.22Å
35	L	94.6	Very high	92.4	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.9	175.1	-175	62.5	0	0	0	108.6	K43 V47 W84 T86 M107 A109	L35-K43 HydrophobicContact CD1-CG 4.45Å; L35-K43 HydrophobicContact CD2-CB 3.53Å; L35-K43 HydrophobicContact CD2-CG 4.12Å; L35-K43 WeakPolarHBondContact CD2-O 3.49Å; L35-K43 HydrophobicContact CG-CB 3.8Å; L35-K43 HydrophobicContact CG-CD 4Å; L35-K43 HydrophobicContact CG-CG 3.87Å; L35-V47 HydrophobicContact CD2-CG2 3.42Å; L35-V47 VanDerWaalsContact CD2-CG2 3.42Å; L35-W84 PolarHBondContact N-O 3.28Å; L35-T86 PolarHBondContact O-N 3.32Å; L35-T86 PolarHBondContact O-OG1 3.42Å; L35-M107 HydrophobicContact CD1-CB 3.44Å; L35-M107 VanDerWaalsContact CD1-CB 3.44Å; L35-A109 HydrophobicContact CD1-CB 4.3Å
36	V	94.3	Very high	93.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	162.3	-173.1	-58.3	0	0	0	0	110.8	I34 Y100 M107 V108 A109 W124 V128	I34-V36 HydrophobicContact CD1-CG1 4.37Å; V36-Y100 HydrophobicContact CG1-CE1 4.05Å; V36-Y100 VanDerWaalsContact CG1-OH 3.31Å; V36-Y100 WeakPolarHBondContact CG1-OH 3.42Å; V36-M107 PolarHBondContact N-O 2.95Å; V36-V108 HydrophobicContact CG2-CB 4.28Å; V36-V108 HydrophobicContact CG2-CG1 4.41Å; V36-V108 HydrophobicContact CG2-CG2 3.77Å; V36-A109 PolarHBondContact O-N 2.96Å; V36-W124 HydrophobicContact CB-CE3 4.08Å; V36-W124 HydrophobicContact CG2-CB 4.3Å; V36-V128 HydrophobicContact CG2-CG2 3.99Å
37	G	94.5	Very high	94.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.			trans	140.4	170.2	-175.5	0	0	0	0	0	111.8	K43 G88 A109 W124	G37-K43 PolarHBondContact O-NZ 3.27Å; G37-G88 WeakPolarHBondContact O-CA 3.4Å; G37-A109 WeakPolarHBondContact CA-O 3.25Å; G37-W124 VanDerWaalsContact C-CE2 3.48Å; G37-W124 VanDerWaalsContact C-CZ2 3.5Å; G37-W124 WeakPolarHBondContact O-CZ2 3.27Å
38	D	93.3	Very high	94.5	Very high	30 Å²	30	24.4 Å²	24.4	16%	0.16	13%	0.131	C	C	.	.	S	Bend	trans	-60.8	163.7	-177.2	-74.4	9.3	0	0	0	112.7	V41 K43 T117 S120 W124	D38-V41 HydrophobicContact CB-CG1 3.9Å; D38-V41 WeakPolarHBondContact O-CG1 3.37Å; D38-V41 VanDerWaalsContact O-CG2 3.25Å; D38-V41 WeakPolarHBondContact O-CG2 3.42Å; D38-K43 PolarHBondContact O-NZ 2.93Å; D38-T117 HydrophobicContact CB-CG2 4.02Å; D38-T117 WeakPolarHBondContact OD2-CA 3.48Å; D38-S120 WeakPolarHBondContact OD1-CB 3.26Å; D38-S120 PolarHBondContact OD1-OG 3.13Å; D38-S120 WeakPolarHBondContact OD2-CB 3.17Å; D38-S120 PolarHBondContact OD2-OG 2.97Å; D38-W124 PolarHBondContact OD1-NE1 2.66Å
39	S	91.3	Very high	94.6	Very high	35 Å²	35	22.6 Å²	22.6	25%	0.245	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	147.2	170.3	-84	0	0	0	0	112.3	V41 G88 Q89 R114	S39-V41 PolarHBondContact O-N 2.86Å; S39-V41 VanDerWaalsContact O-N 3.1Å; S39-G88 PolarHBondContact N-O 2.83Å; S39-G88 PolarHBondContact OG-O 3.2Å; S39-Q89 VanDerWaalsContact OG-CG 3.26Å; S39-Q89 WeakPolarHBondContact OG-CG 3.18Å; S39-Q89 PolarHBondContact OG-N 3.07Å; S39-R114 PolarHBondContact O-NH1 2.82Å
40	D	92	Very high	94.6	Very high	105 Å²	105	21.1 Å²	21.1	56%	0.561	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	13.7	176.3	-168.8	42.4	0	0	0	115.4	G42 R114 K144	D40-G42 PolarHBondContact O-N 3.35Å; D40-R114 PolarHBondContact O-NH2 3.49Å; D40-K144 VanDerWaalsContact O-CE 3.22Å; D40-K144 WeakPolarHBondContact O-CE 3.3Å; D40-K144 PolarHBondContact O-NZ 3Å; D40-K144 IonicContact OD2-NZ 2.8Å
41	V	95.6	Very high	94.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-72.6	-11.4	171	-56.2	0	0	0	0	112.8	D38 S39 K43 A109 D111 T117 N143	D38-V41 HydrophobicContact CB-CG1 3.9Å; D38-V41 WeakPolarHBondContact O-CG1 3.37Å; D38-V41 VanDerWaalsContact O-CG2 3.25Å; D38-V41 WeakPolarHBondContact O-CG2 3.42Å; S39-V41 PolarHBondContact O-N 2.86Å; S39-V41 VanDerWaalsContact O-N 3.1Å; V41-K43 HydrophobicContact CG2-CD 4.25Å; V41-K43 HydrophobicContact CG2-CG 3.6Å; V41-A109 HydrophobicContact CG2-CB 3.87Å; V41-D111 HydrophobicContact CB-CB 4.36Å; V41-D111 HydrophobicContact CG1-CB 4.23Å; V41-T117 HydrophobicContact CG1-CG2 3.79Å; V41-N143 PolarHBondContact O-ND2 3.02Å
42	G	94.7	Very high	94	Very high	12 Å²	12	26.8 Å²	26.8	12%	0.124	14%	0.142	C	C	.	.	S	Bend	trans	95.8	23.7	175.3	0	0	0	0	0	115.6	D40 C45 M46	D40-G42 PolarHBondContact O-N 3.35Å; G42-C45 WeakPolarHBondContact O-CB 3.44Å; G42-C45 PolarHBondContact O-N 2.85Å; G42-M46 WeakPolarHBondContact O-CG 3.39Å; G42-M46 PolarHBondContact O-N 3.2Å
43	K	94.9	Very high	93.4	Very high	10 Å²	10	26.1 Å²	26.1	4%	0.043	15%	0.152	C	C	.	.	H	α-helix	trans	-51.7	-56.3	177.1	-63.6	-171.6	-59.6	-77.6	0	112.8	L35 G37 D38 V41 C45 M46 V47 D85 T86 G88 A109	L35-K43 HydrophobicContact CD1-CG 4.45Å; L35-K43 HydrophobicContact CD2-CB 3.53Å; L35-K43 HydrophobicContact CD2-CG 4.12Å; L35-K43 WeakPolarHBondContact CD2-O 3.49Å; L35-K43 HydrophobicContact CG-CB 3.8Å; L35-K43 HydrophobicContact CG-CD 4Å; L35-K43 HydrophobicContact CG-CG 3.87Å; G37-K43 PolarHBondContact O-NZ 3.27Å; D38-K43 PolarHBondContact O-NZ 2.93Å; V41-K43 HydrophobicContact CG2-CD 4.25Å; V41-K43 HydrophobicContact CG2-CG 3.6Å; K43-C45 VanDerWaalsContact C-N 3.29Å; K43-C45 PolarHBondContact O-N 3.44Å; K43-M46 WeakPolarHBondContact O-CB 3.23Å; K43-M46 PolarHBondContact O-N 2.91Å; K43-V47 PolarHBondContact O-N 2.86Å; K43-D85 VanDerWaalsContact CB-OD1 3.25Å; K43-D85 WeakPolarHBondContact CB-OD1 3.39Å; K43-T86 WeakPolarHBondContact CE-O 3.21Å; K43-G88 VanDerWaalsContact NZ-CA 3.32Å; K43-A109 HydrophobicContact CG-CB 4.04Å
44	T	94.2	Very high	92.7	Very high	21 Å²	21	30.7 Å²	30.7	13%	0.129	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-40.9	177	-45.9	0	0	0	0	112.4	M46 V47 Q48 T62 D85	T44-M46 VanDerWaalsContact C-N 3.33Å; T44-M46 PolarHBondContact O-N 2.9Å; T44-V47 PolarHBondContact O-N 3.07Å; T44-Q48 HydrophobicContact CG2-CG 4.47Å; T44-Q48 WeakPolarHBondContact O-CB 3.44Å; T44-Q48 VanDerWaalsContact O-CG 3.3Å; T44-Q48 WeakPolarHBondContact O-CG 3.36Å; T44-Q48 PolarHBondContact O-N 3.11Å; T44-T62 PolarHBondContact OG1-OG1 3.27Å; T44-D85 VanDerWaalsContact CA-OD2 3.25Å; T44-D85 WeakPolarHBondContact CA-OD2 3.48Å; T44-D85 VanDerWaalsContact CB-OD2 3.22Å; T44-D85 WeakPolarHBondContact CB-OD2 3.22Å; T44-D85 WeakPolarHBondContact CG2-OD2 3.41Å; T44-D85 PolarHBondContact N-OD1 3.04Å; T44-D85 PolarHBondContact OG1-OD2 2.8Å
45	C	95.3	Very high	92.1	Very high	17 Å²	17	33.7 Å²	33.7	12%	0.115	19%	0.188	C	C	.	.	H	α-helix	trans	-64.5	-37.6	176.8	-58.3	0	0	0	0	111.9	G42 K43 R49 F55 A175	G42-C45 WeakPolarHBondContact O-CB 3.44Å; G42-C45 PolarHBondContact O-N 2.85Å; K43-C45 VanDerWaalsContact C-N 3.29Å; K43-C45 PolarHBondContact O-N 3.44Å; C45-R49 WeakPolarHBondContact O-CB 3.2Å; C45-R49 PolarHBondContact O-N 3.41Å; C45-F55 HydrophobicContact CB-CD2 4.19Å; C45-F55 HydrophobicContact CB-CE2 4.08Å; C45-A175 HydrophobicContact CB-CB 3.7Å
46	M	96.3	Very high	91.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-46.5	174.4	-67.2	169.7	58.2	0	0	111.2	G42 K43 T44 R49 F50 A109 V141 N143 A175 I181	G42-M46 WeakPolarHBondContact O-CG 3.39Å; G42-M46 PolarHBondContact O-N 3.2Å; K43-M46 WeakPolarHBondContact O-CB 3.23Å; K43-M46 PolarHBondContact O-N 2.91Å; T44-M46 VanDerWaalsContact C-N 3.33Å; T44-M46 PolarHBondContact O-N 2.9Å; M46-R49 PolarHBondContact O-N 3.02Å; M46-F50 VanDerWaalsContact O-CB 3.3Å; M46-F50 WeakPolarHBondContact O-CB 3.36Å; M46-F50 PolarHBondContact O-N 2.92Å; M46-A109 HydrophobicContact SD-CB 4.41Å; M46-V141 HydrophobicContact CE-CB 4.23Å; M46-V141 HydrophobicContact CE-CG1 3.57Å; M46-V141 HydrophobicContact CE-CG2 4.38Å; M46-V141 HydrophobicContact SD-CG1 4.2Å; M46-N143 HydrophobicContact SD-CB 4.08Å; M46-A175 HydrophobicContact CG-CB 4.27Å; M46-I181 HydrophobicContact CB-CD1 4.11Å; M46-I181 HydrophobicContact CG-CD1 3.82Å
47	V	94.9	Very high	90.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-43	179.5	178.5	0	0	0	0	111.3	L35 K43 T44 F50 K51 T68 V83 D85	L35-V47 HydrophobicContact CD2-CG2 3.42Å; L35-V47 VanDerWaalsContact CD2-CG2 3.42Å; K43-V47 PolarHBondContact O-N 2.86Å; T44-V47 PolarHBondContact O-N 3.07Å; V47-F50 PolarHBondContact O-N 3.09Å; V47-K51 WeakPolarHBondContact O-CB 3.38Å; V47-K51 PolarHBondContact O-N 3.31Å; V47-T68 HydrophobicContact CG1-CG2 3.89Å; V47-V83 HydrophobicContact CG1-CG1 4.34Å; V47-V83 HydrophobicContact CG2-CG1 3.78Å; V47-D85 HydrophobicContact CG2-CB 4.17Å
48	Q	93.4	Very high	89.9	Confident	47 Å²	47	53.8 Å²	53.8	22%	0.22	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-44.7	175.2	-74.4	177.7	-2.8	0	0	111.6	T44 F50 K51 S52 Q59	T44-Q48 HydrophobicContact CG2-CG 4.47Å; T44-Q48 WeakPolarHBondContact O-CB 3.44Å; T44-Q48 VanDerWaalsContact O-CG 3.3Å; T44-Q48 WeakPolarHBondContact O-CG 3.36Å; T44-Q48 PolarHBondContact O-N 3.11Å; Q48-F50 VanDerWaalsContact C-N 3.28Å; Q48-F50 PolarHBondContact O-N 3.17Å; Q48-K51 PolarHBondContact O-N 2.89Å; Q48-K51 VanDerWaalsContact O-N 3.1Å; Q48-S52 PolarHBondContact O-N 3.33Å; Q48-S52 PolarHBondContact O-OG 3.36Å; Q48-S52 VanDerWaalsContact O-OG 3.05Å; Q48-Q59 VanDerWaalsContact CD-NE2 3.31Å
49	R	95.2	Very high	89.1	Confident	45 Å²	45	55.2 Å²	55.2	17%	0.17	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-41.7	177.2	-178.3	60.9	73.4	159.9	23.2	111.1	C45 M46 G53 F55 A175 K176 A178 I181	C45-R49 WeakPolarHBondContact O-CB 3.2Å; C45-R49 PolarHBondContact O-N 3.41Å; M46-R49 PolarHBondContact O-N 3.02Å; R49-G53 PolarHBondContact NH1-O 3.48Å; R49-G53 WeakPolarHBondContact O-CA 3.37Å; R49-G53 PolarHBondContact O-N 3.03Å; R49-F55 VanDerWaalsContact CZ-CB 3.41Å; R49-A175 VanDerWaalsContact CZ-O 3.31Å; R49-A175 PolarHBondContact NE-O 2.89Å; R49-A175 PolarHBondContact NH2-O 3.12Å; R49-K176 PolarHBondContact NH2-O 2.94Å; R49-A178 HydrophobicContact CG-CB 4.1Å; R49-I181 HydrophobicContact CB-CG2 4.33Å; R49-I181 HydrophobicContact CG-CB 4.35Å; R49-I181 HydrophobicContact CG-CG1 4.01Å; R49-I181 HydrophobicContact CG-CG2 4.18Å
50	F	94.4	Very high	88.6	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-40.4	173.8	176.4	-113.8	0	0	0	111.8	M46 V47 Q48 R70 M72 V83 I181 F185	M46-F50 VanDerWaalsContact O-CB 3.3Å; M46-F50 WeakPolarHBondContact O-CB 3.36Å; M46-F50 PolarHBondContact O-N 2.92Å; V47-F50 PolarHBondContact O-N 3.09Å; Q48-F50 VanDerWaalsContact C-N 3.28Å; Q48-F50 PolarHBondContact O-N 3.17Å; F50-R70 HydrophobicContact CD1-CB 4.44Å; F50-R70 HydrophobicContact CE1-CB 3.72Å; F50-R70 HydrophobicContact CE1-CG 4.19Å; F50-R70 HydrophobicContact CZ-CB 4.11Å; F50-R70 HydrophobicContact CZ-CG 4.15Å; F50-R70 WeakPolarHBondContact O-CD 3.38Å; F50-R70 VanDerWaalsContact O-CZ 3.26Å; F50-R70 PolarHBondContact O-NE 3.11Å; F50-R70 PolarHBondContact O-NH1 3.22Å; F50-M72 HydrophobicContact CE2-CE 3.89Å; F50-M72 HydrophobicContact CE2-CG 4.38Å; F50-M72 HydrophobicContact CE2-SD 3.69Å; F50-M72 HydrophobicContact CZ-CE 4.33Å; F50-M72 HydrophobicContact CZ-CG 4.03Å; F50-M72 HydrophobicContact CZ-SD 3.51Å; F50-M72 VanDerWaalsContact CZ-SD 3.51Å; F50-V83 HydrophobicContact CE1-CG2 4.41Å; F50-I181 HydrophobicContact CB-CG2 3.81Å; F50-F185 HydrophobicContact CB-CD2 3.91Å; F50-F185 HydrophobicContact CB-CE2 3.59Å; F50-F185 HydrophobicContact CB-CZ 4.22Å; F50-F185 HydrophobicContact CD1-CD1 4.15Å; F50-F185 HydrophobicContact CD1-CD2 4.03Å; F50-F185 HydrophobicContact CD1-CE1 4.1Å; F50-F185 AromaticContact CD1-CE2 4Å; F50-F185 HydrophobicContact CD1-CE2 4Å; F50-F185 HydrophobicContact CD1-CG 4.13Å; F50-F185 HydrophobicContact CD1-CZ 4.03Å; F50-F185 HydrophobicContact CD2-CB 3.94Å; F50-F185 HydrophobicContact CD2-CD1 4.45Å; F50-F185 AromaticContact CD2-CD2 3.3Å; F50-F185 HydrophobicContact CD2-CD2 3.3Å; F50-F185 AromaticContact CD2-CE2 3.9Å; F50-F185 HydrophobicContact CD2-CE2 3.9Å; F50-F185 AromaticContact CD2-CG 3.64Å; F50-F185 HydrophobicContact CD2-CG 3.64Å; F50-F185 AromaticContact CE1-CD1 3.95Å; F50-F185 HydrophobicContact CE1-CD1 3.95Å; F50-F185 HydrophobicContact CE1-CD2 4.4Å; F50-F185 HydrophobicContact CE1-CE1 4.24Å; F50-F185 HydrophobicContact CE1-CG 4.04Å; F50-F185 HydrophobicContact CE2-CB 3.45Å; F50-F185 VanDerWaalsContact CE2-CB 3.45Å; F50-F185 HydrophobicContact CE2-CD1 4.28Å; F50-F185 AromaticContact CE2-CD2 3.76Å; F50-F185 HydrophobicContact CE2-CD2 3.76Å; F50-F185 AromaticContact CE2-CG 3.57Å; F50-F185 HydrophobicContact CE2-CG 3.57Å; F50-F185 HydrophobicContact CG-CD1 4.4Å; F50-F185 AromaticContact CG-CD2 3.47Å; F50-F185 HydrophobicContact CG-CD2 3.47Å; F50-F185 VanDerWaalsContact CG-CD2 3.47Å; F50-F185 HydrophobicContact CG-CE1 4.46Å; F50-F185 AromaticContact CG-CE2 3.56Å; F50-F185 HydrophobicContact CG-CE2 3.56Å; F50-F185 AromaticContact CG-CG 3.94Å; F50-F185 HydrophobicContact CG-CG 3.94Å; F50-F185 HydrophobicContact CG-CZ 4.07Å; F50-F185 HydrophobicContact CZ-CB 3.81Å; F50-F185 HydrophobicContact CZ-CD1 4.03Å; F50-F185 HydrophobicContact CZ-CD2 4.28Å; F50-F185 AromaticContact CZ-CG 3.78Å; F50-F185 HydrophobicContact CZ-CG 3.78Å
51	K	92	Very high	88.1	Confident	113 Å²	113	61.6 Å²	61.6	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-73.1	-52.3	-176.4	-171.4	-175.8	-168.8	167	0	113.4	V47 Q48 T68	V47-K51 WeakPolarHBondContact O-CB 3.38Å; V47-K51 PolarHBondContact O-N 3.31Å; Q48-K51 PolarHBondContact O-N 2.89Å; Q48-K51 VanDerWaalsContact O-N 3.1Å; K51-T68 HydrophobicContact CB-CG2 3.92Å; K51-T68 HydrophobicContact CD-CG2 3.6Å; K51-T68 HydrophobicContact CG-CG2 3.8Å
52	S	87.3	Confident	87.1	Confident	65 Å²	65	63.1 Å²	63.1	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-117.9	-5.5	-166.6	60.8	0	0	0	0	113.5	Q48 I54	Q48-S52 PolarHBondContact O-N 3.33Å; Q48-S52 PolarHBondContact O-OG 3.36Å; Q48-S52 VanDerWaalsContact O-OG 3.05Å; S52-I54 PolarHBondContact O-N 2.78Å; S52-I54 WeakPolarHBondContact OG-CB 3.42Å; S52-I54 PolarHBondContact OG-N 3.01Å
53	G	82.1	Confident	86.2	Confident	43 Å²	43	69.5 Å²	69.5	44%	0.443	35%	0.351	S	S	.	.	S	Bend	trans	68	10.1	-171.4	0	0	0	0	0	113.1	R49	R49-G53 PolarHBondContact NH1-O 3.48Å; R49-G53 WeakPolarHBondContact O-CA 3.37Å; R49-G53 PolarHBondContact O-N 3.03Å
54	I	81.3	Confident	85.2	Confident	97 Å²	97	69.7 Å²	69.7	50%	0.497	36%	0.357	S	S	.	.			trans	-101.9	145.8	-177.7	-58.6	169.1	0	0	0	109.9	S52 I56	S52-I54 PolarHBondContact O-N 2.78Å; S52-I54 WeakPolarHBondContact OG-CB 3.42Å; S52-I54 PolarHBondContact OG-N 3.01Å; I54-I56 HydrophobicContact CG2-CG1 4.3Å
55	F	82.5	Confident	84.6	Confident	63 Å²	63	70.3 Å²	70.3	28%	0.276	36%	0.36	S	S	.	.			trans	-122.3	138.8	167.5	172.4	-96.8	0	0	0	110.3	C45 R49 E57 A175 K176	C45-F55 HydrophobicContact CB-CD2 4.19Å; C45-F55 HydrophobicContact CB-CE2 4.08Å; R49-F55 VanDerWaalsContact CZ-CB 3.41Å; F55-E57 HydrophobicContact CE1-CB 3.96Å; F55-E57 HydrophobicContact CE1-CG 4.4Å; F55-A175 HydrophobicContact CD2-CB 4.21Å; F55-A175 HydrophobicContact CE2-CB 4.37Å; F55-K176 HydrophobicContact CD1-CG 4.3Å; F55-K176 HydrophobicContact CE1-CB 4.19Å; F55-K176 HydrophobicContact CE1-CG 3.93Å; F55-K176 HydrophobicContact CE2-CB 4.17Å; F55-K176 HydrophobicContact CZ-CB 4Å; F55-K176 HydrophobicContact CZ-CG 4.2Å
56	I	82.4	Confident	84.3	Confident	81 Å²	81	73.2 Å²	73.2	42%	0.415	38%	0.375	S	S	.	.			trans	-121.2	119.8	177.9	-64.4	166.8	0	0	0	106.1	I54 Q59	I54-I56 HydrophobicContact CG2-CG1 4.3Å; I56-Q59 HydrophobicContact CB-CG 4.28Å; I56-Q59 VanDerWaalsContact CB-NE2 3.28Å; I56-Q59 VanDerWaalsContact CD1-NE2 3.32Å; I56-Q59 HydrophobicContact CG2-CG 4.41Å
57	E	76.9	Confident	83.9	Confident	153 Å²	153	77 Å²	77	72%	0.715	39%	0.391	S	S	*	.	S	Bend	trans	-69	-37.7	-172.3	-172.3	169.2	-148.8	0	0	112.8	F55 Q59	F55-E57 HydrophobicContact CE1-CB 3.96Å; F55-E57 HydrophobicContact CE1-CG 4.4Å; E57-Q59 PolarHBondContact O-N 3.29Å
58	K	77.5	Confident	83.8	Confident	190 Å²	190	77.1 Å²	77.1	83%	0.826	39%	0.392	S	S	*	.	S	Bend	trans	-101.9	68.6	178.5	-66	-176.1	-179	178.7	0	110.7
59	Q	77.8	Confident	83.9	Confident	59 Å²	59	77.5 Å²	77.5	28%	0.276	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-71.6	134.2	170.8	-83.6	-57.4	-21.9	0	0	111.2	Q48 I56 E57	Q48-Q59 VanDerWaalsContact CD-NE2 3.31Å; I56-Q59 HydrophobicContact CB-CG 4.28Å; I56-Q59 VanDerWaalsContact CB-NE2 3.28Å; I56-Q59 VanDerWaalsContact CD1-NE2 3.32Å; I56-Q59 HydrophobicContact CG2-CG 4.41Å; E57-Q59 PolarHBondContact O-N 3.29Å
60	Q	79.4	Confident	83.9	Confident	173 Å²	173	78.6 Å²	78.6	81%	0.808	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-74.6	151.9	171.4	-68.7	-172.9	-24.4	0	0	109.4	T62	Q60-T62 PolarHBondContact O-N 3.06Å
61	N	81.1	Confident	83.9	Confident	102 Å²	102	81.6 Å²	81.6	55%	0.545	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-59	131	174.5	-70.8	-30	0	0	0	110.2	I63	N61-I63 PolarHBondContact O-N 3Å
62	T	75.8	Confident	84	Confident	31 Å²	31	76.7 Å²	76.7	19%	0.19	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-60.7	128.5	173.5	-44	0	0	0	0	109.9	T44 Q60 A87	T44-T62 PolarHBondContact OG1-OG1 3.27Å; Q60-T62 PolarHBondContact O-N 3.06Å; T62-A87 WeakPolarHBondContact O-CB 3.32Å
63	I	75.2	Confident	84.4	Confident	146 Å²	146	79 Å²	79	75%	0.749	41%	0.406	S	S	*	.			trans	-101.4	113.4	172.3	-58.7	175.8	0	0	0	106.7	N61 F92	N61-I63 PolarHBondContact O-N 3Å; I63-F92 HydrophobicContact CG2-CZ 4.21Å
64	G	74.7	Confident	85	Confident	15 Å²	15	77.1 Å²	77.1	16%	0.155	39%	0.386	C	S	.	.	S	Bend	trans	77.9	-130	-177.2	0	0	0	0	0	113.1	A87	G64-A87 VanDerWaalsContact O-CB 3.23Å; G64-A87 WeakPolarHBondContact O-CB 3.4Å; G64-A87 PolarHBondContact O-N 2.86Å
65	V	81.9	Confident	85.5	Confident	34 Å²	34	78.1 Å²	78.1	21%	0.206	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.6	-176.1	-174	0	0	0	0	109.5	W84 D85 T86 T96 Y99	V65-W84 HydrophobicContact CG1-CB 4.1Å; V65-W84 HydrophobicContact CG1-CE3 3.67Å; V65-D85 CarbonylContact C-O 3.59Å; V65-D85 VanDerWaalsContact CA-O 3.27Å; V65-D85 WeakPolarHBondContact CA-O 3.37Å; V65-D85 WeakPolarHBondContact CG1-O 3.2Å; V65-T86 HydrophobicContact CG1-CG2 4.31Å; V65-T86 HydrophobicContact CG2-CG2 4.34Å; V65-T96 HydrophobicContact CG2-CG2 4.27Å; V65-Y99 HydrophobicContact CB-CD2 4.49Å; V65-Y99 HydrophobicContact CB-CE2 4.02Å; V65-Y99 HydrophobicContact CG1-CD2 4.4Å; V65-Y99 HydrophobicContact CG1-CE2 4.33Å; V65-Y99 HydrophobicContact CG2-CD2 3.87Å; V65-Y99 HydrophobicContact CG2-CE2 3.53Å
66	D	87.4	Confident	85.9	Confident	77 Å²	77	77.9 Å²	77.9	41%	0.412	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.9	172.5	-172.6	30.8	0	0	0	110.7	W84 D85	D66-W84 WeakPolarHBondContact O-CA 3.32Å; D66-D85 HydrophobicContact CB-CB 4.28Å; D66-D85 PolarHBondContact N-O 3.04Å; D66-D85 PolarHBondContact O-N 3.02Å
67	F	89.5	Confident	86.5	Confident	79 Å²	79	78.5 Å²	78.5	35%	0.346	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122	-175.3	177.8	-106.2	0	0	0	110.8	V69 Q82 W84	F67-V69 HydrophobicContact CD1-CG2 4.22Å; F67-V69 HydrophobicContact CE1-CG2 3.3Å; F67-V69 HydrophobicContact CE2-CG2 4.3Å; F67-V69 HydrophobicContact CZ-CG2 3.35Å; F67-Q82 HydrophobicContact CE2-CB 3.84Å; F67-Q82 HydrophobicContact CE2-CG 4.07Å; F67-Q82 HydrophobicContact CZ-CB 4.18Å; F67-Q82 HydrophobicContact CZ-CG 3.89Å; F67-W84 HydrophobicContact CB-CE3 4.27Å; F67-W84 HydrophobicContact CB-CZ3 4.17Å; F67-W84 AromaticContact CD2-CD2 3.82Å; F67-W84 HydrophobicContact CD2-CD2 3.82Å; F67-W84 AromaticContact CD2-CE2 3.67Å; F67-W84 AromaticContact CD2-CE3 3.98Å; F67-W84 HydrophobicContact CD2-CE3 3.98Å; F67-W84 HydrophobicContact CD2-CG 4.46Å; F67-W84 AromaticContact CD2-CH2 3.95Å; F67-W84 HydrophobicContact CD2-CH2 3.95Å; F67-W84 AromaticContact CD2-CZ2 3.76Å; F67-W84 HydrophobicContact CD2-CZ2 3.76Å; F67-W84 HydrophobicContact CD2-CZ3 4.03Å; F67-W84 HydrophobicContact CE2-CD2 4.47Å; F67-W84 AromaticContact CE2-CE2 3.89Å; F67-W84 HydrophobicContact CE2-CH2 4.42Å; F67-W84 AromaticContact CE2-CZ2 3.88Å; F67-W84 HydrophobicContact CE2-CZ2 3.88Å; F67-W84 HydrophobicContact CG-CH2 4.49Å; F67-W84 HydrophobicContact CG-CZ3 4.41Å
68	T	93	Very high	87.4	Confident	5 Å²	5	75.3 Å²	75.3	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.4	178.5	-79.6	0	0	0	0	110.8	V47 K51 V83	V47-T68 HydrophobicContact CG1-CG2 3.89Å; K51-T68 HydrophobicContact CB-CG2 3.92Å; K51-T68 HydrophobicContact CD-CG2 3.6Å; K51-T68 HydrophobicContact CG-CG2 3.8Å; T68-V83 PolarHBondContact N-O 3.43Å; T68-V83 PolarHBondContact O-N 2.8Å
69	V	94.5	Very high	88.3	Confident	55 Å²	55	66.3 Å²	66.3	33%	0.333	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.4	171.7	-171.2	0	0	0	0	109.5	F67 K80 M81 Q82	F67-V69 HydrophobicContact CD1-CG2 4.22Å; F67-V69 HydrophobicContact CE1-CG2 3.3Å; F67-V69 HydrophobicContact CE2-CG2 4.3Å; F67-V69 HydrophobicContact CZ-CG2 3.35Å; V69-K80 HydrophobicContact CG1-CD 4.04Å; V69-K80 HydrophobicContact CG1-CG 3.57Å; V69-M81 VanDerWaalsContact CA-O 3.29Å; V69-M81 WeakPolarHBondContact CA-O 3.38Å; V69-Q82 HydrophobicContact CG2-CG 4.15Å
70	R	94.3	Very high	89.1	Confident	68 Å²	68	64.8 Å²	64.8	26%	0.257	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	133.4	169.3	-177.5	170.8	174.6	-140.3	-13.8	109.7	F50 M81 E182	F50-R70 HydrophobicContact CD1-CB 4.44Å; F50-R70 HydrophobicContact CE1-CB 3.72Å; F50-R70 HydrophobicContact CE1-CG 4.19Å; F50-R70 HydrophobicContact CZ-CB 4.11Å; F50-R70 HydrophobicContact CZ-CG 4.15Å; F50-R70 WeakPolarHBondContact O-CD 3.38Å; F50-R70 VanDerWaalsContact O-CZ 3.26Å; F50-R70 PolarHBondContact O-NE 3.11Å; F50-R70 PolarHBondContact O-NH1 3.22Å; R70-M81 PolarHBondContact N-O 3.2Å; R70-M81 WeakPolarHBondContact O-CB 3.5Å; R70-M81 PolarHBondContact O-N 3.13Å; R70-E182 IonicContact CZ-OE1 3.48Å; R70-E182 IonicContact CZ-OE2 3.54Å; R70-E182 IonicContact NH1-OE1 3.38Å; R70-E182 PolarHBondContact NH1-OE1 2.87Å; R70-E182 IonicContact NH1-OE2 2.7Å; R70-E182 PolarHBondContact NH1-OE2 3.32Å; R70-E182 IonicContact NH2-OE1 2.79Å; R70-E182 PolarHBondContact NH2-OE1 2.81Å; R70-E182 IonicContact NH2-OE2 3.47Å; R70-E182 PolarHBondContact NH2-OE2 3Å
71	T	95.1	Very high	90	Very high	65 Å²	65	56.5 Å²	56.5	40%	0.399	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134.1	172.4	-54.6	0	0	0	0	109.4	K78 V79	T71-K78 HydrophobicContact CG2-CB 4.32Å; T71-V79 CarbonylContact C-O 3.55Å; T71-V79 WeakPolarHBondContact CA-O 3.45Å
72	M	94.7	Very high	90.6	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.049	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.7	176.5	-56.5	179.2	76	0	0	109.5	F50 I74 V79 M81 E182 F185 T186	F50-M72 HydrophobicContact CE2-CE 3.89Å; F50-M72 HydrophobicContact CE2-CG 4.38Å; F50-M72 HydrophobicContact CE2-SD 3.69Å; F50-M72 HydrophobicContact CZ-CE 4.33Å; F50-M72 HydrophobicContact CZ-CG 4.03Å; F50-M72 HydrophobicContact CZ-SD 3.51Å; F50-M72 VanDerWaalsContact CZ-SD 3.51Å; M72-I74 HydrophobicContact CB-CD1 3.98Å; M72-I74 HydrophobicContact CB-CG1 4.07Å; M72-I74 HydrophobicContact CE-CD1 4.06Å; M72-I74 HydrophobicContact SD-CD1 4.44Å; M72-V79 PolarHBondContact N-O 2.76Å; M72-V79 PolarHBondContact O-N 3.13Å; M72-M81 HydrophobicContact CG-CG 4.26Å; M72-M81 HydrophobicContact SD-CG 3.84Å; M72-E182 HydrophobicContact CE-CG 4.47Å; M72-F185 HydrophobicContact CE-CB 4.25Å; M72-F185 HydrophobicContact SD-CB 4.11Å; M72-T186 WeakPolarHBondContact CE-OG1 3.19Å
73	D	94.8	Very high	91.6	Very high	113 Å²	113	51.9 Å²	51.9	60%	0.604	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.1	164	-168.1	-47.2	0	0	0	108.2	G76	D73-G76 WeakPolarHBondContact OD1-CA 3.29Å; D73-G76 PolarHBondContact OD1-N 3.29Å
74	I	95.3	Very high	92.4	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	104.2	179.8	-52.8	-67.7	0	0	0	107.4	M72 G76 K77 V79 T186 A189 R190 L193	M72-I74 HydrophobicContact CB-CD1 3.98Å; M72-I74 HydrophobicContact CB-CG1 4.07Å; M72-I74 HydrophobicContact CE-CD1 4.06Å; M72-I74 HydrophobicContact SD-CD1 4.44Å; I74-G76 PolarHBondContact O-N 3.33Å; I74-K77 PolarHBondContact N-O 2.78Å; I74-K77 WeakPolarHBondContact O-CB 3.35Å; I74-K77 PolarHBondContact O-N 3.22Å; I74-V79 HydrophobicContact CB-CG2 4.02Å; I74-V79 HydrophobicContact CG1-CB 4.21Å; I74-V79 HydrophobicContact CG1-CG2 3.85Å; I74-T186 HydrophobicContact CD1-CG2 3.92Å; I74-A189 HydrophobicContact CD1-CB 4.11Å; I74-A189 HydrophobicContact CG1-CB 3.96Å; I74-R190 HydrophobicContact CG2-CG 3.41Å; I74-R190 VanDerWaalsContact CG2-CG 3.41Å; I74-L193 HydrophobicContact CB-CD1 3.87Å; I74-L193 HydrophobicContact CG2-CD1 3.63Å
75	D	92.1	Very high	93.2	Very high	117 Å²	117	46.8 Å²	46.8	63%	0.626	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	39.5	176.3	-50	-41	0	0	0	112.5	R190	D75-R190 IonicContact OD1-CZ 3.33Å; D75-R190 IonicContact OD1-NE 3.61Å; D75-R190 IonicContact OD1-NH2 2.87Å; D75-R190 PolarHBondContact OD1-NH2 3.23Å; D75-R190 IonicContact OD2-CZ 2.89Å; D75-R190 IonicContact OD2-NE 3.22Å; D75-R190 PolarHBondContact OD2-NE 3.37Å; D75-R190 IonicContact OD2-NH2 3.97Å
76	G	91.5	Very high	93.3	Very high	58 Å²	58	45.3 Å²	45.3	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	6.5	179.8	0	0	0	0	0	114.8	D73 I74	D73-G76 WeakPolarHBondContact OD1-CA 3.29Å; D73-G76 PolarHBondContact OD1-N 3.29Å; I74-G76 PolarHBondContact O-N 3.33Å
77	K	93.9	Very high	92.8	Very high	95 Å²	95	42 Å²	42	41%	0.413	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.9	173	-62.3	-60.4	-171.5	178.5	0	110.6	D28 F29 I74 V79 L193	D28-K77 HydrophobicContact CB-CB 4.47Å; D28-K77 HydrophobicContact CB-CD 4.25Å; D28-K77 WeakPolarHBondContact OD2-CA 3.48Å; F29-K77 HydrophobicContact CE2-CD 4.34Å; F29-K77 HydrophobicContact CE2-CG 4.37Å; I74-K77 PolarHBondContact N-O 2.78Å; I74-K77 WeakPolarHBondContact O-CB 3.35Å; I74-K77 PolarHBondContact O-N 3.22Å; K77-V79 PolarHBondContact O-N 3.15Å; K77-L193 HydrophobicContact CB-CD1 4.44Å
78	K	95.4	Very high	91.6	Very high	86 Å²	86	38.7 Å²	38.7	37%	0.374	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	107.6	173.3	-68.2	-175.2	179.9	-175	0	109.8	S26 F27 D28 F29 T71	S26-K78 WeakPolarHBondContact O-CD 3.23Å; F27-K78 HydrophobicContact CB-CB 4.48Å; D28-K78 PolarHBondContact N-O 3.21Å; D28-K78 PolarHBondContact OD2-N 3.13Å; F29-K78 PolarHBondContact N-O 3.21Å; T71-K78 HydrophobicContact CG2-CB 4.32Å
79	V	96.4	Very high	90.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.2	-179.9	-175.4	0	0	0	0	110.1	F29 F31 T71 M72 I74 K77 M81 A189 L193	F29-V79 HydrophobicContact CB-CG1 4.5Å; F29-V79 HydrophobicContact CB-CG2 4.48Å; F31-V79 HydrophobicContact CD2-CG1 3.49Å; F31-V79 VanDerWaalsContact CD2-CG1 3.49Å; F31-V79 HydrophobicContact CE2-CG1 3.83Å; T71-V79 CarbonylContact C-O 3.55Å; T71-V79 WeakPolarHBondContact CA-O 3.45Å; M72-V79 PolarHBondContact N-O 2.76Å; M72-V79 PolarHBondContact O-N 3.13Å; I74-V79 HydrophobicContact CB-CG2 4.02Å; I74-V79 HydrophobicContact CG1-CB 4.21Å; I74-V79 HydrophobicContact CG1-CG2 3.85Å; K77-V79 PolarHBondContact O-N 3.15Å; V79-M81 HydrophobicContact CG1-CG 4.43Å; V79-M81 HydrophobicContact CG1-SD 3.62Å; V79-M81 PolarHBondContact O-N 2.9Å; V79-A189 HydrophobicContact CG1-CB 4.34Å; V79-L193 HydrophobicContact CG2-CD1 3.79Å; V79-L193 HydrophobicContact CG2-CD2 3.99Å; V79-L193 HydrophobicContact CG2-CG 4.09Å
80	K	96.3	Very high	88.2	Confident	27 Å²	27	43.4 Å²	43.4	12%	0.117	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	104.2	174.2	-172.2	170.9	-79.4	-176.9	0	109.5	D25 F27 F29 L30 F31 V69	D25-K80 IonicContact OD1-NZ 2.8Å; D25-K80 PolarHBondContact OD1-NZ 3.01Å; F27-K80 HydrophobicContact CB-CB 3.93Å; F27-K80 HydrophobicContact CD1-CB 4.22Å; F27-K80 HydrophobicContact CD1-CD 3.68Å; F27-K80 VanDerWaalsContact CD1-NZ 3.26Å; F27-K80 HydrophobicContact CD2-CB 4.05Å; F27-K80 HydrophobicContact CE1-CD 3.79Å; F27-K80 HydrophobicContact CG-CB 3.78Å; F27-K80 HydrophobicContact CG-CD 4.14Å; F27-K80 HydrophobicContact CZ-CD 4.35Å; F29-K80 PolarHBondContact O-N 3.11Å; L30-K80 WeakPolarHBondContact CA-O 3.4Å; L30-K80 HydrophobicContact CD1-CD 4.33Å; F31-K80 PolarHBondContact N-O 2.91Å; V69-K80 HydrophobicContact CG1-CD 4.04Å; V69-K80 HydrophobicContact CG1-CG 3.57Å
81	M	96.3	Very high	86.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	121.4	176.7	-60	-57.9	-39.7	0	0	110.3	F31 I33 V69 R70 M72 V79 A189	F31-M81 HydrophobicContact CB-CE 3.81Å; F31-M81 HydrophobicContact CB-SD 4.18Å; F31-M81 HydrophobicContact CD2-SD 4.3Å; I33-M81 HydrophobicContact CB-CE 4.45Å; I33-M81 HydrophobicContact CD1-CE 3.53Å; I33-M81 HydrophobicContact CG1-CE 3.07Å; V69-M81 VanDerWaalsContact CA-O 3.29Å; V69-M81 WeakPolarHBondContact CA-O 3.38Å; R70-M81 PolarHBondContact N-O 3.2Å; R70-M81 WeakPolarHBondContact O-CB 3.5Å; R70-M81 PolarHBondContact O-N 3.13Å; M72-M81 HydrophobicContact CG-CG 4.26Å; M72-M81 HydrophobicContact SD-CG 3.84Å; V79-M81 HydrophobicContact CG1-CG 4.43Å; V79-M81 HydrophobicContact CG1-SD 3.62Å; V79-M81 PolarHBondContact O-N 2.9Å; M81-A189 HydrophobicContact SD-CB 3.88Å
82	Q	95.8	Very high	84.7	Confident	36 Å²	36	48.3 Å²	48.3	17%	0.168	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	108.6	171.7	-72.7	-170.4	-21.8	0	0	109.1	L30 F31 K32 I33 F67 V69	L30-Q82 HydrophobicContact CD2-CG 4.49Å; L30-Q82 HydrophobicContact CG-CG 4.39Å; F31-Q82 PolarHBondContact O-N 2.71Å; K32-Q82 CarbonylContact C-O 3.53Å; K32-Q82 WeakPolarHBondContact CA-O 3.49Å; K32-Q82 HydrophobicContact CG-CB 4.27Å; I33-Q82 PolarHBondContact N-O 3.27Å; F67-Q82 HydrophobicContact CE2-CB 3.84Å; F67-Q82 HydrophobicContact CE2-CG 4.07Å; F67-Q82 HydrophobicContact CZ-CB 4.18Å; F67-Q82 HydrophobicContact CZ-CG 3.89Å; V69-Q82 HydrophobicContact CG2-CG 4.15Å
83	V	95.2	Very high	83	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.7	-174.9	-171.2	0	0	0	0	110	I33 V47 F50 T68 F185	I33-V83 CarbonylContact O-C 3.42Å; I33-V83 WeakPolarHBondContact O-CA 3.39Å; V47-V83 HydrophobicContact CG1-CG1 4.34Å; V47-V83 HydrophobicContact CG2-CG1 3.78Å; F50-V83 HydrophobicContact CE1-CG2 4.41Å; T68-V83 PolarHBondContact N-O 3.43Å; T68-V83 PolarHBondContact O-N 2.8Å; V83-F185 HydrophobicContact CG1-CE1 4.3Å; V83-F185 HydrophobicContact CG2-CD1 4.46Å; V83-F185 HydrophobicContact CG2-CE1 3.84Å
84	W	93	Very high	81.4	Confident	54 Å²	54	51.9 Å²	51.9	21%	0.205	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	104.7	173.2	-63.1	90.3	0	0	0	109.1	I33 I34 L35 V65 D66 F67 Y99	I33-W84 PolarHBondContact O-N 3.08Å; I34-W84 HydrophobicContact CG2-CB 4.19Å; L35-W84 PolarHBondContact N-O 3.28Å; V65-W84 HydrophobicContact CG1-CB 4.1Å; V65-W84 HydrophobicContact CG1-CE3 3.67Å; D66-W84 WeakPolarHBondContact O-CA 3.32Å; F67-W84 HydrophobicContact CB-CE3 4.27Å; F67-W84 HydrophobicContact CB-CZ3 4.17Å; F67-W84 AromaticContact CD2-CD2 3.82Å; F67-W84 HydrophobicContact CD2-CD2 3.82Å; F67-W84 AromaticContact CD2-CE2 3.67Å; F67-W84 AromaticContact CD2-CE3 3.98Å; F67-W84 HydrophobicContact CD2-CE3 3.98Å; F67-W84 HydrophobicContact CD2-CG 4.46Å; F67-W84 AromaticContact CD2-CH2 3.95Å; F67-W84 HydrophobicContact CD2-CH2 3.95Å; F67-W84 AromaticContact CD2-CZ2 3.76Å; F67-W84 HydrophobicContact CD2-CZ2 3.76Å; F67-W84 HydrophobicContact CD2-CZ3 4.03Å; F67-W84 HydrophobicContact CE2-CD2 4.47Å; F67-W84 AromaticContact CE2-CE2 3.89Å; F67-W84 HydrophobicContact CE2-CH2 4.42Å; F67-W84 AromaticContact CE2-CZ2 3.88Å; F67-W84 HydrophobicContact CE2-CZ2 3.88Å; F67-W84 HydrophobicContact CG-CH2 4.49Å; F67-W84 HydrophobicContact CG-CZ3 4.41Å; W84-Y99 AromaticContact CD2-CD1 3.72Å; W84-Y99 HydrophobicContact CD2-CD1 3.72Å; W84-Y99 HydrophobicContact CD2-CE1 4.28Å; W84-Y99 HydrophobicContact CD2-CG 4.37Å; W84-Y99 AromaticContact CE3-CD1 3.41Å; W84-Y99 HydrophobicContact CE3-CD1 3.41Å; W84-Y99 VanDerWaalsContact CE3-CD1 3.41Å; W84-Y99 AromaticContact CE3-CE1 3.53Å; W84-Y99 HydrophobicContact CE3-CE1 3.53Å; W84-Y99 HydrophobicContact CE3-CG 4.18Å; W84-Y99 AromaticContact CH2-CD1 3.75Å; W84-Y99 HydrophobicContact CH2-CD1 3.75Å; W84-Y99 AromaticContact CH2-CE1 3.56Å; W84-Y99 HydrophobicContact CH2-CE1 3.56Å; W84-Y99 HydrophobicContact CZ2-CD1 4.04Å; W84-Y99 HydrophobicContact CZ2-CE1 4.31Å; W84-Y99 AromaticContact CZ3-CD1 3.44Å; W84-Y99 HydrophobicContact CZ3-CD1 3.44Å; W84-Y99 VanDerWaalsContact CZ3-CD1 3.44Å; W84-Y99 AromaticContact CZ3-CE1 3.12Å; W84-Y99 HydrophobicContact CZ3-CE1 3.12Å
85	D	90.4	Very high	79.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	114.6	174.4	-179.6	38.5	0	0	0	109.7	K43 T44 V47 V65 D66	K43-D85 VanDerWaalsContact CB-OD1 3.25Å; K43-D85 WeakPolarHBondContact CB-OD1 3.39Å; T44-D85 VanDerWaalsContact CA-OD2 3.25Å; T44-D85 WeakPolarHBondContact CA-OD2 3.48Å; T44-D85 VanDerWaalsContact CB-OD2 3.22Å; T44-D85 WeakPolarHBondContact CB-OD2 3.22Å; T44-D85 WeakPolarHBondContact CG2-OD2 3.41Å; T44-D85 PolarHBondContact N-OD1 3.04Å; T44-D85 PolarHBondContact OG1-OD2 2.8Å; V47-D85 HydrophobicContact CG2-CB 4.17Å; V65-D85 CarbonylContact C-O 3.59Å; V65-D85 VanDerWaalsContact CA-O 3.27Å; V65-D85 WeakPolarHBondContact CA-O 3.37Å; V65-D85 WeakPolarHBondContact CG1-O 3.2Å; D66-D85 HydrophobicContact CB-CB 4.28Å; D66-D85 PolarHBondContact N-O 3.04Å; D66-D85 PolarHBondContact O-N 3.02Å
86	T	83.9	Confident	78.6	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	144.1	-174.7	67.9	0	0	0	0	111.7	L35 K43 V65 G88 T96	L35-T86 PolarHBondContact O-N 3.32Å; L35-T86 PolarHBondContact O-OG1 3.42Å; K43-T86 WeakPolarHBondContact CE-O 3.21Å; V65-T86 HydrophobicContact CG1-CG2 4.31Å; V65-T86 HydrophobicContact CG2-CG2 4.34Å; T86-G88 PolarHBondContact O-N 3.45Å; T86-T96 HydrophobicContact CG2-CG2 3.37Å
87	A	76.7	Confident	77.8	Confident	6 Å²	6	51.7 Å²	51.7	5%	0.05	24%	0.239	C	C	.	.			trans	-60.5	127.9	168.3	0	0	0	0	0	110.1	T62 G64 Q89 F92	T62-A87 WeakPolarHBondContact O-CB 3.32Å; G64-A87 VanDerWaalsContact O-CB 3.23Å; G64-A87 WeakPolarHBondContact O-CB 3.4Å; G64-A87 PolarHBondContact O-N 2.86Å; A87-Q89 PolarHBondContact O-N 3.47Å; A87-F92 HydrophobicContact CB-CB 4.49Å; A87-F92 HydrophobicContact CB-CD2 3.8Å; A87-F92 HydrophobicContact CB-CG 4.5Å
88	G	64.4	Low	77	Confident	10 Å²	10	51 Å²	51	10%	0.103	25%	0.247	C	C	.	.			trans	-75.8	2	176.4	0	0	0	0	0	114.6	G37 S39 K43 T86	G37-G88 WeakPolarHBondContact O-CA 3.4Å; S39-G88 PolarHBondContact N-O 2.83Å; S39-G88 PolarHBondContact OG-O 3.2Å; K43-G88 VanDerWaalsContact NZ-CA 3.32Å; T86-G88 PolarHBondContact O-N 3.45Å
89	Q	62.6	Low	76.4	Confident	45 Å²	45	49.9 Å²	49.9	21%	0.21	24%	0.24	C	C	.	.	S	Bend	trans	-87.1	128.2	176.7	-76	-160.6	5.1	0	0	110.8	S39 A87 R91 F92	S39-Q89 VanDerWaalsContact OG-CG 3.26Å; S39-Q89 WeakPolarHBondContact OG-CG 3.18Å; S39-Q89 PolarHBondContact OG-N 3.07Å; A87-Q89 PolarHBondContact O-N 3.47Å; Q89-R91 PolarHBondContact O-N 2.93Å; Q89-R91 VanDerWaalsContact OE1-NE 3.13Å; Q89-F92 HydrophobicContact CB-CD2 4.22Å; Q89-F92 HydrophobicContact CB-CE2 4.49Å; Q89-F92 PolarHBondContact O-N 2.89Å; Q89-F92 VanDerWaalsContact O-N 3.12Å
90	E	55.3	Low	75.8	Confident	114 Å²	114	50 Å²	50	53%	0.533	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-50.9	-28.4	176.2	65.4	-66.1	151.5	0	0	113.9	F92 R93	E90-F92 PolarHBondContact O-N 3.37Å; E90-F92 VanDerWaalsContact O-N 3.12Å; E90-R93 WeakPolarHBondContact O-CG 3.34Å; E90-R93 PolarHBondContact O-N 2.8Å
91	R	56.7	Low	75.3	Confident	181 Å²	181	58.8 Å²	58.8	68%	0.683	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-64.1	-14.6	179.9	-61.6	-171.4	-66.3	171.2	1.1	114.5	Q89	Q89-R91 PolarHBondContact O-N 2.93Å; Q89-R91 VanDerWaalsContact OE1-NE 3.13Å
92	F	57.3	Low	74.8	Confident	55 Å²	55	61.3 Å²	61.3	24%	0.241	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-109.7	3.4	-179.7	-58.7	-63.1	0	0	0	114.5	I63 A87 Q89 E90 T94 I95 T96	I63-F92 HydrophobicContact CG2-CZ 4.21Å; A87-F92 HydrophobicContact CB-CB 4.49Å; A87-F92 HydrophobicContact CB-CD2 3.8Å; A87-F92 HydrophobicContact CB-CG 4.5Å; Q89-F92 HydrophobicContact CB-CD2 4.22Å; Q89-F92 HydrophobicContact CB-CE2 4.49Å; Q89-F92 PolarHBondContact O-N 2.89Å; Q89-F92 VanDerWaalsContact O-N 3.12Å; E90-F92 PolarHBondContact O-N 3.37Å; E90-F92 VanDerWaalsContact O-N 3.12Å; F92-T94 VanDerWaalsContact C-N 3.3Å; F92-T94 PolarHBondContact O-N 2.96Å; F92-T94 VanDerWaalsContact O-N 3.16Å; F92-I95 HydrophobicContact CD1-CD1 4.28Å; F92-I95 WeakPolarHBondContact O-CB 3.44Å; F92-I95 PolarHBondContact O-N 2.61Å; F92-T96 PolarHBondContact O-N 3.21Å; F92-T96 PolarHBondContact O-OG1 3.31Å; F92-T96 VanDerWaalsContact O-OG1 3.11Å
93	R	61	Low	74.6	Confident	76 Å²	76	59.8 Å²	59.8	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-55.5	-35.2	-173.6	-76.6	176.1	179.5	-170.4	-4.7	115.2	E90 I95 T96 H123	E90-R93 WeakPolarHBondContact O-CG 3.34Å; E90-R93 PolarHBondContact O-N 2.8Å; R93-I95 VanDerWaalsContact C-N 3.27Å; R93-I95 PolarHBondContact O-N 2.89Å; R93-T96 PolarHBondContact O-N 2.87Å; R93-H123 PolarHBondContact NH1-NE2 3.19Å; R93-H123 PolarHBondContact NH2-NE2 3.11Å
94	T	59.2	Low	74.7	Confident	122 Å²	122	62.8 Å²	62.8	75%	0.748	30%	0.298	S	S	*	.	H	α-helix	trans	-65.9	-31.2	178.4	-47.9	0	0	0	0	112.4	F92 T96	F92-T94 VanDerWaalsContact C-N 3.3Å; F92-T94 PolarHBondContact O-N 2.96Å; F92-T94 VanDerWaalsContact O-N 3.16Å; T94-T96 VanDerWaalsContact C-N 3.3Å
95	I	62.2	Low	74.9	Confident	93 Å²	93	60.2 Å²	60.2	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-73.9	-29.9	178.6	-57.5	176.2	0	0	0	109.8	F92 R93 S98 Y99	F92-I95 HydrophobicContact CD1-CD1 4.28Å; F92-I95 WeakPolarHBondContact O-CB 3.44Å; F92-I95 PolarHBondContact O-N 2.61Å; R93-I95 VanDerWaalsContact C-N 3.27Å; R93-I95 PolarHBondContact O-N 2.89Å; I95-S98 PolarHBondContact O-OG 3.31Å; I95-Y99 WeakPolarHBondContact O-CE2 3.36Å
96	T	67.4	Low	75.2	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-76.6	-27.4	-171.8	-28.4	0	0	0	0	113.8	V65 T86 F92 R93 T94 S98 Y99 Y100	V65-T96 HydrophobicContact CG2-CG2 4.27Å; T86-T96 HydrophobicContact CG2-CG2 3.37Å; F92-T96 PolarHBondContact O-N 3.21Å; F92-T96 PolarHBondContact O-OG1 3.31Å; F92-T96 VanDerWaalsContact O-OG1 3.11Å; R93-T96 PolarHBondContact O-N 2.87Å; T94-T96 VanDerWaalsContact C-N 3.3Å; T96-S98 VanDerWaalsContact C-N 3.25Å; T96-S98 PolarHBondContact O-N 2.96Å; T96-S98 VanDerWaalsContact O-N 3.13Å; T96-Y99 HydrophobicContact CG2-CD2 4.37Å; T96-Y99 WeakPolarHBondContact O-CD2 3.29Å; T96-Y99 PolarHBondContact O-N 3.2Å; T96-Y100 HydrophobicContact CG2-CE2 3.75Å; T96-Y100 WeakPolarHBondContact O-CD2 3.39Å; T96-Y100 WeakPolarHBondContact O-CE2 3.35Å
97	Q	75.3	Confident	75.8	Confident	75 Å²	75	60.1 Å²	60.1	35%	0.35	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-35.4	-172.7	-71.8	178.5	3.5	0	0	114.1	Y99 Y100 Y131	Q97-Y99 VanDerWaalsContact C-N 3.25Å; Q97-Y99 PolarHBondContact O-N 3.05Å; Q97-Y100 PolarHBondContact O-N 3.25Å; Q97-Y131 HydrophobicContact CG-CD1 4.13Å; Q97-Y131 HydrophobicContact CG-CD2 4.23Å; Q97-Y131 HydrophobicContact CG-CE1 4.08Å; Q97-Y131 HydrophobicContact CG-CE2 4.19Å; Q97-Y131 HydrophobicContact CG-CG 4.21Å; Q97-Y131 PolarHBondContact NE2-OH 3.32Å
98	S	77.2	Confident	76.8	Confident	81 Å²	81	59.8 Å²	59.8	57%	0.566	29%	0.286	S	S	*	.	H	α-helix	trans	-64.4	-28.7	179.8	62.2	0	0	0	0	113.1	I95 T96	I95-S98 PolarHBondContact O-OG 3.31Å; T96-S98 VanDerWaalsContact C-N 3.25Å; T96-S98 PolarHBondContact O-N 2.96Å; T96-S98 VanDerWaalsContact O-N 3.13Å
99	Y	81.9	Confident	78.4	Confident	62 Å²	62	59.4 Å²	59.4	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-77.6	-23.8	-179.1	-55.5	-71.4	0	0	0	112.8	V65 W84 I95 T96 Q97	V65-Y99 HydrophobicContact CB-CD2 4.49Å; V65-Y99 HydrophobicContact CB-CE2 4.02Å; V65-Y99 HydrophobicContact CG1-CD2 4.4Å; V65-Y99 HydrophobicContact CG1-CE2 4.33Å; V65-Y99 HydrophobicContact CG2-CD2 3.87Å; V65-Y99 HydrophobicContact CG2-CE2 3.53Å; W84-Y99 AromaticContact CD2-CD1 3.72Å; W84-Y99 HydrophobicContact CD2-CD1 3.72Å; W84-Y99 HydrophobicContact CD2-CE1 4.28Å; W84-Y99 HydrophobicContact CD2-CG 4.37Å; W84-Y99 AromaticContact CE3-CD1 3.41Å; W84-Y99 HydrophobicContact CE3-CD1 3.41Å; W84-Y99 VanDerWaalsContact CE3-CD1 3.41Å; W84-Y99 AromaticContact CE3-CE1 3.53Å; W84-Y99 HydrophobicContact CE3-CE1 3.53Å; W84-Y99 HydrophobicContact CE3-CG 4.18Å; W84-Y99 AromaticContact CH2-CD1 3.75Å; W84-Y99 HydrophobicContact CH2-CD1 3.75Å; W84-Y99 AromaticContact CH2-CE1 3.56Å; W84-Y99 HydrophobicContact CH2-CE1 3.56Å; W84-Y99 HydrophobicContact CZ2-CD1 4.04Å; W84-Y99 HydrophobicContact CZ2-CE1 4.31Å; W84-Y99 AromaticContact CZ3-CD1 3.44Å; W84-Y99 HydrophobicContact CZ3-CD1 3.44Å; W84-Y99 VanDerWaalsContact CZ3-CD1 3.44Å; W84-Y99 AromaticContact CZ3-CE1 3.12Å; W84-Y99 HydrophobicContact CZ3-CE1 3.12Å; I95-Y99 WeakPolarHBondContact O-CE2 3.36Å; T96-Y99 HydrophobicContact CG2-CD2 4.37Å; T96-Y99 WeakPolarHBondContact O-CD2 3.29Å; T96-Y99 PolarHBondContact O-N 3.2Å; Q97-Y99 VanDerWaalsContact C-N 3.25Å; Q97-Y99 PolarHBondContact O-N 3.05Å
100	Y	84.3	Confident	80.1	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-39.5	178.8	-70.2	-99.8	0	0	0	112.5	I34 V36 T96 Q97 S102 A103 E127 V128 Y131 G132	I34-Y100 HydrophobicContact CD1-CD1 3.21Å; I34-Y100 HydrophobicContact CD1-CE1 3.48Å; I34-Y100 VanDerWaalsContact CD1-CE1 3.48Å; I34-Y100 HydrophobicContact CD1-CG 3.9Å; V36-Y100 HydrophobicContact CG1-CE1 4.05Å; V36-Y100 VanDerWaalsContact CG1-OH 3.31Å; V36-Y100 WeakPolarHBondContact CG1-OH 3.42Å; T96-Y100 HydrophobicContact CG2-CE2 3.75Å; T96-Y100 WeakPolarHBondContact O-CD2 3.39Å; T96-Y100 WeakPolarHBondContact O-CE2 3.35Å; Q97-Y100 PolarHBondContact O-N 3.25Å; Y100-S102 PolarHBondContact O-N 2.98Å; Y100-A103 WeakPolarHBondContact O-CB 3.22Å; Y100-A103 PolarHBondContact O-N 3.34Å; Y100-E127 HydrophobicContact CE1-CG 4.33Å; Y100-E127 PolarHBondContact OH-OE1 3.15Å; Y100-V128 HydrophobicContact CD1-CG2 4.28Å; Y100-V128 HydrophobicContact CE1-CB 4.44Å; Y100-V128 HydrophobicContact CE1-CG2 3.8Å; Y100-Y131 CarbonylContact C-O 3.59Å; Y100-Y131 WeakPolarHBondContact CB-O 3.47Å; Y100-G132 WeakPolarHBondContact O-CA 3.35Å
101	R	84.6	Confident	82.2	Confident	211 Å²	211	51.9 Å²	51.9	80%	0.796	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.1	-168.6	-170.9	-179.9	176.7	111	0.1	114.9	Y131	R101-Y131 WeakPolarHBondContact CA-O 3.27Å; R101-Y131 PolarHBondContact N-O 2.97Å
102	S	85.7	Confident	84.2	Confident	53 Å²	53	43.3 Å²	43.3	37%	0.371	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	12.4	-179.5	70.2	0	0	0	0	113.8	K32 Y100 H104	K32-S102 WeakPolarHBondContact CD-O 3.25Å; K32-S102 WeakPolarHBondContact CD-OG 3.43Å; K32-S102 PolarHBondContact NZ-OG 2.83Å; Y100-S102 PolarHBondContact O-N 2.98Å; S102-H104 PolarHBondContact O-ND1 3.08Å
103	A	93	Very high	86.1	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.033	21%	0.206	C	C	.	.			trans	-65.9	135.4	174.7	0	0	0	0	0	109.8	I34 Y100 V136	I34-A103 HydrophobicContact CD1-CB 4.09Å; I34-A103 HydrophobicContact CG1-CB 4.05Å; I34-A103 HydrophobicContact CG2-CB 3.89Å; Y100-A103 WeakPolarHBondContact O-CB 3.22Å; Y100-A103 PolarHBondContact O-N 3.34Å; A103-V136 HydrophobicContact CB-CG2 4.36Å; A103-V136 VanDerWaalsContact O-CG2 3.27Å; A103-V136 WeakPolarHBondContact O-CG2 3.46Å
104	H	96.1	Very high	87.9	Confident	64 Å²	64	40.9 Å²	40.9	30%	0.296	20%	0.204	S	C	.	.	S	Bend	trans	-90.4	-35.6	170	-59.5	79.3	0	0	0	109.8	F31 K32 S102 V136 V137 L192	F31-H104 HydrophobicContact CB-CB 4.46Å; F31-H104 HydrophobicContact CD1-CB 4.19Å; F31-H104 AromaticContact CD1-CD2 3.99Å; K32-H104 PolarHBondContact N-ND1 2.96Å; K32-H104 PolarHBondContact O-N 2.74Å; S102-H104 PolarHBondContact O-ND1 3.08Å; H104-V136 WeakPolarHBondContact O-CA 3.38Å; H104-V137 PolarHBondContact O-N 3.42Å; H104-L192 HydrophobicContact CB-CD1 4.03Å; H104-L192 HydrophobicContact CB-CD2 3.94Å; H104-L192 WeakPolarHBondContact O-CD2 3.37Å
105	G	97.1	Very high	89.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	161.4	174.6	0	0	0	0	0	113	K32 I33 I34 V137	K32-G105 PolarHBondContact O-N 2.89Å; I33-G105 VanDerWaalsContact CA-O 3.3Å; I33-G105 WeakPolarHBondContact CA-O 3.31Å; I34-G105 PolarHBondContact N-O 2.82Å; G105-V137 CarbonylContact C-O 3.54Å; G105-V137 WeakPolarHBondContact CA-O 3.38Å
106	A	96.9	Very high	91.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134	175.9	0	0	0	0	0	110.3	I34 V128 V136 V137 V138 V139 M188	I34-A106 HydrophobicContact CD1-CB 3.98Å; I34-A106 HydrophobicContact CG1-CB 3.59Å; I34-A106 CarbonylContact O-C 3.59Å; I34-A106 WeakPolarHBondContact O-CA 3.45Å; A106-V128 HydrophobicContact CB-CB 4.47Å; A106-V128 HydrophobicContact CB-CG1 3.66Å; A106-V128 HydrophobicContact CB-CG2 3.91Å; A106-V136 HydrophobicContact CB-CG1 3.89Å; A106-V137 PolarHBondContact N-O 2.87Å; A106-V138 HydrophobicContact CB-CG2 4.39Å; A106-V138 CarbonylContact O-C 3.19Å; A106-V138 VanDerWaalsContact O-CA 3.31Å; A106-V138 WeakPolarHBondContact O-CA 3.32Å; A106-V139 PolarHBondContact O-N 3.37Å; A106-M188 WeakPolarHBondContact O-CE 3.13Å
107	M	97.8	Very high	92.9	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.8	169.2	-68.9	-173.9	175.7	0	0	108.2	I33 I34 L35 V36 V139 V141 A184 F185 M188	I33-M107 HydrophobicContact CG2-CG 4.2Å; I34-M107 PolarHBondContact O-N 3.48Å; L35-M107 HydrophobicContact CD1-CB 3.44Å; L35-M107 VanDerWaalsContact CD1-CB 3.44Å; V36-M107 PolarHBondContact N-O 2.95Å; M107-V139 WeakPolarHBondContact CA-O 3.42Å; M107-V141 HydrophobicContact CB-CG2 4.49Å; M107-A184 HydrophobicContact CE-CB 4.31Å; M107-A184 WeakPolarHBondContact CE-O 3.35Å; M107-F185 HydrophobicContact CE-CB 4.39Å; M107-F185 HydrophobicContact CE-CD1 3.53Å; M107-F185 HydrophobicContact CE-CD2 4.35Å; M107-F185 HydrophobicContact CE-CE1 3.76Å; M107-F185 HydrophobicContact CE-CG 3.85Å; M107-F185 HydrophobicContact CE-CZ 4.26Å; M107-F185 HydrophobicContact SD-CD1 4.2Å; M107-F185 HydrophobicContact SD-CE1 3.78Å; M107-F185 HydrophobicContact SD-CE2 4.4Å; M107-F185 HydrophobicContact SD-CZ 3.89Å; M107-M188 HydrophobicContact CB-CE 4.49Å; M107-M188 HydrophobicContact CE-CB 4.01Å; M107-M188 HydrophobicContact CE-CE 3.88Å; M107-M188 HydrophobicContact CE-SD 3.7Å; M107-M188 HydrophobicContact CG-CE 3.37Å; M107-M188 HydrophobicContact CG-SD 3.99Å; M107-M188 HydrophobicContact SD-CE 4.5Å
108	V	97.6	Very high	94	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	109.9	176.2	-175.6	0	0	0	0	107.7	V36 V121 W124 I125 V138 V139 L140 V141	V36-V108 HydrophobicContact CG2-CB 4.28Å; V36-V108 HydrophobicContact CG2-CG1 4.41Å; V36-V108 HydrophobicContact CG2-CG2 3.77Å; V108-V121 HydrophobicContact CG1-CG1 4.05Å; V108-V121 HydrophobicContact CG1-CG2 4.32Å; V108-W124 HydrophobicContact CG1-CB 3.7Å; V108-W124 HydrophobicContact CG1-CG 4.43Å; V108-I125 HydrophobicContact CG2-CG1 4.31Å; V108-V138 HydrophobicContact CG2-CG1 3.8Å; V108-V139 PolarHBondContact N-O 2.76Å; V108-L140 HydrophobicContact CB-CD1 4.37Å; V108-L140 HydrophobicContact CG1-CD1 4.4Å; V108-L140 WeakPolarHBondContact O-CD1 3.36Å; V108-V141 PolarHBondContact O-N 2.9Å
109	A	97.9	Very high	95	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.5	-175.9	0	0	0	0	0	112.1	L35 V36 G37 V41 K43 M46 V141	L35-A109 HydrophobicContact CD1-CB 4.3Å; V36-A109 PolarHBondContact O-N 2.96Å; G37-A109 WeakPolarHBondContact CA-O 3.25Å; V41-A109 HydrophobicContact CG2-CB 3.87Å; K43-A109 HydrophobicContact CG-CB 4.04Å; M46-A109 HydrophobicContact SD-CB 4.41Å; A109-V141 CarbonylContact C-O 3.5Å; A109-V141 VanDerWaalsContact CA-O 3.29Å; A109-V141 WeakPolarHBondContact CA-O 3.35Å
110	Y	98.5	Very high	95.7	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	168.8	167.2	72.6	-83.5	0	0	0	110.3	I112 F118 V121 L140 V141 N143 V153 A158	Y110-I112 HydrophobicContact CE2-CG2 3.95Å; Y110-F118 HydrophobicContact CD1-CD2 4.01Å; Y110-F118 HydrophobicContact CD2-CB 3.85Å; Y110-F118 AromaticContact CD2-CD2 3.84Å; Y110-F118 HydrophobicContact CD2-CD2 3.84Å; Y110-F118 HydrophobicContact CD2-CG 4.29Å; Y110-F118 AromaticContact CE1-CD2 3.96Å; Y110-F118 HydrophobicContact CE1-CD2 3.96Å; Y110-F118 HydrophobicContact CE1-CE2 4.3Å; Y110-F118 HydrophobicContact CE2-CB 4.37Å; Y110-F118 AromaticContact CE2-CD2 3.81Å; Y110-F118 HydrophobicContact CE2-CD2 3.81Å; Y110-F118 HydrophobicContact CE2-CG 4.42Å; Y110-F118 HydrophobicContact CG-CB 4.25Å; Y110-F118 AromaticContact CG-CD2 3.95Å; Y110-F118 HydrophobicContact CG-CD2 3.95Å; Y110-F118 AromaticContact CZ-CD2 3.87Å; Y110-V121 HydrophobicContact CD1-CG2 4.13Å; Y110-V121 HydrophobicContact CG-CG2 4.26Å; Y110-L140 HydrophobicContact CD1-CD1 3.73Å; Y110-L140 HydrophobicContact CD1-CG 4.27Å; Y110-L140 HydrophobicContact CE1-CD1 3.92Å; Y110-L140 HydrophobicContact CE1-CD2 4.33Å; Y110-L140 HydrophobicContact CE1-CG 3.93Å; Y110-V141 WeakPolarHBondContact CD1-O 3.47Å; Y110-V141 PolarHBondContact N-O 2.83Å; Y110-N143 PolarHBondContact O-N 2.9Å; Y110-V153 HydrophobicContact CD2-CG2 4.47Å; Y110-V153 HydrophobicContact CE2-CB 3.96Å; Y110-V153 HydrophobicContact CE2-CG1 3.73Å; Y110-V153 HydrophobicContact CE2-CG2 4.23Å; Y110-A158 HydrophobicContact CE1-CB 4.3Å; Y110-A158 VanDerWaalsContact OH-CB 3.22Å; Y110-A158 WeakPolarHBondContact OH-CB 3.34Å
111	D	98.3	Very high	96.3	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.5	178.5	-179.9	-16.3	0	0	0	109.6	V41 S113 R114 T117 K144	V41-D111 HydrophobicContact CB-CB 4.36Å; V41-D111 HydrophobicContact CG1-CB 4.23Å; D111-S113 PolarHBondContact O-N 3.36Å; D111-S113 VanDerWaalsContact O-N 3.09Å; D111-S113 WeakPolarHBondContact OD1-CB 3.37Å; D111-S113 PolarHBondContact OD1-N 2.9Å; D111-S113 PolarHBondContact OD1-OG 2.72Å; D111-R114 HydrophobicContact CB-CB 4.24Å; D111-R114 CarbonylContact O-C 3.44Å; D111-R114 PolarHBondContact O-N 2.9Å; D111-R114 IonicContact OD2-CZ 2.87Å; D111-R114 IonicContact OD2-NE 2.98Å; D111-R114 PolarHBondContact OD2-NE 3.23Å; D111-R114 IonicContact OD2-NH2 3.72Å; D111-R114 PolarHBondContact OD2-NH2 3Å; D111-T117 HydrophobicContact CB-CG2 4.44Å; D111-T117 PolarHBondContact N-OG1 2.6Å; D111-T117 PolarHBondContact O-OG1 2.95Å; D111-K144 WeakPolarHBondContact OD2-CD 3.46Å; D111-K144 VanDerWaalsContact OD2-CE 3.23Å; D111-K144 WeakPolarHBondContact OD2-CE 3.47Å; D111-K144 IonicContact OD2-NZ 3.79Å; D111-K144 PolarHBondContact OD2-NZ 3.04Å
112	I	98.6	Very high	96.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.2	-176.7	66.7	144.2	0	0	0	113.2	Y110 N143 K144 R151 Q152 V153	Y110-I112 HydrophobicContact CE2-CG2 3.95Å; I112-N143 PolarHBondContact N-O 3.34Å; I112-K144 WeakPolarHBondContact CG1-O 3.16Å; I112-R151 HydrophobicContact CD1-CB 4.48Å; I112-Q152 PolarHBondContact O-N 3.27Å; I112-V153 PolarHBondContact O-N 3.28Å
113	S	98.5	Very high	97.3	Very high	11 Å²	11	27.8 Å²	27.8	8%	0.077	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.3	179	73.6	0	0	0	0	113.4	D111 Q150 Q152	D111-S113 PolarHBondContact O-N 3.36Å; D111-S113 VanDerWaalsContact O-N 3.09Å; D111-S113 WeakPolarHBondContact OD1-CB 3.37Å; D111-S113 PolarHBondContact OD1-N 2.9Å; D111-S113 PolarHBondContact OD1-OG 2.72Å; S113-Q150 WeakPolarHBondContact CA-O 3.48Å; S113-Q152 WeakPolarHBondContact O-CG 3.31Å; S113-Q152 PolarHBondContact O-NE2 2.84Å; S113-Q152 PolarHBondContact O-OE1 3.08Å
114	R	98.1	Very high	97.4	Very high	69 Å²	69	27.9 Å²	27.9	26%	0.26	14%	0.138	S	C	.	.			trans	-132.4	101.6	178	-77.7	-176	-63.7	139.8	5.6	112.1	S39 D40 D111 S116 T117	S39-R114 PolarHBondContact O-NH1 2.82Å; D40-R114 PolarHBondContact O-NH2 3.49Å; D111-R114 HydrophobicContact CB-CB 4.24Å; D111-R114 CarbonylContact O-C 3.44Å; D111-R114 PolarHBondContact O-N 2.9Å; D111-R114 IonicContact OD2-CZ 2.87Å; D111-R114 IonicContact OD2-NE 2.98Å; D111-R114 PolarHBondContact OD2-NE 3.23Å; D111-R114 IonicContact OD2-NH2 3.72Å; D111-R114 PolarHBondContact OD2-NH2 3Å; R114-S116 VanDerWaalsContact C-N 3.29Å; R114-S116 PolarHBondContact O-N 2.78Å; R114-T117 HydrophobicContact CB-CG2 4.01Å; R114-T117 PolarHBondContact O-N 2.9Å; R114-T117 VanDerWaalsContact O-N 3.11Å; R114-T117 PolarHBondContact O-OG1 2.93Å
115	R	98.2	Very high	97.3	Very high	94 Å²	94	24.9 Å²	24.9	36%	0.355	12%	0.124	S	C	.	.	H	α-helix	trans	-53	-40.9	-180	-176.4	67.5	178.9	-155.9	8.7	113.8	T117 F118 E119 Q152 D157	R115-T117 PolarHBondContact O-N 3.36Å; R115-F118 WeakPolarHBondContact O-CB 3.49Å; R115-F118 PolarHBondContact O-N 2.83Å; R115-E119 HydrophobicContact CG-CG 4.41Å; R115-E119 IonicContact NE-OE1 2.72Å; R115-E119 PolarHBondContact O-N 3.41Å; R115-Q152 HydrophobicContact CB-CB 4.12Å; R115-D157 IonicContact NH1-OD2 2.84Å; R115-D157 PolarHBondContact NH1-OD2 3.23Å; R115-D157 VanDerWaalsContact NH1-OD2 3.11Å
116	S	97.8	Very high	97.1	Very high	67 Å²	67	31.4 Å²	31.4	47%	0.469	15%	0.149	S	C	.	.	H	α-helix	trans	-57.5	-34.8	-178.8	55.9	0	0	0	0	113	R114 F118 E119 S120	R114-S116 VanDerWaalsContact C-N 3.29Å; R114-S116 PolarHBondContact O-N 2.78Å; S116-F118 VanDerWaalsContact C-N 3.3Å; S116-F118 PolarHBondContact O-N 2.93Å; S116-E119 PolarHBondContact O-N 2.92Å; S116-S120 PolarHBondContact O-N 2.8Å; S116-S120 VanDerWaalsContact O-N 3.13Å; S116-S120 PolarHBondContact O-OG 3.34Å
117	T	97.8	Very high	96.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-70.2	-29	178.7	68.8	0	0	0	0	112.7	D38 V41 D111 R114 R115	D38-T117 HydrophobicContact CB-CG2 4.02Å; D38-T117 WeakPolarHBondContact OD2-CA 3.48Å; V41-T117 HydrophobicContact CG1-CG2 3.79Å; D111-T117 HydrophobicContact CB-CG2 4.44Å; D111-T117 PolarHBondContact N-OG1 2.6Å; D111-T117 PolarHBondContact O-OG1 2.95Å; R114-T117 HydrophobicContact CB-CG2 4.01Å; R114-T117 PolarHBondContact O-N 2.9Å; R114-T117 VanDerWaalsContact O-N 3.11Å; R114-T117 PolarHBondContact O-OG1 2.93Å; R115-T117 PolarHBondContact O-N 3.36Å
118	F	98.6	Very high	96.6	Very high	13 Å²	13	32.2 Å²	32.2	6%	0.057	15%	0.153	C	C	.	.	H	α-helix	trans	-75.3	-37.2	172.9	-178.9	-107	0	0	0	111.5	Y110 R115 S116 S120 V121 L140 V153 D157 A158 L161	Y110-F118 HydrophobicContact CD1-CD2 4.01Å; Y110-F118 HydrophobicContact CD2-CB 3.85Å; Y110-F118 AromaticContact CD2-CD2 3.84Å; Y110-F118 HydrophobicContact CD2-CD2 3.84Å; Y110-F118 HydrophobicContact CD2-CG 4.29Å; Y110-F118 AromaticContact CE1-CD2 3.96Å; Y110-F118 HydrophobicContact CE1-CD2 3.96Å; Y110-F118 HydrophobicContact CE1-CE2 4.3Å; Y110-F118 HydrophobicContact CE2-CB 4.37Å; Y110-F118 AromaticContact CE2-CD2 3.81Å; Y110-F118 HydrophobicContact CE2-CD2 3.81Å; Y110-F118 HydrophobicContact CE2-CG 4.42Å; Y110-F118 HydrophobicContact CG-CB 4.25Å; Y110-F118 AromaticContact CG-CD2 3.95Å; Y110-F118 HydrophobicContact CG-CD2 3.95Å; Y110-F118 AromaticContact CZ-CD2 3.87Å; R115-F118 WeakPolarHBondContact O-CB 3.49Å; R115-F118 PolarHBondContact O-N 2.83Å; S116-F118 VanDerWaalsContact C-N 3.3Å; S116-F118 PolarHBondContact O-N 2.93Å; F118-S120 PolarHBondContact O-N 2.85Å; F118-V121 HydrophobicContact CD2-CG2 4.24Å; F118-V121 VanDerWaalsContact O-CB 3.23Å; F118-V121 WeakPolarHBondContact O-CB 3.46Å; F118-V121 WeakPolarHBondContact O-CG2 3.34Å; F118-V121 PolarHBondContact O-N 3.1Å; F118-L140 HydrophobicContact CE2-CD2 4.42Å; F118-V153 HydrophobicContact CB-CG1 4.21Å; F118-V153 HydrophobicContact CB-CG2 3.67Å; F118-V153 HydrophobicContact CD1-CG1 3.86Å; F118-V153 HydrophobicContact CD1-CG2 4.38Å; F118-V153 HydrophobicContact CD2-CG1 3.79Å; F118-V153 HydrophobicContact CE1-CG1 4.12Å; F118-V153 HydrophobicContact CE2-CG1 4.06Å; F118-V153 HydrophobicContact CG-CG1 3.68Å; F118-V153 HydrophobicContact CG-CG2 4.05Å; F118-V153 HydrophobicContact CZ-CG1 4.21Å; F118-D157 HydrophobicContact CE1-CB 4.11Å; F118-D157 HydrophobicContact CZ-CB 4.05Å; F118-A158 HydrophobicContact CE2-CB 3.95Å; F118-A158 HydrophobicContact CZ-CB 4.46Å; F118-L161 HydrophobicContact CE1-CD1 4.31Å; F118-L161 HydrophobicContact CE2-CD1 4.16Å; F118-L161 HydrophobicContact CZ-CB 4.16Å; F118-L161 HydrophobicContact CZ-CD1 3.78Å
119	E	98.1	Very high	96.3	Very high	125 Å²	125	37.8 Å²	37.8	58%	0.584	18%	0.179	S	C	*	.	H	α-helix	trans	-64.1	-26	174.3	-68.2	172.9	174.3	0	0	112.7	R115 S116 P122	R115-E119 HydrophobicContact CG-CG 4.41Å; R115-E119 IonicContact NE-OE1 2.72Å; R115-E119 PolarHBondContact O-N 3.41Å; S116-E119 PolarHBondContact O-N 2.92Å; E119-P122 WeakPolarHBondContact O-CD 3.44Å
120	S	96.7	Very high	95.9	Very high	33 Å²	33	44.1 Å²	44.1	23%	0.231	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.2	171.4	-60.8	0	0	0	0	114	D38 S116 F118 H123 W124	D38-S120 WeakPolarHBondContact OD1-CB 3.26Å; D38-S120 PolarHBondContact OD1-OG 3.13Å; D38-S120 WeakPolarHBondContact OD2-CB 3.17Å; D38-S120 PolarHBondContact OD2-OG 2.97Å; S116-S120 PolarHBondContact O-N 2.8Å; S116-S120 VanDerWaalsContact O-N 3.13Å; S116-S120 PolarHBondContact O-OG 3.34Å; F118-S120 PolarHBondContact O-N 2.85Å; S120-H123 VanDerWaalsContact O-CB 3.32Å; S120-H123 WeakPolarHBondContact O-CB 3.25Å; S120-H123 PolarHBondContact O-N 3.24Å; S120-W124 PolarHBondContact O-N 3.38Å
121	V	97.1	Very high	95.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-54.7	-46.7	-175.1	167.7	0	0	0	0	113.4	V108 Y110 F118 H123 W124 I125 L140 L161	V108-V121 HydrophobicContact CG1-CG1 4.05Å; V108-V121 HydrophobicContact CG1-CG2 4.32Å; Y110-V121 HydrophobicContact CD1-CG2 4.13Å; Y110-V121 HydrophobicContact CG-CG2 4.26Å; F118-V121 HydrophobicContact CD2-CG2 4.24Å; F118-V121 VanDerWaalsContact O-CB 3.23Å; F118-V121 WeakPolarHBondContact O-CB 3.46Å; F118-V121 WeakPolarHBondContact O-CG2 3.34Å; F118-V121 PolarHBondContact O-N 3.1Å; V121-H123 PolarHBondContact O-N 3.29Å; V121-H123 VanDerWaalsContact O-N 3.15Å; V121-W124 PolarHBondContact O-N 2.87Å; V121-I125 HydrophobicContact CG1-CD1 3.7Å; V121-I125 HydrophobicContact CG1-CG1 4.2Å; V121-I125 WeakPolarHBondContact O-CG1 3.29Å; V121-I125 PolarHBondContact O-N 2.87Å; V121-L140 HydrophobicContact CB-CD1 4.43Å; V121-L140 HydrophobicContact CG1-CD1 3.55Å; V121-L140 HydrophobicContact CG2-CD1 3.96Å; V121-L161 HydrophobicContact CG1-CD1 4.38Å; V121-L161 HydrophobicContact CG1-CD2 3.62Å
122	P	96.8	Very high	94.9	Very high	38 Å²	38	48.3 Å²	48.3	25%	0.247	23%	0.23	C	C	.	.	H	α-helix	trans	-57	-31.2	176.8	-26.2	35.1	0	0	0	113.7	E119 R126 L161	E119-P122 WeakPolarHBondContact O-CD 3.44Å; P122-R126 WeakPolarHBondContact O-CG 3.42Å; P122-R126 PolarHBondContact O-N 2.98Å; P122-R126 PolarHBondContact O-NH1 3.3Å; P122-L161 HydrophobicContact CG-CD1 4.1Å
123	H	94.3	Very high	94.3	Very high	62 Å²	62	50 Å²	50	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-70.6	-43.2	175.8	170.5	39.2	0	0	0	111.7	R93 S120 V121 R126 E127	R93-H123 PolarHBondContact NH1-NE2 3.19Å; R93-H123 PolarHBondContact NH2-NE2 3.11Å; S120-H123 VanDerWaalsContact O-CB 3.32Å; S120-H123 WeakPolarHBondContact O-CB 3.25Å; S120-H123 PolarHBondContact O-N 3.24Å; V121-H123 PolarHBondContact O-N 3.29Å; V121-H123 VanDerWaalsContact O-N 3.15Å; H123-R126 PolarHBondContact O-N 2.86Å; H123-E127 IonicContact CE1-OE2 2.71Å; H123-E127 PolarHBondContact O-N 3.26Å
124	W	94.3	Very high	93.5	Very high	5 Å²	5	55.2 Å²	55.2	2%	0.019	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-38.9	176.4	-67.1	113.1	0	0	0	112.7	V36 G37 D38 V108 S120 V121 E127 V128	V36-W124 HydrophobicContact CB-CE3 4.08Å; V36-W124 HydrophobicContact CG2-CB 4.3Å; G37-W124 VanDerWaalsContact C-CE2 3.48Å; G37-W124 VanDerWaalsContact C-CZ2 3.5Å; G37-W124 WeakPolarHBondContact O-CZ2 3.27Å; D38-W124 PolarHBondContact OD1-NE1 2.66Å; V108-W124 HydrophobicContact CG1-CB 3.7Å; V108-W124 HydrophobicContact CG1-CG 4.43Å; S120-W124 PolarHBondContact O-N 3.38Å; V121-W124 PolarHBondContact O-N 2.87Å; W124-E127 WeakPolarHBondContact CZ3-OE1 3.33Å; W124-E127 PolarHBondContact O-N 3.2Å; W124-V128 WeakPolarHBondContact O-CG2 3.5Å; W124-V128 PolarHBondContact O-N 3.35Å
125	I	94.9	Very high	93	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-50.3	173.6	-66.8	167.1	0	0	0	110	V108 V121 E127 V128 E129 L161 N165 L167	V108-I125 HydrophobicContact CG2-CG1 4.31Å; V121-I125 HydrophobicContact CG1-CD1 3.7Å; V121-I125 HydrophobicContact CG1-CG1 4.2Å; V121-I125 WeakPolarHBondContact O-CG1 3.29Å; V121-I125 PolarHBondContact O-N 2.87Å; I125-E127 VanDerWaalsContact C-N 3.27Å; I125-E127 PolarHBondContact O-N 3.2Å; I125-V128 WeakPolarHBondContact O-CB 3.49Å; I125-V128 PolarHBondContact O-N 3.49Å; I125-V128 VanDerWaalsContact O-N 3.13Å; I125-E129 HydrophobicContact CG2-CG 4.4Å; I125-E129 WeakPolarHBondContact O-CG 3.44Å; I125-E129 PolarHBondContact O-N 2.72Å; I125-L161 HydrophobicContact CD1-CD2 3.73Å; I125-N165 HydrophobicContact CD1-CB 4.29Å; I125-N165 HydrophobicContact CG2-CB 4.49Å; I125-L167 HydrophobicContact CD1-CD1 3.82Å; I125-L167 HydrophobicContact CD1-CD2 4.22Å; I125-L167 HydrophobicContact CG1-CD1 4.46Å; I125-L167 HydrophobicContact CG1-CD2 4.43Å; I125-L167 HydrophobicContact CG2-CD2 4.31Å
126	R	93.1	Very high	92.8	Very high	138 Å²	138	52.6 Å²	52.6	52%	0.521	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-37.2	176.8	-74.2	-171.8	-61	-88.4	3.6	112.8	P122 H123 E129 Q130	P122-R126 WeakPolarHBondContact O-CG 3.42Å; P122-R126 PolarHBondContact O-N 2.98Å; P122-R126 PolarHBondContact O-NH1 3.3Å; H123-R126 PolarHBondContact O-N 2.86Å; R126-E129 PolarHBondContact O-N 3.42Å; R126-Q130 WeakPolarHBondContact O-CB 3.49Å; R126-Q130 PolarHBondContact O-N 2.87Å
127	E	90.4	Very high	92.8	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.065	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-43.6	176.9	-167.5	171.7	110.4	0	0	111.2	Y100 H123 W124 I125 Q130 Y131	Y100-E127 HydrophobicContact CE1-CG 4.33Å; Y100-E127 PolarHBondContact OH-OE1 3.15Å; H123-E127 IonicContact CE1-OE2 2.71Å; H123-E127 PolarHBondContact O-N 3.26Å; W124-E127 WeakPolarHBondContact CZ3-OE1 3.33Å; W124-E127 PolarHBondContact O-N 3.2Å; I125-E127 VanDerWaalsContact C-N 3.27Å; I125-E127 PolarHBondContact O-N 3.2Å; E127-Q130 PolarHBondContact O-N 3.48Å; E127-Y131 HydrophobicContact CG-CD2 3.69Å; E127-Y131 HydrophobicContact CG-CE2 3.82Å; E127-Y131 VanDerWaalsContact O-CD2 3.25Å; E127-Y131 WeakPolarHBondContact O-CD2 3.29Å; E127-Y131 PolarHBondContact O-N 3.27Å; E127-Y131 VanDerWaalsContact O-N 3.11Å
128	V	92.4	Very high	92.8	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-45.1	174.1	173.7	0	0	0	0	111.3	I34 V36 Y100 A106 W124 I125 G132 V136 V138	I34-V128 HydrophobicContact CD1-CG2 4.22Å; V36-V128 HydrophobicContact CG2-CG2 3.99Å; Y100-V128 HydrophobicContact CD1-CG2 4.28Å; Y100-V128 HydrophobicContact CE1-CB 4.44Å; Y100-V128 HydrophobicContact CE1-CG2 3.8Å; A106-V128 HydrophobicContact CB-CB 4.47Å; A106-V128 HydrophobicContact CB-CG1 3.66Å; A106-V128 HydrophobicContact CB-CG2 3.91Å; W124-V128 WeakPolarHBondContact O-CG2 3.5Å; W124-V128 PolarHBondContact O-N 3.35Å; I125-V128 WeakPolarHBondContact O-CB 3.49Å; I125-V128 PolarHBondContact O-N 3.49Å; I125-V128 VanDerWaalsContact O-N 3.13Å; V128-G132 WeakPolarHBondContact O-CA 3.22Å; V128-G132 PolarHBondContact O-N 2.91Å; V128-V136 HydrophobicContact CG1-CG1 3.72Å; V128-V138 HydrophobicContact CG1-CG2 4.09Å
129	E	91.6	Very high	92.8	Very high	117 Å²	117	49.5 Å²	49.5	55%	0.547	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-37.1	179	-70	171.2	165.6	0	0	112.6	I125 R126	I125-E129 HydrophobicContact CG2-CG 4.4Å; I125-E129 WeakPolarHBondContact O-CG 3.44Å; I125-E129 PolarHBondContact O-N 2.72Å; R126-E129 PolarHBondContact O-N 3.42Å
130	Q	90.9	Very high	92.8	Very high	134 Å²	134	43.6 Å²	43.6	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-72.4	-39.6	-177.1	-179.3	176.4	-7.1	0	0	112.7	R126 E127	R126-Q130 WeakPolarHBondContact O-CB 3.49Å; R126-Q130 PolarHBondContact O-N 2.87Å; E127-Q130 PolarHBondContact O-N 3.48Å
131	Y	88.8	Confident	92.9	Very high	73 Å²	73	42 Å²	42	29%	0.286	23%	0.234	S	C	.	.	H	α-helix	trans	-108.5	-16.2	-173.3	-58.7	-64.9	0	0	0	113.8	Q97 Y100 R101 E127	Q97-Y131 HydrophobicContact CG-CD1 4.13Å; Q97-Y131 HydrophobicContact CG-CD2 4.23Å; Q97-Y131 HydrophobicContact CG-CE1 4.08Å; Q97-Y131 HydrophobicContact CG-CE2 4.19Å; Q97-Y131 HydrophobicContact CG-CG 4.21Å; Q97-Y131 PolarHBondContact NE2-OH 3.32Å; Y100-Y131 CarbonylContact C-O 3.59Å; Y100-Y131 WeakPolarHBondContact CB-O 3.47Å; R101-Y131 WeakPolarHBondContact CA-O 3.27Å; R101-Y131 PolarHBondContact N-O 2.97Å; E127-Y131 HydrophobicContact CG-CD2 3.69Å; E127-Y131 HydrophobicContact CG-CE2 3.82Å; E127-Y131 VanDerWaalsContact O-CD2 3.25Å; E127-Y131 WeakPolarHBondContact O-CD2 3.29Å; E127-Y131 PolarHBondContact O-N 3.27Å; E127-Y131 VanDerWaalsContact O-N 3.11Å
132	G	87.2	Confident	93	Very high	17 Å²	17	42 Å²	42	18%	0.175	23%	0.234	C	C	.	.	S	Bend	trans	-82.3	175.4	179.6	0	0	0	0	0	113.7	Y100 V128	Y100-G132 WeakPolarHBondContact O-CA 3.35Å; V128-G132 WeakPolarHBondContact O-CA 3.22Å; V128-G132 PolarHBondContact O-N 2.91Å
133	A	85	Confident	93.1	Very high	36 Å²	36	40.3 Å²	40.3	30%	0.298	22%	0.223	S	C	.	.			trans	-71.7	148.2	168.1	0	0	0	0	0	110.4	S135 V136	A133-S135 PolarHBondContact O-N 3.41Å; A133-V136 HydrophobicContact CB-CG2 4.12Å; A133-V136 WeakPolarHBondContact O-CB 3.36Å; A133-V136 VanDerWaalsContact O-CG2 3.22Å; A133-V136 WeakPolarHBondContact O-CG2 3.44Å; A133-V136 PolarHBondContact O-N 3.41Å; A133-V136 VanDerWaalsContact O-N 3.08Å
134	A	82.1	Confident	93.3	Very high	121 Å²	121	39.2 Å²	39.2	100%	1	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.3	-179.5	0	0	0	0	0	114
135	S	87.3	Confident	93.4	Very high	87 Å²	87	39.5 Å²	39.5	61%	0.608	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	7.7	-178.5	55.6	0	0	0	0	114.5	A133 V137 R195	A133-S135 PolarHBondContact O-N 3.41Å; S135-V137 PolarHBondContact O-N 3.05Å; S135-R195 PolarHBondContact O-NH1 3.23Å
136	V	94.6	Very high	93.6	Very high	20 Å²	20	40.7 Å²	40.7	12%	0.121	23%	0.227	C	C	.	.			trans	-55.7	126.3	-178.3	166	0	0	0	0	110.8	A103 H104 A106 V128 A133 V138	A103-V136 HydrophobicContact CB-CG2 4.36Å; A103-V136 VanDerWaalsContact O-CG2 3.27Å; A103-V136 WeakPolarHBondContact O-CG2 3.46Å; H104-V136 WeakPolarHBondContact O-CA 3.38Å; A106-V136 HydrophobicContact CB-CG1 3.89Å; V128-V136 HydrophobicContact CG1-CG1 3.72Å; A133-V136 HydrophobicContact CB-CG2 4.12Å; A133-V136 WeakPolarHBondContact O-CB 3.36Å; A133-V136 VanDerWaalsContact O-CG2 3.22Å; A133-V136 WeakPolarHBondContact O-CG2 3.44Å; A133-V136 PolarHBondContact O-N 3.41Å; A133-V136 VanDerWaalsContact O-N 3.08Å; V136-V138 HydrophobicContact CG1-CG2 3.96Å
137	V	96.9	Very high	93.8	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	122	172.3	174.6	0	0	0	0	109.3	H104 G105 A106 S135 L168 E191 L192 R195	H104-V137 PolarHBondContact O-N 3.42Å; G105-V137 CarbonylContact C-O 3.54Å; G105-V137 WeakPolarHBondContact CA-O 3.38Å; A106-V137 PolarHBondContact N-O 2.87Å; S135-V137 PolarHBondContact O-N 3.05Å; V137-L168 HydrophobicContact CG1-CB 4.07Å; V137-L168 HydrophobicContact CG1-CD2 3.73Å; V137-L168 HydrophobicContact CG1-CG 4.45Å; V137-E191 HydrophobicContact CG1-CB 4.34Å; V137-E191 HydrophobicContact CG1-CG 3.8Å; V137-E191 HydrophobicContact CG2-CG 3.83Å; V137-L192 HydrophobicContact CB-CD2 4Å; V137-L192 HydrophobicContact CG2-CD2 3.51Å; V137-L192 HydrophobicContact CG2-CG 4.26Å; V137-R195 VanDerWaalsContact CG2-CZ 3.43Å
138	V	97.9	Very high	94	Very high	16 Å²	16	42.1 Å²	42.1	10%	0.097	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.4	-179.6	-171.3	0	0	0	0	111.1	A106 V108 V128 V136 L167 L168	A106-V138 HydrophobicContact CB-CG2 4.39Å; A106-V138 CarbonylContact O-C 3.19Å; A106-V138 VanDerWaalsContact O-CA 3.31Å; A106-V138 WeakPolarHBondContact O-CA 3.32Å; V108-V138 HydrophobicContact CG2-CG1 3.8Å; V128-V138 HydrophobicContact CG1-CG2 4.09Å; V136-V138 HydrophobicContact CG1-CG2 3.96Å; V138-L167 HydrophobicContact CB-CD2 3.83Å; V138-L167 HydrophobicContact CG1-CD1 4.43Å; V138-L167 HydrophobicContact CG1-CD2 3.83Å; V138-L168 WeakPolarHBondContact O-CB 3.32Å; V138-L168 PolarHBondContact O-N 3.37Å
139	V	98.5	Very high	94.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.1	171.1	176.4	0	0	0	0	109.1	A106 M107 V108 V141 L168 L171 M188	A106-V139 PolarHBondContact O-N 3.37Å; M107-V139 WeakPolarHBondContact CA-O 3.42Å; V108-V139 PolarHBondContact N-O 2.76Å; V139-V141 HydrophobicContact CG1-CG2 4.03Å; V139-L168 HydrophobicContact CG2-CB 4.06Å; V139-L168 HydrophobicContact CG2-CD2 3.78Å; V139-L168 HydrophobicContact CG2-CG 4.34Å; V139-L171 HydrophobicContact CG1-CD1 4.13Å; V139-M188 HydrophobicContact CB-CE 3.93Å; V139-M188 HydrophobicContact CG2-CE 3.69Å
140	L	98.7	Very high	94.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.2	173.4	179.8	61.7	0	0	0	109.9	V108 Y110 F118 V121 A158 L161 A162 L167 A169 A170 L171	V108-L140 HydrophobicContact CB-CD1 4.37Å; V108-L140 HydrophobicContact CG1-CD1 4.4Å; V108-L140 WeakPolarHBondContact O-CD1 3.36Å; Y110-L140 HydrophobicContact CD1-CD1 3.73Å; Y110-L140 HydrophobicContact CD1-CG 4.27Å; Y110-L140 HydrophobicContact CE1-CD1 3.92Å; Y110-L140 HydrophobicContact CE1-CD2 4.33Å; Y110-L140 HydrophobicContact CE1-CG 3.93Å; F118-L140 HydrophobicContact CE2-CD2 4.42Å; V121-L140 HydrophobicContact CB-CD1 4.43Å; V121-L140 HydrophobicContact CG1-CD1 3.55Å; V121-L140 HydrophobicContact CG2-CD1 3.96Å; L140-A158 HydrophobicContact CD2-CB 3.98Å; L140-A158 WeakPolarHBondContact CD2-O 3.48Å; L140-L161 HydrophobicContact CD2-CD2 3.94Å; L140-A162 HydrophobicContact CD2-CB 4.49Å; L140-L167 HydrophobicContact CB-CD1 3.93Å; L140-A169 PolarHBondContact N-O 2.85Å; L140-A170 HydrophobicContact CB-CB 4.33Å; L140-A170 HydrophobicContact CD2-CB 4.31Å; L140-A170 CarbonylContact O-C 3.57Å; L140-A170 WeakPolarHBondContact O-CA 3.35Å; L140-L171 PolarHBondContact O-N 3.4Å
141	V	98.7	Very high	94.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	111.5	-176.2	-173.4	0	0	0	0	111.6	M46 M107 V108 A109 Y110 V139 N143 L171 T173	M46-V141 HydrophobicContact CE-CB 4.23Å; M46-V141 HydrophobicContact CE-CG1 3.57Å; M46-V141 HydrophobicContact CE-CG2 4.38Å; M46-V141 HydrophobicContact SD-CG1 4.2Å; M107-V141 HydrophobicContact CB-CG2 4.49Å; V108-V141 PolarHBondContact O-N 2.9Å; A109-V141 CarbonylContact C-O 3.5Å; A109-V141 VanDerWaalsContact CA-O 3.29Å; A109-V141 WeakPolarHBondContact CA-O 3.35Å; Y110-V141 WeakPolarHBondContact CD1-O 3.47Å; Y110-V141 PolarHBondContact N-O 2.83Å; V139-V141 HydrophobicContact CG1-CG2 4.03Å; V141-N143 PolarHBondContact O-N 3.47Å; V141-L171 CarbonylContact C-O 3.6Å; V141-L171 WeakPolarHBondContact CA-O 3.37Å; V141-T173 HydrophobicContact CG1-CG2 3.55Å; V141-T173 VanDerWaalsContact CG1-OG1 3.29Å; V141-T173 WeakPolarHBondContact CG1-OG1 3.08Å
142	G	98.6	Very high	95.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	98.4	169	0	0	0	0	0	110.9	L171 E172 T173	G142-L171 PolarHBondContact N-O 3.35Å; G142-E172 CarbonylContact O-C 3.4Å; G142-E172 WeakPolarHBondContact O-CA 3.4Å; G142-T173 PolarHBondContact O-N 3.19Å
143	N	98.5	Very high	95.9	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.011	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	168.6	-177.8	-166.6	33.9	0	0	0	112.3	V41 M46 Y110 I112 V141 T173 A175	V41-N143 PolarHBondContact O-ND2 3.02Å; M46-N143 HydrophobicContact SD-CB 4.08Å; Y110-N143 PolarHBondContact O-N 2.9Å; I112-N143 PolarHBondContact N-O 3.34Å; V141-N143 PolarHBondContact O-N 3.47Å; N143-T173 CarbonylContact C-O 3.58Å; N143-T173 WeakPolarHBondContact CA-O 3.3Å; N143-T173 PolarHBondContact OD1-O 3.34Å; N143-T173 PolarHBondContact OD1-OG1 3.05Å; N143-A175 PolarHBondContact OD1-N 3.49Å
144	K	98.1	Very high	96.5	Very high	39 Å²	39	47.5 Å²	47.5	17%	0.17	27%	0.272	C	S	.	.			trans	66.1	36.3	-176.7	-46	-169.2	-167.3	169.6	0	113.6	D40 D111 I112 D146 L147 T173	D40-K144 VanDerWaalsContact O-CE 3.22Å; D40-K144 WeakPolarHBondContact O-CE 3.3Å; D40-K144 PolarHBondContact O-NZ 3Å; D40-K144 IonicContact OD2-NZ 2.8Å; D111-K144 WeakPolarHBondContact OD2-CD 3.46Å; D111-K144 VanDerWaalsContact OD2-CE 3.23Å; D111-K144 WeakPolarHBondContact OD2-CE 3.47Å; D111-K144 IonicContact OD2-NZ 3.79Å; D111-K144 PolarHBondContact OD2-NZ 3.04Å; I112-K144 WeakPolarHBondContact CG1-O 3.16Å; K144-D146 WeakPolarHBondContact CA-OD1 2.89Å; K144-D146 PolarHBondContact O-N 3.43Å; K144-D146 VanDerWaalsContact O-N 3.13Å; K144-L147 HydrophobicContact CB-CD1 4.01Å; K144-L147 HydrophobicContact CB-CG 4.24Å; K144-L147 HydrophobicContact CD-CD1 4.01Å; K144-L147 WeakPolarHBondContact O-CB 3.22Å; K144-L147 PolarHBondContact O-N 2.89Å; K144-T173 PolarHBondContact N-O 2.9Å
145	S	98.3	Very high	97.3	Very high	11 Å²	11	45.5 Å²	45.5	8%	0.077	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-57.6	-21.8	175	47.9	0	0	0	0	114.3	L147 H148 T173 S174 Q179	S145-L147 PolarHBondContact O-N 3.41Å; S145-H148 PolarHBondContact O-N 3.45Å; S145-T173 PolarHBondContact N-O 3.42Å; S145-T173 PolarHBondContact OG-O 3.06Å; S145-S174 WeakPolarHBondContact OG-CB 3.32Å; S145-S174 PolarHBondContact OG-N 3.29Å; S145-Q179 PolarHBondContact OG-OE1 3.49Å
146	D	98.1	Very high	97.8	Very high	26 Å²	26	47.1 Å²	47.1	14%	0.139	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-58	-27.6	169.8	55.3	-76.7	0	0	0	112.8	K144 H148 S174 K176 E177	K144-D146 WeakPolarHBondContact CA-OD1 2.89Å; K144-D146 PolarHBondContact O-N 3.43Å; K144-D146 VanDerWaalsContact O-N 3.13Å; D146-H148 PolarHBondContact O-N 3.03Å; D146-H148 VanDerWaalsContact O-N 3.13Å; D146-H148 PolarHBondContact O-ND1 3.39Å; D146-H148 VanDerWaalsContact O-ND1 3.15Å; D146-S174 WeakPolarHBondContact OD1-CB 3.25Å; D146-S174 PolarHBondContact OD1-OG 3.1Å; D146-K176 WeakPolarHBondContact OD2-CD 3.25Å; D146-E177 HydrophobicContact CB-CG 3.9Å
147	L	97.1	Very high	98	Very high	46 Å²	46	48.8 Å²	48.8	24%	0.241	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-84.1	34.3	175.7	-55.7	-178.6	0	0	0	113.3	K144 S145 A149 Q150 R151	K144-L147 HydrophobicContact CB-CD1 4.01Å; K144-L147 HydrophobicContact CB-CG 4.24Å; K144-L147 HydrophobicContact CD-CD1 4.01Å; K144-L147 WeakPolarHBondContact O-CB 3.22Å; K144-L147 PolarHBondContact O-N 2.89Å; S145-L147 PolarHBondContact O-N 3.41Å; L147-A149 PolarHBondContact O-N 3.41Å; L147-A149 VanDerWaalsContact O-N 3.08Å; L147-Q150 PolarHBondContact O-N 3.18Å; L147-R151 PolarHBondContact O-N 3.02Å
148	H	95	Very high	98.1	Very high	136 Å²	136	48.8 Å²	48.8	63%	0.63	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-50.9	-34.6	-179	65.9	-78.1	0	0	0	114.2	S145 D146 Q150 R151	S145-H148 PolarHBondContact O-N 3.45Å; D146-H148 PolarHBondContact O-N 3.03Å; D146-H148 VanDerWaalsContact O-N 3.13Å; D146-H148 PolarHBondContact O-ND1 3.39Å; D146-H148 VanDerWaalsContact O-ND1 3.15Å; H148-Q150 PolarHBondContact O-N 2.93Å; H148-R151 VanDerWaalsContact O-CB 3.25Å; H148-R151 WeakPolarHBondContact O-CB 3.27Å; H148-R151 PolarHBondContact O-N 3.46Å
149	A	97.6	Very high	98.1	Very high	90 Å²	90	49.7 Å²	49.7	74%	0.744	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-68.1	-19.1	177.3	0	0	0	0	0	114	L147	L147-A149 PolarHBondContact O-N 3.41Å; L147-A149 VanDerWaalsContact O-N 3.08Å
150	Q	97.8	Very high	98.1	Very high	121 Å²	121	53.9 Å²	53.9	57%	0.565	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-107.9	13.6	179.1	-59.2	175.6	29.8	0	0	111.7	S113 L147 H148 Q152	S113-Q150 WeakPolarHBondContact CA-O 3.48Å; L147-Q150 PolarHBondContact O-N 3.18Å; H148-Q150 PolarHBondContact O-N 2.93Å; Q150-Q152 PolarHBondContact O-N 3.02Å
151	R	98.4	Very high	98.1	Very high	78 Å²	78	55 Å²	55	29%	0.294	29%	0.285	S	S	.	.			trans	-57.3	129.2	-176.7	178.2	-179.9	-70.9	-85.7	6.2	111.4	I112 L147 H148 V153 E172	I112-R151 HydrophobicContact CD1-CB 4.48Å; L147-R151 PolarHBondContact O-N 3.02Å; H148-R151 VanDerWaalsContact O-CB 3.25Å; H148-R151 WeakPolarHBondContact O-CB 3.27Å; H148-R151 PolarHBondContact O-N 3.46Å; R151-V153 WeakPolarHBondContact CD-O 3.45Å; R151-V153 WeakPolarHBondContact CG-O 3.49Å; R151-V153 PolarHBondContact NH1-O 2.77Å; R151-E172 IonicContact CZ-OE1 3.66Å; R151-E172 IonicContact CZ-OE2 3.11Å; R151-E172 IonicContact NH1-OE1 3.7Å; R151-E172 PolarHBondContact NH1-OE1 2.85Å; R151-E172 IonicContact NH1-OE2 3.68Å; R151-E172 IonicContact NH2-OE1 3.41Å; R151-E172 PolarHBondContact NH2-OE1 3.3Å; R151-E172 IonicContact NH2-OE2 3.62Å; R151-E172 PolarHBondContact NH2-OE2 3.19Å
152	Q	98.6	Very high	98	Very high	109 Å²	109	55.2 Å²	55.2	51%	0.509	29%	0.287	S	S	.	.			trans	-118.6	-10.1	174.3	-60.2	-176.5	5.4	0	0	113	I112 S113 R115 Q150	I112-Q152 PolarHBondContact O-N 3.27Å; S113-Q152 WeakPolarHBondContact O-CG 3.31Å; S113-Q152 PolarHBondContact O-NE2 2.84Å; S113-Q152 PolarHBondContact O-OE1 3.08Å; R115-Q152 HydrophobicContact CB-CB 4.12Å; Q150-Q152 PolarHBondContact O-N 3.02Å
153	V	98.4	Very high	98	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	-124.1	123.1	179.7	-174.1	0	0	0	0	108.5	Y110 I112 F118 R151	Y110-V153 HydrophobicContact CD2-CG2 4.47Å; Y110-V153 HydrophobicContact CE2-CB 3.96Å; Y110-V153 HydrophobicContact CE2-CG1 3.73Å; Y110-V153 HydrophobicContact CE2-CG2 4.23Å; I112-V153 PolarHBondContact O-N 3.28Å; F118-V153 HydrophobicContact CB-CG1 4.21Å; F118-V153 HydrophobicContact CB-CG2 3.67Å; F118-V153 HydrophobicContact CD1-CG1 3.86Å; F118-V153 HydrophobicContact CD1-CG2 4.38Å; F118-V153 HydrophobicContact CD2-CG1 3.79Å; F118-V153 HydrophobicContact CE1-CG1 4.12Å; F118-V153 HydrophobicContact CE2-CG1 4.06Å; F118-V153 HydrophobicContact CG-CG1 3.68Å; F118-V153 HydrophobicContact CG-CG2 4.05Å; F118-V153 HydrophobicContact CZ-CG1 4.21Å; R151-V153 WeakPolarHBondContact CD-O 3.45Å; R151-V153 WeakPolarHBondContact CG-O 3.49Å; R151-V153 PolarHBondContact NH1-O 2.77Å
154	L	98.2	Very high	98	Very high	94 Å²	94	70.6 Å²	70.6	49%	0.492	36%	0.356	S	S	.	.			trans	-75.5	148.4	174.6	-66.8	179.7	0	0	0	109.9	E156 D157 A158	L154-E156 WeakPolarHBondContact CB-OE2 3.2Å; L154-E156 PolarHBondContact O-N 2.86Å; L154-D157 WeakPolarHBondContact O-CB 3.46Å; L154-D157 PolarHBondContact O-N 2.76Å; L154-A158 PolarHBondContact O-N 3.06Å
155	F	98.1	Very high	97.9	Very high	79 Å²	79	71.3 Å²	71.3	35%	0.346	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-34.3	178.3	-176.8	-121.8	0	0	0	110.9	D157 A158 C159 A170 E172	F155-D157 VanDerWaalsContact C-N 3.3Å; F155-D157 PolarHBondContact O-N 3.01Å; F155-A158 WeakPolarHBondContact O-CB 3.14Å; F155-A158 PolarHBondContact O-N 3.22Å; F155-C159 WeakPolarHBondContact CE1-SG 3.4Å; F155-C159 VanDerWaalsContact CZ-SG 3.59Å; F155-C159 PolarHBondContact O-N 3.42Å; F155-C159 PolarHBondContact O-SG 3.11Å; F155-C159 VanDerWaalsContact O-SG 3.42Å; F155-A170 HydrophobicContact CE2-CB 4.2Å; F155-E172 HydrophobicContact CD2-CG 3.52Å; F155-E172 HydrophobicContact CE2-CG 3.91Å; F155-E172 HydrophobicContact CG-CG 4.38Å
156	E	98.4	Very high	97.8	Very high	122 Å²	122	76.1 Å²	76.1	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-60.9	-36.3	176.6	-61.3	84.5	177.3	0	0	112.7	L154 A158 C159 T160	L154-E156 WeakPolarHBondContact CB-OE2 3.2Å; L154-E156 PolarHBondContact O-N 2.86Å; E156-A158 VanDerWaalsContact C-N 3.31Å; E156-A158 PolarHBondContact O-N 2.67Å; E156-C159 PolarHBondContact O-N 3.39Å; E156-T160 WeakPolarHBondContact O-CB 3.42Å; E156-T160 PolarHBondContact O-N 2.92Å; E156-T160 PolarHBondContact O-OG1 3.3Å
157	D	98.3	Very high	97.8	Very high	55 Å²	55	75.9 Å²	75.9	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-42.3	174.7	-74.8	-10.8	0	0	0	110.3	R115 F118 L154 F155 L161	R115-D157 IonicContact NH1-OD2 2.84Å; R115-D157 PolarHBondContact NH1-OD2 3.23Å; R115-D157 VanDerWaalsContact NH1-OD2 3.11Å; F118-D157 HydrophobicContact CE1-CB 4.11Å; F118-D157 HydrophobicContact CZ-CB 4.05Å; L154-D157 WeakPolarHBondContact O-CB 3.46Å; L154-D157 PolarHBondContact O-N 2.76Å; F155-D157 VanDerWaalsContact C-N 3.3Å; F155-D157 PolarHBondContact O-N 3.01Å; D157-L161 WeakPolarHBondContact O-CB 3.25Å; D157-L161 PolarHBondContact O-N 2.6Å
158	A	98.3	Very high	97.8	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-69.6	-40.6	179.2	0	0	0	0	0	112.3	Y110 F118 L140 L154 F155 E156 L161 A162 A170	Y110-A158 HydrophobicContact CE1-CB 4.3Å; Y110-A158 VanDerWaalsContact OH-CB 3.22Å; Y110-A158 WeakPolarHBondContact OH-CB 3.34Å; F118-A158 HydrophobicContact CE2-CB 3.95Å; F118-A158 HydrophobicContact CZ-CB 4.46Å; L140-A158 HydrophobicContact CD2-CB 3.98Å; L140-A158 WeakPolarHBondContact CD2-O 3.48Å; L154-A158 PolarHBondContact O-N 3.06Å; F155-A158 WeakPolarHBondContact O-CB 3.14Å; F155-A158 PolarHBondContact O-N 3.22Å; E156-A158 VanDerWaalsContact C-N 3.31Å; E156-A158 PolarHBondContact O-N 2.67Å; A158-L161 PolarHBondContact O-N 3.39Å; A158-A162 WeakPolarHBondContact O-CB 3.21Å; A158-A162 PolarHBondContact O-N 3.12Å; A158-A170 HydrophobicContact CB-CB 4.23Å
159	C	98.4	Very high	97.9	Very high	36 Å²	36	71 Å²	71	24%	0.243	38%	0.376	C	S	.	.	H	α-helix	trans	-59.9	-48.9	172.3	-67.8	0	0	0	0	111.4	F155 E156 L161 A162 E163	F155-C159 WeakPolarHBondContact CE1-SG 3.4Å; F155-C159 VanDerWaalsContact CZ-SG 3.59Å; F155-C159 PolarHBondContact O-N 3.42Å; F155-C159 PolarHBondContact O-SG 3.11Å; F155-C159 VanDerWaalsContact O-SG 3.42Å; E156-C159 PolarHBondContact O-N 3.39Å; C159-L161 VanDerWaalsContact C-N 3.28Å; C159-L161 PolarHBondContact O-N 3.26Å; C159-A162 PolarHBondContact O-N 3.12Å; C159-A162 VanDerWaalsContact O-N 3.11Å; C159-E163 WeakPolarHBondContact O-CG 3.39Å; C159-E163 PolarHBondContact O-N 3.38Å
160	T	98.5	Very high	98	Very high	88 Å²	88	67.4 Å²	67.4	54%	0.54	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-42	178.1	-57.4	0	0	0	0	111.3	E156 K164	E156-T160 WeakPolarHBondContact O-CB 3.42Å; E156-T160 PolarHBondContact O-N 2.92Å; E156-T160 PolarHBondContact O-OG1 3.3Å; T160-K164 VanDerWaalsContact O-CB 3.25Å; T160-K164 WeakPolarHBondContact O-CB 3.3Å; T160-K164 PolarHBondContact O-N 3.2Å
161	L	98.3	Very high	98	Very high	24 Å²	24	63.4 Å²	63.4	13%	0.126	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-41.7	176.8	-171.6	148.8	0	0	0	111.8	F118 V121 P122 I125 L140 D157 A158 C159 K164 N165	F118-L161 HydrophobicContact CE1-CD1 4.31Å; F118-L161 HydrophobicContact CE2-CD1 4.16Å; F118-L161 HydrophobicContact CZ-CB 4.16Å; F118-L161 HydrophobicContact CZ-CD1 3.78Å; V121-L161 HydrophobicContact CG1-CD1 4.38Å; V121-L161 HydrophobicContact CG1-CD2 3.62Å; P122-L161 HydrophobicContact CG-CD1 4.1Å; I125-L161 HydrophobicContact CD1-CD2 3.73Å; L140-L161 HydrophobicContact CD2-CD2 3.94Å; D157-L161 WeakPolarHBondContact O-CB 3.25Å; D157-L161 PolarHBondContact O-N 2.6Å; A158-L161 PolarHBondContact O-N 3.39Å; C159-L161 VanDerWaalsContact C-N 3.28Å; C159-L161 PolarHBondContact O-N 3.26Å; L161-K164 PolarHBondContact O-N 2.64Å; L161-N165 PolarHBondContact O-N 2.68Å; L161-N165 VanDerWaalsContact O-N 3.17Å; L161-N165 PolarHBondContact O-ND2 2.99Å
162	A	97.9	Very high	98	Very high	4 Å²	4	61.1 Å²	61.1	3%	0.033	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-46.9	177.8	0	0	0	0	0	111.9	L140 A158 C159 N165 S166 L167 A170	L140-A162 HydrophobicContact CD2-CB 4.49Å; A158-A162 WeakPolarHBondContact O-CB 3.21Å; A158-A162 PolarHBondContact O-N 3.12Å; C159-A162 PolarHBondContact O-N 3.12Å; C159-A162 VanDerWaalsContact O-N 3.11Å; A162-N165 CarbonylContact O-C 3.54Å; A162-N165 PolarHBondContact O-N 3.04Å; A162-S166 PolarHBondContact O-N 2.98Å; A162-L167 HydrophobicContact CB-CB 4.07Å; A162-L167 HydrophobicContact CB-CD1 4.11Å; A162-L167 HydrophobicContact CB-CG 4.33Å; A162-L167 PolarHBondContact O-N 2.79Å; A162-A170 HydrophobicContact CB-CB 4.04Å
163	E	97.8	Very high	98	Very high	150 Å²	150	56 Å²	56	70%	0.701	30%	0.297	S	S	*	.	H	α-helix	trans	-60.5	-47.6	176.3	-71.6	173.9	-173	0	0	111.6	C159 N165 S166	C159-E163 WeakPolarHBondContact O-CG 3.39Å; C159-E163 PolarHBondContact O-N 3.38Å; E163-N165 PolarHBondContact O-N 2.7Å; E163-S166 PolarHBondContact O-N 3.47Å
164	K	97.8	Very high	98	Very high	175 Å²	175	56 Å²	56	76%	0.761	30%	0.297	S	S	*	.	H	α-helix	trans	-58.1	-34.1	179.6	-179.8	177.8	176.5	-179.4	0	113.1	T160 L161	T160-K164 VanDerWaalsContact O-CB 3.25Å; T160-K164 WeakPolarHBondContact O-CB 3.3Å; T160-K164 PolarHBondContact O-N 3.2Å; L161-K164 PolarHBondContact O-N 2.64Å
165	N	96.4	Very high	97.9	Very high	54 Å²	54	51.6 Å²	51.6	29%	0.289	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	11.9	-179.7	-62	-86.6	0	0	0	112.7	I125 L161 A162 E163 L167	I125-N165 HydrophobicContact CD1-CB 4.29Å; I125-N165 HydrophobicContact CG2-CB 4.49Å; L161-N165 PolarHBondContact O-N 2.68Å; L161-N165 VanDerWaalsContact O-N 3.17Å; L161-N165 PolarHBondContact O-ND2 2.99Å; A162-N165 CarbonylContact O-C 3.54Å; A162-N165 PolarHBondContact O-N 3.04Å; E163-N165 PolarHBondContact O-N 2.7Å; N165-L167 HydrophobicContact CB-CD2 3.88Å; N165-L167 HydrophobicContact CB-CG 4.04Å; N165-L167 PolarHBondContact O-N 2.7Å
166	S	96.3	Very high	97.8	Very high	112 Å²	112	52.7 Å²	52.7	78%	0.783	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	36	-179.9	-54.7	0	0	0	0	113.8	A162 E163	A162-S166 PolarHBondContact O-N 2.98Å; E163-S166 PolarHBondContact O-N 3.47Å
167	L	97.8	Very high	97.8	Very high	20 Å²	20	52.8 Å²	52.8	11%	0.105	28%	0.279	C	S	.	.			trans	-74	157.2	174.2	-45	-175.2	0	0	0	109.7	I125 V138 L140 A162 N165 A169	I125-L167 HydrophobicContact CD1-CD1 3.82Å; I125-L167 HydrophobicContact CD1-CD2 4.22Å; I125-L167 HydrophobicContact CG1-CD1 4.46Å; I125-L167 HydrophobicContact CG1-CD2 4.43Å; I125-L167 HydrophobicContact CG2-CD2 4.31Å; V138-L167 HydrophobicContact CB-CD2 3.83Å; V138-L167 HydrophobicContact CG1-CD1 4.43Å; V138-L167 HydrophobicContact CG1-CD2 3.83Å; L140-L167 HydrophobicContact CB-CD1 3.93Å; A162-L167 HydrophobicContact CB-CB 4.07Å; A162-L167 HydrophobicContact CB-CD1 4.11Å; A162-L167 HydrophobicContact CB-CG 4.33Å; A162-L167 PolarHBondContact O-N 2.79Å; N165-L167 HydrophobicContact CB-CD2 3.88Å; N165-L167 HydrophobicContact CB-CG 4.04Å; N165-L167 PolarHBondContact O-N 2.7Å; L167-A169 PolarHBondContact O-N 3.4Å
168	L	97.6	Very high	97.6	Very high	55 Å²	55	52.5 Å²	52.5	29%	0.288	29%	0.285	S	S	.	.	S	Bend	trans	-60.7	-46.8	-180	176.6	64.1	0	0	0	112	V137 V138 V139 L187 E191	V137-L168 HydrophobicContact CG1-CB 4.07Å; V137-L168 HydrophobicContact CG1-CD2 3.73Å; V137-L168 HydrophobicContact CG1-CG 4.45Å; V138-L168 WeakPolarHBondContact O-CB 3.32Å; V138-L168 PolarHBondContact O-N 3.37Å; V139-L168 HydrophobicContact CG2-CB 4.06Å; V139-L168 HydrophobicContact CG2-CD2 3.78Å; V139-L168 HydrophobicContact CG2-CG 4.34Å; L168-L187 HydrophobicContact CD2-CD1 4.49Å; L168-L187 HydrophobicContact CD2-CD2 4.31Å; L168-L187 HydrophobicContact CD2-CG 3.95Å; L168-E191 HydrophobicContact CD1-CB 4.15Å; L168-E191 HydrophobicContact CD1-CG 3.76Å; L168-E191 HydrophobicContact CD2-CB 3.58Å; L168-E191 HydrophobicContact CD2-CG 3.81Å; L168-E191 HydrophobicContact CG-CG 4.38Å
169	A	97.9	Very high	97.6	Very high	25 Å²	25	56.8 Å²	56.8	21%	0.207	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	163.1	-179.1	0	0	0	0	0	111.4	L140 L167 L187	L140-A169 PolarHBondContact N-O 2.85Å; L167-A169 PolarHBondContact O-N 3.4Å; A169-L187 HydrophobicContact CB-CD2 3.69Å
170	A	98.4	Very high	97.6	Very high	14 Å²	14	58.5 Å²	58.5	12%	0.116	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136	158.3	0	0	0	0	0	109.4	L140 F155 A158 A162	L140-A170 HydrophobicContact CB-CB 4.33Å; L140-A170 HydrophobicContact CD2-CB 4.31Å; L140-A170 CarbonylContact O-C 3.57Å; L140-A170 WeakPolarHBondContact O-CA 3.35Å; F155-A170 HydrophobicContact CE2-CB 4.2Å; A158-A170 HydrophobicContact CB-CB 4.23Å; A162-A170 HydrophobicContact CB-CB 4.04Å
171	L	98.3	Very high	97.6	Very high	38 Å²	38	54.5 Å²	54.5	20%	0.199	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.3	177.7	-68	169.5	0	0	0	110	V139 L140 V141 G142 A184 L187	V139-L171 HydrophobicContact CG1-CD1 4.13Å; L140-L171 PolarHBondContact O-N 3.4Å; V141-L171 CarbonylContact C-O 3.6Å; V141-L171 WeakPolarHBondContact CA-O 3.37Å; G142-L171 PolarHBondContact N-O 3.35Å; L171-A184 HydrophobicContact CD1-CB 3.8Å; L171-L187 HydrophobicContact CD1-CD2 3.84Å; L171-L187 HydrophobicContact CG-CD2 4.44Å
172	E	98.6	Very high	97.5	Very high	30 Å²	30	57.2 Å²	57.2	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136	166.8	-62.7	-166.7	155.8	0	0	111	G142 R151 F155 N180	G142-E172 CarbonylContact O-C 3.4Å; G142-E172 WeakPolarHBondContact O-CA 3.4Å; R151-E172 IonicContact CZ-OE1 3.66Å; R151-E172 IonicContact CZ-OE2 3.11Å; R151-E172 IonicContact NH1-OE1 3.7Å; R151-E172 PolarHBondContact NH1-OE1 2.85Å; R151-E172 IonicContact NH1-OE2 3.68Å; R151-E172 IonicContact NH2-OE1 3.41Å; R151-E172 PolarHBondContact NH2-OE1 3.3Å; R151-E172 IonicContact NH2-OE2 3.62Å; R151-E172 PolarHBondContact NH2-OE2 3.19Å; F155-E172 HydrophobicContact CD2-CG 3.52Å; F155-E172 HydrophobicContact CE2-CG 3.91Å; F155-E172 HydrophobicContact CG-CG 4.38Å; E172-N180 WeakPolarHBondContact O-CB 3.42Å; E172-N180 PolarHBondContact O-ND2 2.75Å
173	T	98.6	Very high	97.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.315	C	S	.	.			trans	-129.4	157.1	-177.3	64	0	0	0	0	111.7	V141 G142 N143 K144 S145 Q179 N180 I181 A184	V141-T173 HydrophobicContact CG1-CG2 3.55Å; V141-T173 VanDerWaalsContact CG1-OG1 3.29Å; V141-T173 WeakPolarHBondContact CG1-OG1 3.08Å; G142-T173 PolarHBondContact O-N 3.19Å; N143-T173 CarbonylContact C-O 3.58Å; N143-T173 WeakPolarHBondContact CA-O 3.3Å; N143-T173 PolarHBondContact OD1-O 3.34Å; N143-T173 PolarHBondContact OD1-OG1 3.05Å; K144-T173 PolarHBondContact N-O 2.9Å; S145-T173 PolarHBondContact N-O 3.42Å; S145-T173 PolarHBondContact OG-O 3.06Å; T173-Q179 WeakPolarHBondContact CA-O 3.22Å; T173-N180 HydrophobicContact CG2-CB 3.99Å; T173-I181 HydrophobicContact CG2-CD1 4.35Å; T173-A184 HydrophobicContact CG2-CB 4.43Å
174	S	98.3	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-129.6	111.7	163.3	175.5	0	0	0	0	109	S145 D146 K176 E177 A178 Q179	S145-S174 WeakPolarHBondContact OG-CB 3.32Å; S145-S174 PolarHBondContact OG-N 3.29Å; D146-S174 WeakPolarHBondContact OD1-CB 3.25Å; D146-S174 PolarHBondContact OD1-OG 3.1Å; S174-K176 PolarHBondContact O-N 2.9Å; S174-K176 PolarHBondContact OG-N 2.86Å; S174-E177 PolarHBondContact OG-N 2.8Å; S174-A178 CarbonylContact O-C 3.54Å; S174-A178 WeakPolarHBondContact O-CA 3.45Å; S174-A178 PolarHBondContact O-N 3.31Å; S174-Q179 PolarHBondContact N-O 3.48Å; S174-Q179 PolarHBondContact O-N 3.06Å
175	A	96.7	Very high	97.5	Very high	3 Å²	3	43.8 Å²	43.8	3%	0.025	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.7	169.4	0	0	0	0	0	111.8	C45 M46 R49 F55 N143 I181	C45-A175 HydrophobicContact CB-CB 3.7Å; M46-A175 HydrophobicContact CG-CB 4.27Å; R49-A175 VanDerWaalsContact CZ-O 3.31Å; R49-A175 PolarHBondContact NE-O 2.89Å; R49-A175 PolarHBondContact NH2-O 3.12Å; F55-A175 HydrophobicContact CD2-CB 4.21Å; F55-A175 HydrophobicContact CE2-CB 4.37Å; N143-A175 PolarHBondContact OD1-N 3.49Å; A175-I181 HydrophobicContact CB-CD1 4.38Å
176	K	96.2	Very high	97.5	Very high	101 Å²	101	42.4 Å²	42.4	44%	0.439	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-44.1	179.5	-174.9	-178.9	-178.8	178	0	112.1	R49 F55 D146 S174	R49-K176 PolarHBondContact NH2-O 2.94Å; F55-K176 HydrophobicContact CD1-CG 4.3Å; F55-K176 HydrophobicContact CE1-CB 4.19Å; F55-K176 HydrophobicContact CE1-CG 3.93Å; F55-K176 HydrophobicContact CE2-CB 4.17Å; F55-K176 HydrophobicContact CZ-CB 4Å; F55-K176 HydrophobicContact CZ-CG 4.2Å; D146-K176 WeakPolarHBondContact OD2-CD 3.25Å; S174-K176 PolarHBondContact O-N 2.9Å; S174-K176 PolarHBondContact OG-N 2.86Å
177	E	96.6	Very high	97.6	Very high	124 Å²	124	39.8 Å²	39.8	58%	0.579	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	1.1	-178.9	-61.3	-175.2	167.5	0	0	113.1	D146 S174 Q179	D146-E177 HydrophobicContact CB-CG 3.9Å; S174-E177 PolarHBondContact OG-N 2.8Å; E177-Q179 PolarHBondContact O-N 2.77Å
178	A	96.1	Very high	97.6	Very high	49 Å²	49	38.9 Å²	38.9	41%	0.405	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	19.4	-172.6	0	0	0	0	0	114.1	R49 S174 N180	R49-A178 HydrophobicContact CG-CB 4.1Å; S174-A178 CarbonylContact O-C 3.54Å; S174-A178 WeakPolarHBondContact O-CA 3.45Å; S174-A178 PolarHBondContact O-N 3.31Å; A178-N180 PolarHBondContact O-N 2.83Å
179	Q	98	Very high	97.6	Very high	90 Å²	90	36.2 Å²	36.2	42%	0.421	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-72.7	128.5	-179.3	-168.1	178.7	40.7	0	0	110.8	S145 T173 S174 E177 I181	S145-Q179 PolarHBondContact OG-OE1 3.49Å; T173-Q179 WeakPolarHBondContact CA-O 3.22Å; S174-Q179 PolarHBondContact N-O 3.48Å; S174-Q179 PolarHBondContact O-N 3.06Å; E177-Q179 PolarHBondContact O-N 2.77Å; Q179-I181 PolarHBondContact O-N 2.78Å
180	N	97.7	Very high	97.5	Very high	72 Å²	72	40.9 Å²	40.9	39%	0.385	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	8.3	175.3	-63.8	-25.1	0	0	0	116.6	E172 T173 A178 A183 A184	E172-N180 WeakPolarHBondContact O-CB 3.42Å; E172-N180 PolarHBondContact O-ND2 2.75Å; T173-N180 HydrophobicContact CG2-CB 3.99Å; A178-N180 PolarHBondContact O-N 2.83Å; N180-A183 HydrophobicContact CB-CB 4.44Å; N180-A183 PolarHBondContact O-N 3Å; N180-A184 WeakPolarHBondContact O-CB 3.48Å; N180-A184 PolarHBondContact O-N 2.89Å
181	I	97.8	Very high	97.5	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-55.9	176.7	-61	-66	0	0	0	109.8	M46 R49 F50 T173 A175 Q179 A183 A184 F185	M46-I181 HydrophobicContact CB-CD1 4.11Å; M46-I181 HydrophobicContact CG-CD1 3.82Å; R49-I181 HydrophobicContact CB-CG2 4.33Å; R49-I181 HydrophobicContact CG-CB 4.35Å; R49-I181 HydrophobicContact CG-CG1 4.01Å; R49-I181 HydrophobicContact CG-CG2 4.18Å; F50-I181 HydrophobicContact CB-CG2 3.81Å; T173-I181 HydrophobicContact CG2-CD1 4.35Å; A175-I181 HydrophobicContact CB-CD1 4.38Å; Q179-I181 PolarHBondContact O-N 2.78Å; I181-A183 VanDerWaalsContact C-N 3.26Å; I181-A183 PolarHBondContact O-N 3.31Å; I181-A184 PolarHBondContact O-N 3.35Å; I181-F185 HydrophobicContact CG2-CD2 4.42Å; I181-F185 HydrophobicContact CG2-CE2 4.29Å; I181-F185 VanDerWaalsContact O-CD2 3.29Å; I181-F185 WeakPolarHBondContact O-CD2 3.27Å; I181-F185 PolarHBondContact O-N 2.85Å
182	E	96.6	Very high	97.4	Very high	82 Å²	82	41 Å²	41	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-60.5	-38.6	178.2	-163	73.1	173.3	0	0	111.9	R70 M72 A184 F185 T186	R70-E182 IonicContact CZ-OE1 3.48Å; R70-E182 IonicContact CZ-OE2 3.54Å; R70-E182 IonicContact NH1-OE1 3.38Å; R70-E182 PolarHBondContact NH1-OE1 2.87Å; R70-E182 IonicContact NH1-OE2 2.7Å; R70-E182 PolarHBondContact NH1-OE2 3.32Å; R70-E182 IonicContact NH2-OE1 2.79Å; R70-E182 PolarHBondContact NH2-OE1 2.81Å; R70-E182 IonicContact NH2-OE2 3.47Å; R70-E182 PolarHBondContact NH2-OE2 3Å; M72-E182 HydrophobicContact CE-CG 4.47Å; E182-A184 PolarHBondContact O-N 3.32Å; E182-F185 PolarHBondContact O-N 2.58Å; E182-T186 VanDerWaalsContact O-CB 3.27Å; E182-T186 WeakPolarHBondContact O-CB 3.23Å; E182-T186 PolarHBondContact O-N 3.01Å; E182-T186 PolarHBondContact O-OG1 3.16Å
183	A	97.4	Very high	97.2	Very high	45 Å²	45	40.7 Å²	40.7	37%	0.372	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-40.9	-179.7	0	0	0	0	0	112.1	N180 I181 T186 L187	N180-A183 HydrophobicContact CB-CB 4.44Å; N180-A183 PolarHBondContact O-N 3Å; I181-A183 VanDerWaalsContact C-N 3.26Å; I181-A183 PolarHBondContact O-N 3.31Å; A183-T186 PolarHBondContact O-N 3.13Å; A183-L187 VanDerWaalsContact O-CB 3.29Å; A183-L187 WeakPolarHBondContact O-CB 3.38Å; A183-L187 PolarHBondContact O-N 3.01Å
184	A	98.1	Very high	96.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-45.6	177.8	0	0	0	0	0	112.2	M107 L171 T173 N180 I181 E182 M188	M107-A184 HydrophobicContact CE-CB 4.31Å; M107-A184 WeakPolarHBondContact CE-O 3.35Å; L171-A184 HydrophobicContact CD1-CB 3.8Å; T173-A184 HydrophobicContact CG2-CB 4.43Å; N180-A184 WeakPolarHBondContact O-CB 3.48Å; N180-A184 PolarHBondContact O-N 2.89Å; I181-A184 PolarHBondContact O-N 3.35Å; E182-A184 PolarHBondContact O-N 3.32Å; A184-M188 PolarHBondContact O-N 3.2Å
185	F	97.8	Very high	96.6	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-70.3	-38	177.2	-72	-80.8	0	0	0	112.4	F50 M72 V83 M107 I181 E182 M188 A189	F50-F185 HydrophobicContact CB-CD2 3.91Å; F50-F185 HydrophobicContact CB-CE2 3.59Å; F50-F185 HydrophobicContact CB-CZ 4.22Å; F50-F185 HydrophobicContact CD1-CD1 4.15Å; F50-F185 HydrophobicContact CD1-CD2 4.03Å; F50-F185 HydrophobicContact CD1-CE1 4.1Å; F50-F185 AromaticContact CD1-CE2 4Å; F50-F185 HydrophobicContact CD1-CE2 4Å; F50-F185 HydrophobicContact CD1-CG 4.13Å; F50-F185 HydrophobicContact CD1-CZ 4.03Å; F50-F185 HydrophobicContact CD2-CB 3.94Å; F50-F185 HydrophobicContact CD2-CD1 4.45Å; F50-F185 AromaticContact CD2-CD2 3.3Å; F50-F185 HydrophobicContact CD2-CD2 3.3Å; F50-F185 AromaticContact CD2-CE2 3.9Å; F50-F185 HydrophobicContact CD2-CE2 3.9Å; F50-F185 AromaticContact CD2-CG 3.64Å; F50-F185 HydrophobicContact CD2-CG 3.64Å; F50-F185 AromaticContact CE1-CD1 3.95Å; F50-F185 HydrophobicContact CE1-CD1 3.95Å; F50-F185 HydrophobicContact CE1-CD2 4.4Å; F50-F185 HydrophobicContact CE1-CE1 4.24Å; F50-F185 HydrophobicContact CE1-CG 4.04Å; F50-F185 HydrophobicContact CE2-CB 3.45Å; F50-F185 VanDerWaalsContact CE2-CB 3.45Å; F50-F185 HydrophobicContact CE2-CD1 4.28Å; F50-F185 AromaticContact CE2-CD2 3.76Å; F50-F185 HydrophobicContact CE2-CD2 3.76Å; F50-F185 AromaticContact CE2-CG 3.57Å; F50-F185 HydrophobicContact CE2-CG 3.57Å; F50-F185 HydrophobicContact CG-CD1 4.4Å; F50-F185 AromaticContact CG-CD2 3.47Å; F50-F185 HydrophobicContact CG-CD2 3.47Å; F50-F185 VanDerWaalsContact CG-CD2 3.47Å; F50-F185 HydrophobicContact CG-CE1 4.46Å; F50-F185 AromaticContact CG-CE2 3.56Å; F50-F185 HydrophobicContact CG-CE2 3.56Å; F50-F185 AromaticContact CG-CG 3.94Å; F50-F185 HydrophobicContact CG-CG 3.94Å; F50-F185 HydrophobicContact CG-CZ 4.07Å; F50-F185 HydrophobicContact CZ-CB 3.81Å; F50-F185 HydrophobicContact CZ-CD1 4.03Å; F50-F185 HydrophobicContact CZ-CD2 4.28Å; F50-F185 AromaticContact CZ-CG 3.78Å; F50-F185 HydrophobicContact CZ-CG 3.78Å; M72-F185 HydrophobicContact CE-CB 4.25Å; M72-F185 HydrophobicContact SD-CB 4.11Å; V83-F185 HydrophobicContact CG1-CE1 4.3Å; V83-F185 HydrophobicContact CG2-CD1 4.46Å; V83-F185 HydrophobicContact CG2-CE1 3.84Å; M107-F185 HydrophobicContact CE-CB 4.39Å; M107-F185 HydrophobicContact CE-CD1 3.53Å; M107-F185 HydrophobicContact CE-CD2 4.35Å; M107-F185 HydrophobicContact CE-CE1 3.76Å; M107-F185 HydrophobicContact CE-CG 3.85Å; M107-F185 HydrophobicContact CE-CZ 4.26Å; M107-F185 HydrophobicContact SD-CD1 4.2Å; M107-F185 HydrophobicContact SD-CE1 3.78Å; M107-F185 HydrophobicContact SD-CE2 4.4Å; M107-F185 HydrophobicContact SD-CZ 3.89Å; I181-F185 HydrophobicContact CG2-CD2 4.42Å; I181-F185 HydrophobicContact CG2-CE2 4.29Å; I181-F185 VanDerWaalsContact O-CD2 3.29Å; I181-F185 WeakPolarHBondContact O-CD2 3.27Å; I181-F185 PolarHBondContact O-N 2.85Å; E182-F185 PolarHBondContact O-N 2.58Å; F185-M188 PolarHBondContact O-N 2.77Å; F185-A189 WeakPolarHBondContact O-CB 3.39Å; F185-A189 PolarHBondContact O-N 3.34Å
186	T	97.6	Very high	96.1	Very high	25 Å²	25	52 Å²	52	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-44.5	175.6	-58.8	0	0	0	0	111.5	M72 I74 E182 A183 M188 A189 R190	M72-T186 WeakPolarHBondContact CE-OG1 3.19Å; I74-T186 HydrophobicContact CD1-CG2 3.92Å; E182-T186 VanDerWaalsContact O-CB 3.27Å; E182-T186 WeakPolarHBondContact O-CB 3.23Å; E182-T186 PolarHBondContact O-N 3.01Å; E182-T186 PolarHBondContact O-OG1 3.16Å; A183-T186 PolarHBondContact O-N 3.13Å; T186-M188 PolarHBondContact O-N 3.46Å; T186-A189 PolarHBondContact O-N 3.41Å; T186-R190 WeakPolarHBondContact O-CB 3.46Å; T186-R190 WeakPolarHBondContact O-CG 3.34Å; T186-R190 PolarHBondContact O-N 2.99Å
187	L	97.9	Very high	94.5	Very high	58 Å²	58	49.6 Å²	49.6	30%	0.304	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-47.3	177.3	178.5	67	0	0	0	110.9	L168 A169 L171 A183 R190 E191	L168-L187 HydrophobicContact CD2-CD1 4.49Å; L168-L187 HydrophobicContact CD2-CD2 4.31Å; L168-L187 HydrophobicContact CD2-CG 3.95Å; A169-L187 HydrophobicContact CB-CD2 3.69Å; L171-L187 HydrophobicContact CD1-CD2 3.84Å; L171-L187 HydrophobicContact CG-CD2 4.44Å; A183-L187 VanDerWaalsContact O-CB 3.29Å; A183-L187 WeakPolarHBondContact O-CB 3.38Å; A183-L187 PolarHBondContact O-N 3.01Å; L187-R190 PolarHBondContact O-N 2.86Å; L187-E191 PolarHBondContact O-N 3.37Å
188	M	97.9	Very high	92.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-45.8	177.3	-178.3	165.1	-73.9	0	0	112.1	I33 A106 M107 V139 A184 F185 T186 R190 E191 L192	I33-M188 HydrophobicContact CB-SD 4.18Å; I33-M188 HydrophobicContact CD1-CG 3.89Å; I33-M188 HydrophobicContact CD1-SD 3.32Å; I33-M188 WeakPolarHBondContact CD1-SD 3.47Å; I33-M188 HydrophobicContact CG1-SD 3.7Å; I33-M188 HydrophobicContact CG2-CE 4.42Å; I33-M188 HydrophobicContact CG2-SD 3.42Å; I33-M188 WeakPolarHBondContact CG2-SD 3.35Å; A106-M188 WeakPolarHBondContact O-CE 3.13Å; M107-M188 HydrophobicContact CB-CE 4.49Å; M107-M188 HydrophobicContact CE-CB 4.01Å; M107-M188 HydrophobicContact CE-CE 3.88Å; M107-M188 HydrophobicContact CE-SD 3.7Å; M107-M188 HydrophobicContact CG-CE 3.37Å; M107-M188 HydrophobicContact CG-SD 3.99Å; M107-M188 HydrophobicContact SD-CE 4.5Å; V139-M188 HydrophobicContact CB-CE 3.93Å; V139-M188 HydrophobicContact CG2-CE 3.69Å; A184-M188 PolarHBondContact O-N 3.2Å; F185-M188 PolarHBondContact O-N 2.77Å; T186-M188 PolarHBondContact O-N 3.46Å; M188-R190 PolarHBondContact O-N 2.8Å; M188-E191 PolarHBondContact O-N 3.29Å; M188-L192 HydrophobicContact CG-CD1 3.99Å; M188-L192 WeakPolarHBondContact O-CB 3.4Å; M188-L192 VanDerWaalsContact O-CG 3.27Å; M188-L192 WeakPolarHBondContact O-CG 3.44Å; M188-L192 PolarHBondContact O-N 3.44Å
189	A	97.1	Very high	89.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-43.9	178.5	0	0	0	0	0	111.8	I74 V79 M81 F185 T186 L192 L193	I74-A189 HydrophobicContact CD1-CB 4.11Å; I74-A189 HydrophobicContact CG1-CB 3.96Å; V79-A189 HydrophobicContact CG1-CB 4.34Å; M81-A189 HydrophobicContact SD-CB 3.88Å; F185-A189 WeakPolarHBondContact O-CB 3.39Å; F185-A189 PolarHBondContact O-N 3.34Å; T186-A189 PolarHBondContact O-N 3.41Å; A189-L192 PolarHBondContact O-N 2.83Å; A189-L193 WeakPolarHBondContact O-CB 3.29Å; A189-L193 WeakPolarHBondContact O-CG 3.45Å; A189-L193 PolarHBondContact O-N 3.13Å
190	R	96.8	Very high	87.3	Confident	122 Å²	122	55 Å²	55	46%	0.46	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-45.5	177.1	-80.1	-176.8	170.3	142.5	1.4	112.8	I74 D75 T186 L187 M188 L192 L193 A194	I74-R190 HydrophobicContact CG2-CG 3.41Å; I74-R190 VanDerWaalsContact CG2-CG 3.41Å; D75-R190 IonicContact OD1-CZ 3.33Å; D75-R190 IonicContact OD1-NE 3.61Å; D75-R190 IonicContact OD1-NH2 2.87Å; D75-R190 PolarHBondContact OD1-NH2 3.23Å; D75-R190 IonicContact OD2-CZ 2.89Å; D75-R190 IonicContact OD2-NE 3.22Å; D75-R190 PolarHBondContact OD2-NE 3.37Å; D75-R190 IonicContact OD2-NH2 3.97Å; T186-R190 WeakPolarHBondContact O-CB 3.46Å; T186-R190 WeakPolarHBondContact O-CG 3.34Å; T186-R190 PolarHBondContact O-N 2.99Å; L187-R190 PolarHBondContact O-N 2.86Å; M188-R190 PolarHBondContact O-N 2.8Å; R190-L192 VanDerWaalsContact C-N 3.33Å; R190-L192 PolarHBondContact O-N 2.98Å; R190-L193 WeakPolarHBondContact O-CB 3.4Å; R190-L193 PolarHBondContact O-N 2.83Å; R190-A194 PolarHBondContact O-N 2.92Å
191	E	97	Very high	84.7	Confident	50 Å²	50	56.7 Å²	56.7	23%	0.234	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-42.2	177.6	177.1	63.2	-170.6	0	0	111.3	V137 L168 L187 M188 L193 A194 R195	V137-E191 HydrophobicContact CG1-CB 4.34Å; V137-E191 HydrophobicContact CG1-CG 3.8Å; V137-E191 HydrophobicContact CG2-CG 3.83Å; L168-E191 HydrophobicContact CD1-CB 4.15Å; L168-E191 HydrophobicContact CD1-CG 3.76Å; L168-E191 HydrophobicContact CD2-CB 3.58Å; L168-E191 HydrophobicContact CD2-CG 3.81Å; L168-E191 HydrophobicContact CG-CG 4.38Å; L187-E191 PolarHBondContact O-N 3.37Å; M188-E191 PolarHBondContact O-N 3.29Å; E191-L193 PolarHBondContact O-N 2.82Å; E191-A194 WeakPolarHBondContact O-CB 3.38Å; E191-A194 PolarHBondContact O-N 3.01Å; E191-R195 WeakPolarHBondContact O-CG 3.39Å; E191-R195 PolarHBondContact O-N 2.79Å; E191-R195 IonicContact OE1-CZ 3.27Å; E191-R195 IonicContact OE1-NE 3.66Å; E191-R195 PolarHBondContact OE1-NE 3.43Å; E191-R195 IonicContact OE1-NH2 2.66Å; E191-R195 PolarHBondContact OE1-NH2 3.28Å
192	L	96	Very high	82	Confident	4 Å²	4	63 Å²	63	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-65.9	-38.3	176.9	-69.7	174.6	0	0	0	112.1	F31 I33 H104 V137 M188 A189 R190 A194 R195 N196	F31-L192 HydrophobicContact CB-CD1 3.79Å; F31-L192 HydrophobicContact CD1-CB 4.01Å; F31-L192 HydrophobicContact CD1-CD1 4.11Å; F31-L192 HydrophobicContact CD2-CB 3.73Å; F31-L192 HydrophobicContact CD2-CD1 4.01Å; F31-L192 HydrophobicContact CE1-CB 3.86Å; F31-L192 HydrophobicContact CE2-CB 3.57Å; F31-L192 HydrophobicContact CG-CB 3.96Å; F31-L192 HydrophobicContact CG-CD1 3.7Å; F31-L192 HydrophobicContact CG-CG 4.45Å; F31-L192 HydrophobicContact CZ-CB 3.64Å; I33-L192 HydrophobicContact CD1-CD1 3.65Å; H104-L192 HydrophobicContact CB-CD1 4.03Å; H104-L192 HydrophobicContact CB-CD2 3.94Å; H104-L192 WeakPolarHBondContact O-CD2 3.37Å; V137-L192 HydrophobicContact CB-CD2 4Å; V137-L192 HydrophobicContact CG2-CD2 3.51Å; V137-L192 HydrophobicContact CG2-CG 4.26Å; M188-L192 HydrophobicContact CG-CD1 3.99Å; M188-L192 WeakPolarHBondContact O-CB 3.4Å; M188-L192 VanDerWaalsContact O-CG 3.27Å; M188-L192 WeakPolarHBondContact O-CG 3.44Å; M188-L192 PolarHBondContact O-N 3.44Å; A189-L192 PolarHBondContact O-N 2.83Å; R190-L192 VanDerWaalsContact C-N 3.33Å; R190-L192 PolarHBondContact O-N 2.98Å; L192-A194 VanDerWaalsContact C-N 3.35Å; L192-R195 PolarHBondContact O-N 3.26Å; L192-N196 WeakPolarHBondContact O-CB 3.18Å; L192-N196 PolarHBondContact O-N 2.8Å; L192-N196 PolarHBondContact O-ND2 3.45Å
193	L	94.8	Very high	79.7	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-42.8	170.6	-75.5	178.3	0	0	0	111.6	F29 F31 I74 K77 V79 A189 R190 E191 R195 N196 G197	F29-L193 HydrophobicContact CB-CD2 3.98Å; F29-L193 HydrophobicContact CD1-CD2 3.89Å; F29-L193 HydrophobicContact CD2-CD2 3.19Å; F29-L193 HydrophobicContact CE1-CD2 4.16Å; F29-L193 HydrophobicContact CE2-CD2 3.54Å; F29-L193 HydrophobicContact CG-CD2 3.4Å; F29-L193 HydrophobicContact CZ-CD2 4.01Å; F31-L193 HydrophobicContact CE2-CD2 3.93Å; F31-L193 HydrophobicContact CE2-CG 4.04Å; F31-L193 HydrophobicContact CZ-CD2 4.12Å; F31-L193 HydrophobicContact CZ-CG 4.49Å; I74-L193 HydrophobicContact CB-CD1 3.87Å; I74-L193 HydrophobicContact CG2-CD1 3.63Å; K77-L193 HydrophobicContact CB-CD1 4.44Å; V79-L193 HydrophobicContact CG2-CD1 3.79Å; V79-L193 HydrophobicContact CG2-CD2 3.99Å; V79-L193 HydrophobicContact CG2-CG 4.09Å; A189-L193 WeakPolarHBondContact O-CB 3.29Å; A189-L193 WeakPolarHBondContact O-CG 3.45Å; A189-L193 PolarHBondContact O-N 3.13Å; R190-L193 WeakPolarHBondContact O-CB 3.4Å; R190-L193 PolarHBondContact O-N 2.83Å; E191-L193 PolarHBondContact O-N 2.82Å; L193-R195 VanDerWaalsContact C-N 3.31Å; L193-R195 PolarHBondContact O-N 3.02Å; L193-N196 PolarHBondContact O-N 2.81Å; L193-G197 VanDerWaalsContact O-CA 3.25Å; L193-G197 WeakPolarHBondContact O-CA 2.91Å; L193-G197 PolarHBondContact O-N 2.76Å
194	A	93.8	Very high	77	Confident	66 Å²	66	71.7 Å²	71.7	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-39.1	178.5	0	0	0	0	0	112	R190 E191 L192	R190-A194 PolarHBondContact O-N 2.92Å; E191-A194 WeakPolarHBondContact O-CB 3.38Å; E191-A194 PolarHBondContact O-N 3.01Å; L192-A194 VanDerWaalsContact C-N 3.35Å
195	R	91.2	Very high	74.4	Confident	124 Å²	124	76.1 Å²	76.1	47%	0.468	42%	0.417	S	S	.	.	H	α-helix	trans	-73.9	-34.9	177.7	-67.2	-176.1	-173.3	-158.9	0.3	113.8	S135 V137 E191 L192 L193	S135-R195 PolarHBondContact O-NH1 3.23Å; V137-R195 VanDerWaalsContact CG2-CZ 3.43Å; E191-R195 WeakPolarHBondContact O-CG 3.39Å; E191-R195 PolarHBondContact O-N 2.79Å; E191-R195 IonicContact OE1-CZ 3.27Å; E191-R195 IonicContact OE1-NE 3.66Å; E191-R195 PolarHBondContact OE1-NE 3.43Å; E191-R195 IonicContact OE1-NH2 2.66Å; E191-R195 PolarHBondContact OE1-NH2 3.28Å; L192-R195 PolarHBondContact O-N 3.26Å; L193-R195 VanDerWaalsContact C-N 3.31Å; L193-R195 PolarHBondContact O-N 3.02Å
196	N	84.9	Confident	71.7	Confident	50 Å²	50	84 Å²	84	27%	0.267	46%	0.459	S	S	.	.	H	α-helix	trans	-100	-10.4	-175.8	-63.4	-72.9	0	0	0	113.5	F31 L192 L193 M198 A199	F31-N196 HydrophobicContact CE1-CB 4.24Å; F31-N196 WeakPolarHBondContact CE1-ND2 3.37Å; F31-N196 HydrophobicContact CZ-CB 4.34Å; L192-N196 WeakPolarHBondContact O-CB 3.18Å; L192-N196 PolarHBondContact O-N 2.8Å; L192-N196 PolarHBondContact O-ND2 3.45Å; L193-N196 PolarHBondContact O-N 2.81Å; N196-M198 PolarHBondContact O-N 2.83Å; N196-M198 VanDerWaalsContact O-N 3.12Å; N196-A199 CarbonylContact O-C 3.56Å; N196-A199 PolarHBondContact O-N 3.11Å; N196-A199 VanDerWaalsContact O-O 3.09Å
197	G	64.3	Low	68.6	Low	51 Å²	51	89.2 Å²	89.2	53%	0.526	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	0.8	178.5	0	0	0	0	0	114.7	L193	L193-G197 VanDerWaalsContact O-CA 3.25Å; L193-G197 WeakPolarHBondContact O-CA 2.91Å; L193-G197 PolarHBondContact O-N 2.76Å
198	M	49.2	Very low	65.5	Low	183 Å²	183	91.1 Å²	91.1	90%	0.901	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-3.6	163.9	-70.2	-164.6	-104.1	0	0	113.7	N196	N196-M198 PolarHBondContact O-N 2.83Å; N196-M198 VanDerWaalsContact O-N 3.12Å
199	A	45.2	Very low	62.8	Low	55 Å²	55	97.3 Å²	97.3	46%	0.455	55%	0.553	S	S	.	*			trans	-145.6	87	-179.9	0	0	0	0	0	110.6	N196 T201	N196-A199 CarbonylContact O-C 3.56Å; N196-A199 PolarHBondContact O-N 3.11Å; N196-A199 VanDerWaalsContact O-O 3.09Å; A199-T201 PolarHBondContact O-N 3.01Å; A199-T201 VanDerWaalsContact O-N 3.13Å
200	I	44.2	Very low	59.8	Low	138 Å²	138	105.3 Å²	105.3	71%	0.708	59%	0.59	S	S	*	*			trans	-66.1	110.7	169.2	-58.9	172.4	0	0	0	107.4
201	T	42.8	Very low	56.9	Low	109 Å²	109	108.8 Å²	108.8	67%	0.669	61%	0.609	S	S	*	*			trans	-111	101.1	165.8	-49.4	0	0	0	0	108	A199 Q203	A199-T201 PolarHBondContact O-N 3.01Å; A199-T201 VanDerWaalsContact O-N 3.13Å; T201-Q203 HydrophobicContact CG2-CG 4.1Å; T201-Q203 PolarHBondContact O-N 3.02Å
202	D	41.2	Very low	53.8	Low	136 Å²	136	114.1 Å²	114.1	73%	0.727	64%	0.636	S	S	*	*			trans	-63.1	97.9	164.4	-99.9	-31.4	0	0	0	108.4	N204	D202-N204 PolarHBondContact O-N 2.81Å
203	Q	48.2	Very low	51.2	Low	168 Å²	168	121.4 Å²	121.4	79%	0.785	67%	0.674	S	S	*	*			trans	-88.8	63.4	161.2	-69.4	-141.1	6.8	0	0	109.6	T201 S205	T201-Q203 HydrophobicContact CG2-CG 4.1Å; T201-Q203 PolarHBondContact O-N 3.02Å; Q203-S205 PolarHBondContact O-N 3.02Å
204	N	41.6	Very low	48.3	Very low	141 Å²	141	126 Å²	126	75%	0.754	71%	0.708	S	S	*	*			trans	-87.8	67	162.9	-122.4	-1	0	0	0	108.4	D202	D202-N204 PolarHBondContact O-N 2.81Å
205	S	44.1	Very low	45.4	Very low	94 Å²	94	129.9 Å²	129.9	66%	0.657	72%	0.72	S	S	*	*			trans	-155.9	110.6	164.5	-34.6	0	0	0	0	111.4	Q203	Q203-S205 PolarHBondContact O-N 3.02Å
206	L	40.2	Very low	42.5	Very low	166 Å²	166	129 Å²	129	87%	0.869	73%	0.733	S	S	*	*			trans	81.1	94	154.9	-55.6	160.3	0	0	0	118.1
207	C	32.4	Very low	40	Very low	135 Å²	135	130.5 Å²	130.5	91%	0.912	75%	0.747	S	S	*	*				-151.3	86.3	128.2	-145.4	0	0	0	0	109.9
208	S	33.7	Very low	38.6	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	76%	0.759	S	S	*	*			trans	-85.9	136	166	-43.3	0	0	0	0	108.7	Q210	S208-Q210 PolarHBondContact O-N 3.34Å
209	P	40.1	Very low	37.6	Very low	131 Å²	131	133.5 Å²	133.5	85%	0.851	76%	0.756	S	S	*	*			trans	-81.9	114.5	173	31.1	-27.5	0	0	0	108.9
210	Q	33.8	Very low	37.4	Very low	167 Å²	167	137.7 Å²	137.7	78%	0.78	77%	0.769	S	S	*	*			trans	-130.6	86.9	168.6	-122.4	170.9	1.1	0	0	110.1	S208 M212	S208-Q210 PolarHBondContact O-N 3.34Å; Q210-M212 HydrophobicContact CG-CG 4.43Å
211	F	37.3	Very low	36.7	Very low	196 Å²	196	140.9 Å²	140.9	86%	0.86	78%	0.781	S	S	*	*			trans	-76.4	107.5	151.6	-129.2	-89.5	0	0	0	106.4
212	M	31.7	Very low	36.2	Very low	162 Å²	162	139.7 Å²	139.7	80%	0.798	78%	0.782	S	S	*	*			trans	-133.1	108	162.4	-80.8	-90.4	-92.8	0	0	106.9	Q210	Q210-M212 HydrophobicContact CG-CG 4.43Å
213	L	41.8	Very low	35.8	Very low	157 Å²	157	138.6 Å²	138.6	82%	0.822	79%	0.785	S	S	*	*			trans	-63.2	141.3	162.6	-68.7	159.1	0	0	0	108.8
214	S	32.8	Very low	35.2	Very low	120 Å²	120	136.4 Å²	136.4	84%	0.839	78%	0.783	S	S	*	*			trans	-140.8	103.4	152.4	65	0	0	0	0	110.2
215	D	32.4	Very low	34.9	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	78%	0.776	S	S	*	*			trans	-70.8	131.7	157.9	-177.8	19.9	0	0	0	109.5
216	S	30.2	Very low	34.5	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	78%	0.783	S	S	*	*			trans	174.4	100.9	136.9	27	0	0	0	0	113.7
217	S	32.8	Very low	34.3	Very low	81 Å²	81	134.1 Å²	134.1	57%	0.566	77%	0.771	S	S	*	*				18.2	121.5	125.1	33.5	0	0	0	0	120.1
218	H	34.7	Very low	34.6	Very low	171 Å²	171	135.4 Å²	135.4	79%	0.792	76%	0.761	S	S	*	*				120.2	158.7	87.3	-85.1	-25.4	0	0	0	110.3
219	P	29.5	Very low	34.7	Very low	126 Å²	126	140 Å²	140	82%	0.818	77%	0.769	S	S	*	*			cis	-142.3	170.8	38.5	36.5	-13.5	0	0	0	118.9
220	I	39.5	Very low	34.6	Very low	144 Å²	144	139.8 Å²	139.8	74%	0.738	77%	0.769	S	S	*	*			trans	-83.9	141	174	-62.4	164.3	0	0	0	110.2
221	Q	31.1	Very low	34.6	Very low	204 Å²	204	135.1 Å²	135.1	95%	0.953	77%	0.766	S	S	*	*			trans	-153.6	139.6	141.2	-113.8	173.6	1.6	0	0	112
222	A	31.3	Very low	34.4	Very low	85 Å²	85	131.5 Å²	131.5	70%	0.702	76%	0.763	S	S	*	*			trans	-109.5	175.2	-162.4	0	0	0	0	0	113.4
223	S	33.5	Very low	34.7	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	76%	0.763	S	S	*	*			trans	93.9	141.5	159.3	83.4	0	0	0	0	115.8
224	V	34.8	Very low	34.6	Very low	123 Å²	123	130.2 Å²	130.2	75%	0.745	76%	0.76	S	S	*	*			cis	-158.2	156	25	-162.7	0	0	0	0	111.4
225	S	34.3	Very low	35.2	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	78%	0.781	S	S	*	*			trans	67.7	113.7	145.5	45	0	0	0	0	121.1
226	D	36.3	Very low	35.4	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	78%	0.781	S	S	*	*				79.9	135.9	90.6	-65.7	-44.6	0	0	0	112.2
227	D	37.2	Very low	35.6	Very low	115 Å²	115	135.3 Å²	135.3	62%	0.615	78%	0.783	S	S	*	*			cis	-168.4	147.6	37.1	-138.8	-9.2	0	0	0	111.6
228	K	37.4	Very low	35.8	Very low	161 Å²	161	138.3 Å²	138.3	70%	0.7	80%	0.795	S	S	*	*			trans	53.7	117.6	140.5	-82.4	177.1	-159.7	83.6	0	125.5
229	K	37	Very low	35.9	Very low	193 Å²	193	136.4 Å²	136.4	84%	0.839	80%	0.795	S	S	*	*				77.6	148.6	111.2	-117	-175.3	-172.1	-176.2	0	123.8
230	C	36.8	Very low	36.3	Very low	128 Å²	128	137.1 Å²	137.1	87%	0.865	79%	0.794	S	S	*	*			trans	82	136	162.9	-81	0	0	0	0	117
231	G	33.8	Very low	36	Very low	68 Å²	68	136.6 Å²	136.6	70%	0.701	80%	0.797	S	S	*	*			cis	143.3	120.8	8.7	0	0	0	0	0	109.8
232	C	34.6	Very low	36.4	Very low	120 Å²	120	131.8 Å²	131.8	81%	0.811	79%	0.786	S	S	*	*			trans	42.5	128	152.1	-61.8	0	0	0	0	124
233	Q	37.3	Very low	36.8	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.794	79%	0.793	S	S	*	*				81.2	137.7	125.8	-72.3	-176.8	-0.2	0	0	123.9
234	T	39.3	Very low	37.1	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	79%	0.794	S	S	*	*			trans	63.8	130.9	148.6	41.4	0	0	0	0	117.4
235	T	46	Very low	37.3	Very low	209 Å²	209	138.6 Å²	138.6	100%	1.282	80%	0.798	S	S	*	*			cis	-159.3	0	44	-31.5	0	0	0	0	109.4

Retrieved 235 of 235 residues in 215.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).