A0A077Z5P1_TRITR Loading...

VWFC domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z5P1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 177 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	40.8	Very low	232 Å²	232	154.7 Å²	154.7	100%	1.143	89%	0.886	S	S	*	*				0	106.2	0	-77.2	-172.5	-103.1	0	0	107.5
2	L	40.8	Very low	40.1	Very low	164 Å²	164	150.8 Å²	150.8	86%	0.859	89%	0.886	S	S	*	*			trans	-118.9	107.1	171.2	-76.4	169.2	0	0	0	107.6
3	L	39	Very low	40	Very low	168 Å²	168	150.7 Å²	150.7	88%	0.88	87%	0.872	S	S	*	*			trans	-88.1	127.1	173.5	-71	162.8	0	0	0	107.5
4	F	50.8	Low	39.9	Very low	197 Å²	197	148.8 Å²	148.8	86%	0.864	87%	0.871	S	S	*	*			trans	-92.2	115.3	168	-65.3	-79.3	0	0	0	108.4
5	A	48.4	Very low	39.8	Very low	108 Å²	108	146.2 Å²	146.2	89%	0.893	86%	0.858	S	S	*	*			trans	-80.8	126.5	160	0	0	0	0	0	107.8
6	G	38.9	Very low	40.1	Very low	71 Å²	71	142.7 Å²	142.7	73%	0.732	85%	0.851	S	S	*	*			trans	-131.5	129.1	177.5	0	0	0	0	0	110.9
7	E	43.5	Very low	40.1	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	84%	0.84	S	S	*	*			trans	-142.3	105	162	-66.8	-175.7	119.5	0	0	105.8
8	R	38	Very low	40.4	Very low	235 Å²	235	140.8 Å²	140.8	89%	0.887	83%	0.834	S	S	*	*				45.1	115	95.4	-68.1	-166.8	178.6	-174.4	2.1	111.2
9	L	40.4	Very low	40.6	Very low	171 Å²	171	144.1 Å²	144.1	90%	0.895	84%	0.837	S	S	*	*				-170.1	142.6	66.1	-77	162.1	0	0	0	111.4
10	G	33.9	Very low	41.2	Very low	83 Å²	83	139.6 Å²	139.6	86%	0.856	81%	0.814	S	S	*	*			trans	103.4	114.7	142.3	0	0	0	0	0	118.6
11	G	34.8	Very low	41.9	Very low	82 Å²	82	142.8 Å²	142.8	85%	0.845	81%	0.814	S	S	*	*			trans	103.1	78.5	157.1	0	0	0	0	0	116	Q13	G11-Q13 PolarHBondContact O-N 3.44Å
12	A	32.3	Very low	43.1	Very low	107 Å²	107	136.1 Å²	136.1	88%	0.884	79%	0.788	S	S	*	*			trans	-76.8	96.7	-166	0	0	0	0	0	115.5
13	Q	39.2	Very low	44.5	Very low	150 Å²	150	132.9 Å²	132.9	70%	0.701	77%	0.765	S	S	*	*			trans	-117	107.2	132.9	-70.4	-168	6	0	0	106.1	G11 V15	G11-Q13 PolarHBondContact O-N 3.44Å; Q13-V15 PolarHBondContact O-N 2.91Å
14	S	38.3	Very low	46.5	Very low	124 Å²	124	129 Å²	129	87%	0.867	76%	0.757	S	S	*	*			trans	-70.6	83.3	178.4	59.1	0	0	0	0	109.5	A16	S14-A16 VanDerWaalsContact C-N 3.34Å; S14-A16 PolarHBondContact O-N 2Å
15	V	38.9	Very low	48.1	Very low	110 Å²	110	120.2 Å²	120.2	67%	0.667	72%	0.72	S	S	*	*			trans	-77.7	93.9	160.2	-176.1	0	0	0	0	105.5	Q13 V17	Q13-V15 PolarHBondContact O-N 2.91Å; V15-V17 VanDerWaalsContact C-N 3.32Å; V15-V17 HydrophobicContact CG1-CG2 3.95Å; V15-V17 PolarHBondContact O-N 2.89Å
16	A	44.5	Very low	49.9	Very low	90 Å²	90	123 Å²	123	74%	0.744	72%	0.72	S	S	*	*			trans	-69.4	95.4	168.3	0	0	0	0	0	107.6	S14 L18	S14-A16 VanDerWaalsContact C-N 3.34Å; S14-A16 PolarHBondContact O-N 2Å; A16-L18 PolarHBondContact O-N 3.29Å; A16-L18 VanDerWaalsContact O-N 3.1Å
17	V	40.4	Very low	52.2	Low	112 Å²	112	127.8 Å²	127.8	68%	0.679	72%	0.716	S	S	*	*			trans	-75	96.6	168.8	-176.9	0	0	0	0	106.6	V15 K19	V15-V17 VanDerWaalsContact C-N 3.32Å; V15-V17 HydrophobicContact CG1-CG2 3.95Å; V15-V17 PolarHBondContact O-N 2.89Å; V17-K19 PolarHBondContact O-N 3.36Å
18	L	45.3	Very low	54.5	Low	139 Å²	139	124.2 Å²	124.2	73%	0.728	70%	0.699	S	S	*	*			trans	-62.5	104.6	165.3	-76.9	163.5	0	0	0	106.8	A16 S20	A16-L18 PolarHBondContact O-N 3.29Å; A16-L18 VanDerWaalsContact O-N 3.1Å; L18-S20 PolarHBondContact O-N 3.34Å
19	K	43.3	Very low	57	Low	203 Å²	203	115 Å²	115	88%	0.883	68%	0.677	S	S	*	*			trans	-71	63	167.8	-68.2	-175.1	177.9	-178.1	0	109.1	V17	V17-K19 PolarHBondContact O-N 3.36Å
20	S	53	Low	59.4	Low	55 Å²	55	109.3 Å²	109.3	39%	0.385	65%	0.648	S	S	.	*			trans	-85.7	130.4	159.5	63.8	0	0	0	0	107.1	L18	L18-S20 PolarHBondContact O-N 3.34Å
21	Y	55.6	Low	62.1	Low	207 Å²	207	112 Å²	112	81%	0.812	64%	0.642	S	S	*	*			trans	-20.5	127.3	171.6	-143.7	-97.3	0	0	0	112.3	Y23	Y21-Y23 PolarHBondContact O-N 3.3Å
22	P	66.3	Low	64.6	Low	92 Å²	92	109.8 Å²	109.8	60%	0.597	61%	0.611	S	S	*	*			trans	-57.6	113.3	-177.6	24.7	-31.7	0	0	0	107.3	A24 T51	P22-A24 VanDerWaalsContact C-N 3.3Å; P22-A24 PolarHBondContact O-N 3.36Å; P22-T51 HydrophobicContact CB-CG2 4.41Å
23	Y	69.5	Low	67.3	Low	95 Å²	95	113.6 Å²	113.6	37%	0.373	60%	0.603	S	S	.	*			trans	-65.1	101.9	171.8	-67	-88.1	0	0	0	105.1	Y21 I34 I37 A52	Y21-Y23 PolarHBondContact O-N 3.3Å; Y23-I34 HydrophobicContact CD1-CD1 4.32Å; Y23-I34 HydrophobicContact CD1-CG1 4.06Å; Y23-I34 HydrophobicContact CD1-CG2 4.05Å; Y23-I34 HydrophobicContact CD2-CD1 3.57Å; Y23-I34 HydrophobicContact CD2-CG1 4.15Å; Y23-I34 HydrophobicContact CD2-CG2 4.01Å; Y23-I34 HydrophobicContact CE1-CG1 4.35Å; Y23-I34 HydrophobicContact CE1-CG2 3.48Å; Y23-I34 VanDerWaalsContact CE1-CG2 3.48Å; Y23-I34 HydrophobicContact CE2-CD1 4.09Å; Y23-I34 HydrophobicContact CE2-CG1 4.43Å; Y23-I34 HydrophobicContact CE2-CG2 3.44Å; Y23-I34 VanDerWaalsContact CE2-CG2 3.44Å; Y23-I34 HydrophobicContact CG-CD1 3.7Å; Y23-I34 HydrophobicContact CG-CG1 3.96Å; Y23-I34 HydrophobicContact CG-CG2 4.29Å; Y23-I34 VanDerWaalsContact OH-CG2 3.31Å; Y23-I34 WeakPolarHBondContact OH-CG2 3.07Å; Y23-I37 HydrophobicContact CE2-CD1 3.76Å; Y23-A52 WeakPolarHBondContact O-CB 2.77Å; Y23-A52 PolarHBondContact O-N 3.31Å
24	A	81.3	Confident	69.5	Low	86 Å²	86	106.8 Å²	106.8	71%	0.711	57%	0.572	S	S	*	*	B	Isolated β-bridge	trans	-67.2	143.6	175.4	0	0	0	0	0	108.8	P22 G50	P22-A24 VanDerWaalsContact C-N 3.3Å; P22-A24 PolarHBondContact O-N 3.36Å; A24-G50 WeakPolarHBondContact CA-O 3.27Å
25	C	85.2	Confident	71.8	Confident	13 Å²	13	109.8 Å²	109.8	9%	0.088	57%	0.569	C	S	.	*			trans	-144.1	144.8	-178.5	56.5	0	0	0	0	109.8	L32 C47 G50 T51	C25-L32 HydrophobicContact CB-CD1 3.9Å; C25-L32 HydrophobicContact CB-CD2 3.73Å; C25-L32 HydrophobicContact CB-CG 4.45Å; C25-C47 VanDerWaalsContact C-SG 3.59Å; C25-C47 HydrophobicContact CB-CB 3.66Å; C25-C47 WeakPolarHBondContact CB-SG 2.95Å; C25-C47 PolarHBondContact O-SG 3.05Å; C25-C47 WeakPolarHBondContact SG-CA 3.26Å; C25-C47 WeakPolarHBondContact SG-CB 3.06Å; C25-C47 CovalentContact SG-SG 2.02Å; C25-C47 PolarHBondContact SG-SG 2.95Å; C25-G50 PolarHBondContact N-O 3.08Å; C25-G50 VanDerWaalsContact N-O 3.12Å; C25-G50 WeakPolarHBondContact O-CA 3.01Å; C25-G50 VanDerWaalsContact SG-C 3.57Å; C25-T51 VanDerWaalsContact SG-C 3.5Å; C25-T51 PolarHBondContact SG-O 3.15Å
26	D	86	Confident	74	Confident	168 Å²	168	107.5 Å²	107.5	90%	0.898	57%	0.567	S	S	*	*	S	Bend	trans	-94	-32	-169.5	-56.2	-44.8	0	0	0	112.9
27	R	87.6	Confident	75.9	Confident	170 Å²	170	104.5 Å²	104.5	64%	0.642	54%	0.538	S	S	*	.	S	Bend	trans	-107.7	109.9	-172.3	-68.3	-165.1	-58.1	-133.7	-3.9	110.9	G29 D30 C47	R27-G29 PolarHBondContact O-N 3.08Å; R27-D30 HydrophobicContact CB-CB 4.25Å; R27-D30 VanDerWaalsContact CB-CG 3.46Å; R27-D30 WeakPolarHBondContact CB-OD2 3Å; R27-D30 IonicContact CZ-OD2 3.19Å; R27-D30 IonicContact NE-OD1 3.62Å; R27-D30 IonicContact NE-OD2 2.72Å; R27-D30 PolarHBondContact NE-OD2 2.96Å; R27-D30 IonicContact NH2-OD2 2.79Å; R27-D30 PolarHBondContact NH2-OD2 3.35Å; R27-D30 WeakPolarHBondContact O-CB 3.39Å; R27-D30 PolarHBondContact O-N 2.78Å; R27-D30 VanDerWaalsContact O-N 3.14Å; R27-C47 WeakPolarHBondContact O-CB 3.43Å; R27-C47 PolarHBondContact O-SG 3.19Å; R27-C47 VanDerWaalsContact O-SG 3.35Å
28	E	90.9	Very high	78.1	Confident	116 Å²	116	100.3 Å²	100.3	54%	0.542	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	129	175.7	-169.1	63.7	-160.5	0	0	111	K48 D49	E28-K48 VanDerWaalsContact OE1-CA 3.23Å; E28-K48 WeakPolarHBondContact OE1-CA 3.34Å; E28-K48 WeakPolarHBondContact OE2-CA 3.3Å; E28-D49 PolarHBondContact OE1-N 3.3Å; E28-D49 PolarHBondContact OE2-N 2.82Å
29	G	90	Very high	80	Confident	41 Å²	41	97.4 Å²	97.4	42%	0.423	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-5.9	-179	0	0	0	0	0	115.8	R27 C47	R27-G29 PolarHBondContact O-N 3.08Å; G29-C47 PolarHBondContact N-O 3.48Å
30	D	90.4	Very high	82.1	Confident	53 Å²	53	90.7 Å²	90.7	28%	0.283	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-67.2	136.7	178.8	-88.5	14.5	0	0	0	112.1	R27 L32 I46 C47	R27-D30 HydrophobicContact CB-CB 4.25Å; R27-D30 VanDerWaalsContact CB-CG 3.46Å; R27-D30 WeakPolarHBondContact CB-OD2 3Å; R27-D30 IonicContact CZ-OD2 3.19Å; R27-D30 IonicContact NE-OD1 3.62Å; R27-D30 IonicContact NE-OD2 2.72Å; R27-D30 PolarHBondContact NE-OD2 2.96Å; R27-D30 IonicContact NH2-OD2 2.79Å; R27-D30 PolarHBondContact NH2-OD2 3.35Å; R27-D30 WeakPolarHBondContact O-CB 3.39Å; R27-D30 PolarHBondContact O-N 2.78Å; R27-D30 VanDerWaalsContact O-N 3.14Å; D30-L32 PolarHBondContact O-N 3.46Å; D30-I46 CarbonylContact O-C 3.58Å; D30-I46 WeakPolarHBondContact O-CA 3.44Å; D30-C47 HydrophobicContact CB-CB 4.33Å; D30-C47 PolarHBondContact O-N 2.03Å
31	L	90.6	Very high	83.9	Confident	139 Å²	139	90.5 Å²	90.5	73%	0.728	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	120.8	168.1	-71.6	173.8	0	0	0	109.8	T44 C45	L31-T44 HydrophobicContact CD2-CG2 3.69Å; L31-C45 WeakPolarHBondContact CA-O 3.01Å
32	L	88.5	Confident	85.5	Confident	36 Å²	36	81.4 Å²	81.4	19%	0.188	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.2	-176.1	-57.5	177.9	0	0	0	110.7	C25 D30 I34 T38 C45 C47 A52	C25-L32 HydrophobicContact CB-CD1 3.9Å; C25-L32 HydrophobicContact CB-CD2 3.73Å; C25-L32 HydrophobicContact CB-CG 4.45Å; D30-L32 PolarHBondContact O-N 3.46Å; L32-I34 HydrophobicContact CB-CD1 4.33Å; L32-I34 HydrophobicContact CB-CG1 4.34Å; L32-T38 WeakPolarHBondContact O-CG2 3.4Å; L32-C45 HydrophobicContact CB-CB 4.08Å; L32-C45 PolarHBondContact N-O 3.39Å; L32-C47 HydrophobicContact CD1-CB 4.27Å; L32-C47 HydrophobicContact CD2-CB 4.26Å; L32-C47 HydrophobicContact CG-CB 4.37Å; L32-A52 HydrophobicContact CD1-CB 3.36Å
33	Y	88.6	Confident	86.6	Confident	187 Å²	187	78.7 Å²	78.7	73%	0.733	42%	0.422	S	S	*	.			trans	-96.1	105.1	170.5	-174.6	-99.7	0	0	0	110.2	T38	Y33-T38 VanDerWaalsContact CD2-OG1 3.25Å; Y33-T38 WeakPolarHBondContact CD2-OG1 3.44Å
34	I	86.3	Confident	87.6	Confident	7 Å²	7	78 Å²	78	4%	0.036	43%	0.428	C	S	.	.			trans	-110.2	111.3	-177.5	-63.7	164.5	0	0	0	108.8	Y23 L32 G36 I37 T38 C45 A52	Y23-I34 HydrophobicContact CD1-CD1 4.32Å; Y23-I34 HydrophobicContact CD1-CG1 4.06Å; Y23-I34 HydrophobicContact CD1-CG2 4.05Å; Y23-I34 HydrophobicContact CD2-CD1 3.57Å; Y23-I34 HydrophobicContact CD2-CG1 4.15Å; Y23-I34 HydrophobicContact CD2-CG2 4.01Å; Y23-I34 HydrophobicContact CE1-CG1 4.35Å; Y23-I34 HydrophobicContact CE1-CG2 3.48Å; Y23-I34 VanDerWaalsContact CE1-CG2 3.48Å; Y23-I34 HydrophobicContact CE2-CD1 4.09Å; Y23-I34 HydrophobicContact CE2-CG1 4.43Å; Y23-I34 HydrophobicContact CE2-CG2 3.44Å; Y23-I34 VanDerWaalsContact CE2-CG2 3.44Å; Y23-I34 HydrophobicContact CG-CD1 3.7Å; Y23-I34 HydrophobicContact CG-CG1 3.96Å; Y23-I34 HydrophobicContact CG-CG2 4.29Å; Y23-I34 VanDerWaalsContact OH-CG2 3.31Å; Y23-I34 WeakPolarHBondContact OH-CG2 3.07Å; L32-I34 HydrophobicContact CB-CD1 4.33Å; L32-I34 HydrophobicContact CB-CG1 4.34Å; I34-G36 PolarHBondContact O-N 3.14Å; I34-I37 HydrophobicContact CB-CB 4.1Å; I34-I37 HydrophobicContact CG2-CB 3.86Å; I34-I37 HydrophobicContact CG2-CD1 3.72Å; I34-I37 HydrophobicContact CG2-CG1 3.78Å; I34-I37 PolarHBondContact O-N 2.83Å; I34-T38 HydrophobicContact CB-CG2 4.38Å; I34-T38 PolarHBondContact N-OG1 3.37Å; I34-T38 PolarHBondContact O-N 3.43Å; I34-T38 PolarHBondContact O-OG1 3.11Å; I34-T38 VanDerWaalsContact O-OG1 3.13Å; I34-C45 HydrophobicContact CD1-CB 4.11Å; I34-A52 HydrophobicContact CD1-CB 3.88Å
35	K	86.3	Confident	88.1	Confident	187 Å²	187	74 Å²	74	81%	0.813	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	123	-179.4	-171.3	177.1	-178.6	178.9	0	110.7	I37	K35-I37 VanDerWaalsContact C-N 3.34Å
36	G	84.5	Confident	88.4	Confident	61 Å²	61	76.6 Å²	76.6	63%	0.629	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	-13.1	-178.8	0	0	0	0	0	115.2	I34 S39	I34-G36 PolarHBondContact O-N 3.14Å; G36-S39 WeakPolarHBondContact CA-OG 3.05Å; G36-S39 PolarHBondContact O-OG 3.32Å
37	I	84.2	Confident	88.6	Confident	27 Å²	27	68.6 Å²	68.6	14%	0.138	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-62.1	173.6	-59.1	-172.3	0	0	0	109.5	Y23 I34 K35 S39 D40 I43	Y23-I37 HydrophobicContact CE2-CD1 3.76Å; I34-I37 HydrophobicContact CB-CB 4.1Å; I34-I37 HydrophobicContact CG2-CB 3.86Å; I34-I37 HydrophobicContact CG2-CD1 3.72Å; I34-I37 HydrophobicContact CG2-CG1 3.78Å; I34-I37 PolarHBondContact O-N 2.83Å; K35-I37 VanDerWaalsContact C-N 3.34Å; I37-S39 PolarHBondContact O-N 2.91Å; I37-S39 VanDerWaalsContact O-N 3.1Å; I37-D40 PolarHBondContact O-N 3.43Å; I37-D40 VanDerWaalsContact O-N 3.15Å; I37-I43 HydrophobicContact CG2-CB 4.46Å; I37-I43 HydrophobicContact CG2-CD1 4.34Å; I37-I43 HydrophobicContact CG2-CG2 3.64Å
38	T	85.8	Confident	88.7	Confident	25 Å²	25	65.3 Å²	65.3	15%	0.153	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	10.4	-179.7	61.6	0	0	0	0	113.2	L32 Y33 I34 D40 C45	L32-T38 WeakPolarHBondContact O-CG2 3.4Å; Y33-T38 VanDerWaalsContact CD2-OG1 3.25Å; Y33-T38 WeakPolarHBondContact CD2-OG1 3.44Å; I34-T38 HydrophobicContact CB-CG2 4.38Å; I34-T38 PolarHBondContact N-OG1 3.37Å; I34-T38 PolarHBondContact O-N 3.43Å; I34-T38 PolarHBondContact O-OG1 3.11Å; I34-T38 VanDerWaalsContact O-OG1 3.13Å; T38-D40 VanDerWaalsContact C-N 3.28Å; T38-C45 HydrophobicContact CG2-CB 4.17Å
39	S	86.9	Confident	88.6	Confident	77 Å²	77	65.6 Å²	65.6	54%	0.538	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-24	162.6	47.8	0	0	0	0	112.1	G36 I37 P41	G36-S39 WeakPolarHBondContact CA-OG 3.05Å; G36-S39 PolarHBondContact O-OG 3.32Å; I37-S39 PolarHBondContact O-N 2.91Å; I37-S39 VanDerWaalsContact O-N 3.1Å; S39-P41 WeakPolarHBondContact O-CD 3.19Å
40	D	87.5	Confident	88.3	Confident	62 Å²	62	65.2 Å²	65.2	33%	0.332	36%	0.357	S	S	.	.	S	Bend	trans	-81.8	118	169	-172.3	-16.8	0	0	0	109.2	I37 T38 C42 I43	I37-D40 PolarHBondContact O-N 3.43Å; I37-D40 VanDerWaalsContact O-N 3.15Å; T38-D40 VanDerWaalsContact C-N 3.28Å; D40-C42 PolarHBondContact O-N 3.4Å; D40-C42 VanDerWaalsContact OD1-CB 3.31Å; D40-C42 WeakPolarHBondContact OD1-CB 3.41Å; D40-C42 PolarHBondContact OD1-N 3.18Å; D40-I43 HydrophobicContact CB-CD1 4.01Å; D40-I43 HydrophobicContact CB-CG1 4.05Å; D40-I43 PolarHBondContact O-N 3.05Å
41	P	88.9	Confident	88.1	Confident	52 Å²	52	65.2 Å²	65.2	34%	0.338	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-12.7	177.3	25.2	-34.8	0	0	0	113.9	S39 G74 C76	S39-P41 WeakPolarHBondContact O-CD 3.19Å; P41-G74 WeakPolarHBondContact CB-O 3.43Å; P41-C76 WeakPolarHBondContact O-CB 3.39Å
42	C	89.8	Confident	88	Confident	15 Å²	15	59.8 Å²	59.8	10%	0.101	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.3	173.6	-69.3	0	0	0	0	114.9	D40 T56 K57 C76	D40-C42 PolarHBondContact O-N 3.4Å; D40-C42 VanDerWaalsContact OD1-CB 3.31Å; D40-C42 WeakPolarHBondContact OD1-CB 3.41Å; D40-C42 PolarHBondContact OD1-N 3.18Å; C42-T56 CarbonylContact O-C 3.57Å; C42-T56 WeakPolarHBondContact O-CA 3.33Å; C42-K57 PolarHBondContact O-N 3.1Å; C42-C76 WeakPolarHBondContact CA-SG 3.46Å; C42-C76 HydrophobicContact CB-CB 3.9Å; C42-C76 WeakPolarHBondContact CB-SG 3.46Å; C42-C76 WeakPolarHBondContact SG-CA 3.41Å; C42-C76 WeakPolarHBondContact SG-CB 3.47Å; C42-C76 PolarHBondContact SG-O 2.9Å; C42-C76 CovalentContact SG-SG 2.03Å; C42-C76 PolarHBondContact SG-SG 3.37Å
43	I	90.7	Very high	88	Confident	36 Å²	36	61.6 Å²	61.6	19%	0.185	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.9	-177.9	-54.3	177	0	0	0	109.1	I37 D40 C54 I55 T56	I37-I43 HydrophobicContact CG2-CB 4.46Å; I37-I43 HydrophobicContact CG2-CD1 4.34Å; I37-I43 HydrophobicContact CG2-CG2 3.64Å; D40-I43 HydrophobicContact CB-CD1 4.01Å; D40-I43 HydrophobicContact CB-CG1 4.05Å; D40-I43 PolarHBondContact O-N 3.05Å; I43-C54 HydrophobicContact CG2-CB 4.12Å; I43-I55 WeakPolarHBondContact CA-O 3.34Å; I43-T56 HydrophobicContact CG1-CG2 4.19Å
44	T	89.9	Confident	88.1	Confident	81 Å²	81	55.3 Å²	55.3	50%	0.497	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.7	174.4	-54.4	0	0	0	0	109	L31 C54 I55	L31-T44 HydrophobicContact CD2-CG2 3.69Å; T44-C54 CarbonylContact O-C 3.55Å; T44-C54 WeakPolarHBondContact O-CA 3.47Å; T44-I55 PolarHBondContact N-O 3.2Å; T44-I55 PolarHBondContact O-N 2.96Å
45	C	91	Very high	88.3	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.007	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.4	179.7	-55.8	0	0	0	0	110	L31 L32 I34 T38 H53 C54	L31-C45 WeakPolarHBondContact CA-O 3.01Å; L32-C45 HydrophobicContact CB-CB 4.08Å; L32-C45 PolarHBondContact N-O 3.39Å; I34-C45 HydrophobicContact CD1-CB 4.11Å; T38-C45 HydrophobicContact CG2-CB 4.17Å; C45-H53 WeakPolarHBondContact CA-O 3.42Å; C45-C54 HydrophobicContact CB-CB 4.07Å; C45-C54 WeakPolarHBondContact CB-SG 3.1Å; C45-C54 WeakPolarHBondContact SG-CB 3.35Å; C45-C54 CovalentContact SG-SG 2.04Å; C45-C54 PolarHBondContact SG-SG 3.46Å
46	I	91.4	Very high	88.4	Confident	67 Å²	67	56.1 Å²	56.1	34%	0.344	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.1	175.4	-169.8	165.3	0	0	0	109.3	D30 K48 H53	D30-I46 CarbonylContact O-C 3.58Å; D30-I46 WeakPolarHBondContact O-CA 3.44Å; I46-K48 PolarHBondContact O-N 3.03Å; I46-H53 HydrophobicContact CG2-CB 4.19Å; I46-H53 PolarHBondContact N-O 3.42Å; I46-H53 PolarHBondContact O-N 3.39Å
47	C	89.9	Confident	88.7	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.007	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.8	170.6	-171.8	0	0	0	0	109.5	C25 R27 G29 D30 L32	C25-C47 VanDerWaalsContact C-SG 3.59Å; C25-C47 HydrophobicContact CB-CB 3.66Å; C25-C47 WeakPolarHBondContact CB-SG 2.95Å; C25-C47 PolarHBondContact O-SG 3.05Å; C25-C47 WeakPolarHBondContact SG-CA 3.26Å; C25-C47 WeakPolarHBondContact SG-CB 3.06Å; C25-C47 CovalentContact SG-SG 2.02Å; C25-C47 PolarHBondContact SG-SG 2.95Å; R27-C47 WeakPolarHBondContact O-CB 3.43Å; R27-C47 PolarHBondContact O-SG 3.19Å; R27-C47 VanDerWaalsContact O-SG 3.35Å; G29-C47 PolarHBondContact N-O 3.48Å; D30-C47 HydrophobicContact CB-CB 4.33Å; D30-C47 PolarHBondContact O-N 2.03Å; L32-C47 HydrophobicContact CD1-CB 4.27Å; L32-C47 HydrophobicContact CD2-CB 4.26Å; L32-C47 HydrophobicContact CG-CB 4.37Å
48	K	90.4	Very high	88.9	Confident	100 Å²	100	66.7 Å²	66.7	44%	0.435	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.7	172.3	168.6	177.9	-173.9	-177.5	0	111.5	E28 I46 G50 T51 H53	E28-K48 VanDerWaalsContact OE1-CA 3.23Å; E28-K48 WeakPolarHBondContact OE1-CA 3.34Å; E28-K48 WeakPolarHBondContact OE2-CA 3.3Å; I46-K48 PolarHBondContact O-N 3.03Å; K48-G50 PolarHBondContact O-N 2.03Å; K48-T51 PolarHBondContact N-O 2.85Å; K48-T51 PolarHBondContact O-N 2.87Å; K48-T51 PolarHBondContact O-OG1 3.47Å; K48-T51 VanDerWaalsContact O-OG1 3.13Å; K48-H53 HydrophobicContact CB-CB 4.33Å; K48-H53 WeakPolarHBondContact CB-CD2 3.43Å; K48-H53 PolarHBondContact O-CD2 2.87Å; K48-H53 PolarHBondContact O-NE2 2.04Å
49	D	88.2	Confident	89	Confident	122 Å²	122	68.2 Å²	68.2	65%	0.652	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	38.5	-178.9	-58.5	-50.3	0	0	0	112.3	E28 T51	E28-D49 PolarHBondContact OE1-N 3.3Å; E28-D49 PolarHBondContact OE2-N 2.82Å; D49-T51 PolarHBondContact O-N 3Å
50	G	84.9	Confident	88.9	Confident	34 Å²	34	69.5 Å²	69.5	35%	0.351	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	6.6	-178.7	0	0	0	0	0	115.3	A24 C25 K48	A24-G50 WeakPolarHBondContact CA-O 3.27Å; C25-G50 PolarHBondContact N-O 3.08Å; C25-G50 VanDerWaalsContact N-O 3.12Å; C25-G50 WeakPolarHBondContact O-CA 3.01Å; C25-G50 VanDerWaalsContact SG-C 3.57Å; K48-G50 PolarHBondContact O-N 2.03Å
51	T	86.4	Confident	88.6	Confident	52 Å²	52	70.5 Å²	70.5	32%	0.319	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.8	-178.5	67.5	0	0	0	0	112.6	P22 C25 K48 D49 H53	P22-T51 HydrophobicContact CB-CG2 4.41Å; C25-T51 VanDerWaalsContact SG-C 3.5Å; C25-T51 PolarHBondContact SG-O 3.15Å; K48-T51 PolarHBondContact N-O 2.85Å; K48-T51 PolarHBondContact O-N 2.87Å; K48-T51 PolarHBondContact O-OG1 3.47Å; K48-T51 VanDerWaalsContact O-OG1 3.13Å; D49-T51 PolarHBondContact O-N 3Å; T51-H53 PolarHBondContact O-CD2 3.03Å; T51-H53 PolarHBondContact O-N 2.94Å; T51-H53 PolarHBondContact OG1-NE2 3.12Å
52	A	87.6	Confident	88.1	Confident	25 Å²	25	69.9 Å²	69.9	21%	0.207	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	113.7	175.6	0	0	0	0	0	112.2	Y23 L32 I34	Y23-A52 WeakPolarHBondContact O-CB 2.77Å; Y23-A52 PolarHBondContact O-N 3.31Å; L32-A52 HydrophobicContact CD1-CB 3.36Å; I34-A52 HydrophobicContact CD1-CB 3.88Å
53	H	89.5	Confident	87.4	Confident	75 Å²	75	77.4 Å²	77.4	35%	0.347	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	101.8	170.9	-74.6	-97.3	0	0	0	110.3	C45 I46 K48 T51	C45-H53 WeakPolarHBondContact CA-O 3.42Å; I46-H53 HydrophobicContact CG2-CB 4.19Å; I46-H53 PolarHBondContact N-O 3.42Å; I46-H53 PolarHBondContact O-N 3.39Å; K48-H53 HydrophobicContact CB-CB 4.33Å; K48-H53 WeakPolarHBondContact CB-CD2 3.43Å; K48-H53 PolarHBondContact O-CD2 2.87Å; K48-H53 PolarHBondContact O-NE2 2.04Å; T51-H53 PolarHBondContact O-CD2 3.03Å; T51-H53 PolarHBondContact O-N 2.94Å; T51-H53 PolarHBondContact OG1-NE2 3.12Å
54	C	90.1	Very high	87	Confident	55 Å²	55	86.7 Å²	86.7	37%	0.372	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.6	178.8	-59.8	0	0	0	0	112.3	I43 T44 C45	I43-C54 HydrophobicContact CG2-CB 4.12Å; T44-C54 CarbonylContact O-C 3.55Å; T44-C54 WeakPolarHBondContact O-CA 3.47Å; C45-C54 HydrophobicContact CB-CB 4.07Å; C45-C54 WeakPolarHBondContact CB-SG 3.1Å; C45-C54 WeakPolarHBondContact SG-CB 3.35Å; C45-C54 CovalentContact SG-SG 2.04Å; C45-C54 PolarHBondContact SG-SG 3.46Å
55	I	89.4	Confident	86.9	Confident	121 Å²	121	83.9 Å²	83.9	62%	0.621	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.4	177.1	-57.4	172.4	0	0	0	108.7	I43 T44	I43-I55 WeakPolarHBondContact CA-O 3.34Å; T44-I55 PolarHBondContact N-O 3.2Å; T44-I55 PolarHBondContact O-N 2.96Å
56	T	89.8	Confident	86.8	Confident	90 Å²	90	88.8 Å²	88.8	55%	0.552	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.6	172.1	-52	0	0	0	0	110.1	C42 I43 K58	C42-T56 CarbonylContact O-C 3.57Å; C42-T56 WeakPolarHBondContact O-CA 3.33Å; I43-T56 HydrophobicContact CG1-CG2 4.19Å; T56-K58 PolarHBondContact O-N 2.99Å
57	K	89.7	Confident	86.7	Confident	136 Å²	136	88.6 Å²	88.6	59%	0.591	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-69.1	126.1	176.8	-175.2	174.3	-178.2	175	0	110.6	C42 C76	C42-K57 PolarHBondContact O-N 3.1Å; K57-C76 HydrophobicContact CD-CB 4.48Å
58	K	89.3	Confident	86.7	Confident	174 Å²	174	91.3 Å²	91.3	76%	0.757	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-81.2	130.7	171.2	-67.1	-177.8	-178.8	175.9	0	110	T56	T56-K58 PolarHBondContact O-N 2.99Å
59	C	87.6	Confident	86.7	Confident	57 Å²	57	88.8 Å²	88.8	39%	0.385	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-91.6	143.7	178.4	-66.8	0	0	0	0	112.1	C76 C77	C59-C76 PolarHBondContact SG-SG 2.93Å; C59-C77 WeakPolarHBondContact CA-SG 3.24Å; C59-C77 HydrophobicContact CB-CB 3.74Å; C59-C77 WeakPolarHBondContact CB-SG 3.44Å; C59-C77 WeakPolarHBondContact SG-CA 3.47Å; C59-C77 WeakPolarHBondContact SG-CB 3.5Å; C59-C77 CovalentContact SG-SG 2.04Å; C59-C77 PolarHBondContact SG-SG 2.88Å
60	P	85.8	Confident	86.6	Confident	104 Å²	104	89 Å²	89	68%	0.675	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.1	144.4	171.2	26.9	-33	0	0	0	110.4	A62	P60-A62 PolarHBondContact O-N 3.2Å
61	S	79.8	Confident	86.5	Confident	83 Å²	83	89.6 Å²	89.6	58%	0.58	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-69.8	122.2	179.1	-178.5	0	0	0	0	111	Q63	S61-Q63 PolarHBondContact O-N 3.06Å; S61-Q63 WeakPolarHBondContact OG-CG 3.45Å; S61-Q63 PolarHBondContact OG-NE2 2.84Å
62	A	79.1	Confident	86.3	Confident	38 Å²	38	94.1 Å²	94.1	31%	0.314	49%	0.492	S	S	.	.			trans	-87.4	30.3	177.4	0	0	0	0	0	113.2	P60 R64 C65 V68	P60-A62 PolarHBondContact O-N 3.2Å; A62-R64 PolarHBondContact O-N 2.77Å; A62-C65 HydrophobicContact CB-CB 4.36Å; A62-C65 VanDerWaalsContact O-CB 3.3Å; A62-C65 WeakPolarHBondContact O-CB 2.84Å; A62-C65 PolarHBondContact O-N 3.47Å; A62-C65 VanDerWaalsContact O-N 3.08Å; A62-V68 HydrophobicContact CB-CG1 4.25Å; A62-V68 HydrophobicContact CB-CG2 3.72Å
63	Q	75.2	Confident	86	Confident	174 Å²	174	99.4 Å²	99.4	81%	0.813	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.8	-169.9	-90.4	164.7	13	0	0	116	S61	S61-Q63 PolarHBondContact O-N 3.06Å; S61-Q63 WeakPolarHBondContact OG-CG 3.45Å; S61-Q63 PolarHBondContact OG-NE2 2.84Å
64	R	82.8	Confident	85.5	Confident	231 Å²	231	98.9 Å²	98.9	87%	0.872	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	26.8	179.6	-62.9	-174.7	-174	170.4	1.8	113.5	A62 K109	A62-R64 PolarHBondContact O-N 2.77Å; R64-K109 PolarHBondContact O-NZ 3.15Å
65	C	87.6	Confident	85.4	Confident	21 Å²	21	97.4 Å²	97.4	14%	0.142	53%	0.533	C	S	.	.			trans	-114	121	-177.8	-160.2	0	0	0	0	112.4	A62 V67 V68 C80	A62-C65 HydrophobicContact CB-CB 4.36Å; A62-C65 VanDerWaalsContact O-CB 3.3Å; A62-C65 WeakPolarHBondContact O-CB 2.84Å; A62-C65 PolarHBondContact O-N 3.47Å; A62-C65 VanDerWaalsContact O-N 3.08Å; C65-V67 VanDerWaalsContact C-N 3.33Å; C65-V67 PolarHBondContact O-N 2.85Å; C65-V67 PolarHBondContact SG-O 2.79Å; C65-V68 HydrophobicContact CB-CG2 3.62Å; C65-C80 HydrophobicContact CB-CB 4.33Å; C65-C80 WeakPolarHBondContact CB-SG 3.29Å; C65-C80 WeakPolarHBondContact SG-CA 3.35Å; C65-C80 WeakPolarHBondContact SG-CB 3.49Å; C65-C80 CovalentContact SG-SG 2.01Å; C65-C80 PolarHBondContact SG-SG 2.82Å
66	P	88.2	Confident	85.3	Confident	104 Å²	104	92.3 Å²	92.3	68%	0.675	51%	0.508	S	S	*	.	S	Bend	trans	-63.8	-34.8	175.8	-24.4	34	0	0	0	113.9	A110	P66-A110 HydrophobicContact CB-CB 4.31Å; P66-A110 HydrophobicContact CG-CB 4.32Å
67	V	89.6	Confident	85.3	Confident	64 Å²	64	88.6 Å²	88.6	39%	0.388	49%	0.486	S	S	.	.	S	Bend	trans	-135.6	115.1	-176.8	-175.5	0	0	0	0	110.1	C65 V69 C80 K81 A110	C65-V67 VanDerWaalsContact C-N 3.33Å; C65-V67 PolarHBondContact O-N 2.85Å; C65-V67 PolarHBondContact SG-O 2.79Å; V67-V69 HydrophobicContact CG1-CG1 4.07Å; V67-C80 WeakPolarHBondContact O-CA 3.31Å; V67-K81 HydrophobicContact CB-CB 4.41Å; V67-K81 HydrophobicContact CG1-CB 4.09Å; V67-K81 HydrophobicContact CG1-CD 4.25Å; V67-K81 PolarHBondContact O-N 2.85Å; V67-K81 VanDerWaalsContact O-N 3.08Å; V67-A110 HydrophobicContact CB-CB 4.1Å; V67-A110 HydrophobicContact CG2-CB 4.45Å
68	V	89.8	Confident	85.2	Confident	58 Å²	58	87.9 Å²	87.9	35%	0.352	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.8	-176.5	175.9	0	0	0	0	109.9	A62 C65 K78 E79	A62-V68 HydrophobicContact CB-CG1 4.25Å; A62-V68 HydrophobicContact CB-CG2 3.72Å; C65-V68 HydrophobicContact CB-CG2 3.62Å; V68-K78 HydrophobicContact CG1-CB 3.29Å; V68-K78 HydrophobicContact CG1-CD 4.14Å; V68-K78 HydrophobicContact CG1-CG 4.35Å; V68-E79 CarbonylContact C-O 3.46Å; V68-E79 VanDerWaalsContact CA-O 3.31Å; V68-E79 WeakPolarHBondContact CA-O 3.47Å
69	V	90.3	Very high	85.2	Confident	46 Å²	46	84.3 Å²	84.3	28%	0.279	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	164.7	-175.2	-59.1	0	0	0	0	111.4	V67 N71 K78 E79 K81	V67-V69 HydrophobicContact CG1-CG1 4.07Å; V69-N71 WeakPolarHBondContact CG2-OD1 2.98Å; V69-N71 PolarHBondContact O-N 3.46Å; V69-K78 CarbonylContact O-C 3.56Å; V69-K78 VanDerWaalsContact O-CA 3.3Å; V69-K78 WeakPolarHBondContact O-CA 3.49Å; V69-E79 PolarHBondContact N-O 3.41Å; V69-E79 PolarHBondContact O-N 3.05Å; V69-K81 HydrophobicContact CG1-CB 4.26Å; V69-K81 HydrophobicContact CG2-CB 3.67Å; V69-K81 HydrophobicContact CG2-CG 4Å
70	R	86.5	Confident	85.5	Confident	128 Å²	128	83 Å²	83	48%	0.483	46%	0.459	S	S	.	.			trans	-83.8	104.1	163.1	-73.3	-173.2	170.3	125.7	-2.5	107.8	Q72 S75 K78	R70-Q72 PolarHBondContact O-N 3Å; R70-S75 WeakPolarHBondContact CD-O 3.37Å; R70-S75 PolarHBondContact NE-O 2.82Å; R70-S75 VanDerWaalsContact NE-O 3.08Å; R70-K78 HydrophobicContact CG-CG 4.08Å
71	N	81.6	Confident	85.8	Confident	45 Å²	45	82.8 Å²	82.8	24%	0.241	45%	0.448	C	S	.	.	S	Bend	trans	-65.7	-21.6	-178.2	-76.2	-39.6	0	0	0	112.6	V69 E79 C80 N82	V69-N71 WeakPolarHBondContact CG2-OD1 2.98Å; V69-N71 PolarHBondContact O-N 3.46Å; N71-E79 PolarHBondContact ND2-OE2 2.89Å; N71-C80 PolarHBondContact ND2-O 2.93Å; N71-N82 PolarHBondContact ND2-OD1 3.35Å; N71-N82 PolarHBondContact OD1-N 2.89Å
72	Q	82.8	Confident	86.4	Confident	147 Å²	147	80.6 Å²	80.6	69%	0.687	43%	0.43	S	S	*	.	S	Bend	trans	-131.8	138.5	177.9	-65.8	176.3	-17.8	0	0	110.1	R70 G74 S75	R70-Q72 PolarHBondContact O-N 3Å; Q72-G74 PolarHBondContact O-N 3.08Å; Q72-S75 WeakPolarHBondContact O-CB 3.28Å; Q72-S75 PolarHBondContact O-N 3.36Å; Q72-S75 PolarHBondContact O-OG 2.77Å
73	S	81	Confident	87.1	Confident	136 Å²	136	78.9 Å²	78.9	95%	0.951	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	124	170.8	-64.2	0	0	0	0	109.4
74	G	80.4	Confident	87.9	Confident	65 Å²	65	75 Å²	75	67%	0.67	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	4.6	-176.1	0	0	0	0	0	115.1	P41 Q72 C76	P41-G74 WeakPolarHBondContact CB-O 3.43Å; Q72-G74 PolarHBondContact O-N 3.08Å; G74-C76 PolarHBondContact O-N 2.78Å
75	S	86.5	Confident	88.3	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.161	37%	0.367	C	S	.	.			trans	-70	132.2	170.9	78.6	0	0	0	0	110.9	R70 Q72 C77	R70-S75 WeakPolarHBondContact CD-O 3.37Å; R70-S75 PolarHBondContact NE-O 2.82Å; R70-S75 VanDerWaalsContact NE-O 3.08Å; Q72-S75 WeakPolarHBondContact O-CB 3.28Å; Q72-S75 PolarHBondContact O-N 3.36Å; Q72-S75 PolarHBondContact O-OG 2.77Å; S75-C77 PolarHBondContact OG-O 2.77Å; S75-C77 VanDerWaalsContact OG-O 3.07Å
76	C	88.5	Confident	88.5	Confident	15 Å²	15	69.5 Å²	69.5	10%	0.101	39%	0.387	C	S	.	.	S	Bend	trans	-57.8	-59	171.4	162.6	0	0	0	0	110.5	P41 C42 K57 C59 G74	P41-C76 WeakPolarHBondContact O-CB 3.39Å; C42-C76 WeakPolarHBondContact CA-SG 3.46Å; C42-C76 HydrophobicContact CB-CB 3.9Å; C42-C76 WeakPolarHBondContact CB-SG 3.46Å; C42-C76 WeakPolarHBondContact SG-CA 3.41Å; C42-C76 WeakPolarHBondContact SG-CB 3.47Å; C42-C76 PolarHBondContact SG-O 2.9Å; C42-C76 CovalentContact SG-SG 2.03Å; C42-C76 PolarHBondContact SG-SG 3.37Å; K57-C76 HydrophobicContact CD-CB 4.48Å; C59-C76 PolarHBondContact SG-SG 2.93Å; G74-C76 PolarHBondContact O-N 2.78Å
77	C	88.9	Confident	88.6	Confident	12 Å²	12	72 Å²	72	8%	0.081	40%	0.395	C	S	.	.	S	Bend	trans	-86.4	143.4	-170.7	-58.9	0	0	0	0	112	C59 S75	C59-C77 WeakPolarHBondContact CA-SG 3.24Å; C59-C77 HydrophobicContact CB-CB 3.74Å; C59-C77 WeakPolarHBondContact CB-SG 3.44Å; C59-C77 WeakPolarHBondContact SG-CA 3.47Å; C59-C77 WeakPolarHBondContact SG-CB 3.5Å; C59-C77 CovalentContact SG-SG 2.04Å; C59-C77 PolarHBondContact SG-SG 2.88Å; S75-C77 PolarHBondContact OG-O 2.77Å; S75-C77 VanDerWaalsContact OG-O 3.07Å
78	K	88.5	Confident	88.8	Confident	120 Å²	120	72.4 Å²	72.4	52%	0.522	40%	0.397	S	S	.	.			trans	-85	139.3	163.8	-53.4	-178.4	179.9	178	0	108.6	V68 V69 R70	V68-K78 HydrophobicContact CG1-CB 3.29Å; V68-K78 HydrophobicContact CG1-CD 4.14Å; V68-K78 HydrophobicContact CG1-CG 4.35Å; V69-K78 CarbonylContact O-C 3.56Å; V69-K78 VanDerWaalsContact O-CA 3.3Å; V69-K78 WeakPolarHBondContact O-CA 3.49Å; R70-K78 HydrophobicContact CG-CG 4.08Å
79	E	89.8	Confident	89	Confident	100 Å²	100	74 Å²	74	47%	0.467	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	171.6	-176.4	-66.8	175.4	-177.3	0	0	109.3	V68 V69 N71 K81	V68-E79 CarbonylContact C-O 3.46Å; V68-E79 VanDerWaalsContact CA-O 3.31Å; V68-E79 WeakPolarHBondContact CA-O 3.47Å; V69-E79 PolarHBondContact N-O 3.41Å; V69-E79 PolarHBondContact O-N 3.05Å; N71-E79 PolarHBondContact ND2-OE2 2.89Å; E79-K81 PolarHBondContact O-N 3.39Å
80	C	92.1	Very high	89.1	Confident	28 Å²	28	74 Å²	74	19%	0.189	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	135.2	169.7	-78.7	0	0	0	0	110.9	C65 V67 N71 N82 S92	C65-C80 HydrophobicContact CB-CB 4.33Å; C65-C80 WeakPolarHBondContact CB-SG 3.29Å; C65-C80 WeakPolarHBondContact SG-CA 3.35Å; C65-C80 WeakPolarHBondContact SG-CB 3.49Å; C65-C80 CovalentContact SG-SG 2.01Å; C65-C80 PolarHBondContact SG-SG 2.82Å; V67-C80 WeakPolarHBondContact O-CA 3.31Å; N71-C80 PolarHBondContact ND2-O 2.93Å; C80-N82 PolarHBondContact O-N 3.44Å; C80-S92 WeakPolarHBondContact CB-OG 2.97Å
81	K	92.2	Very high	89.4	Confident	100 Å²	100	74.4 Å²	74.4	44%	0.435	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-54.4	124.9	177.9	-177.5	176.5	177.6	-173	0	110.9	V67 V69 E79 S92 A110 G111	V67-K81 HydrophobicContact CB-CB 4.41Å; V67-K81 HydrophobicContact CG1-CB 4.09Å; V67-K81 HydrophobicContact CG1-CD 4.25Å; V67-K81 PolarHBondContact O-N 2.85Å; V67-K81 VanDerWaalsContact O-N 3.08Å; V69-K81 HydrophobicContact CG1-CB 4.26Å; V69-K81 HydrophobicContact CG2-CB 3.67Å; V69-K81 HydrophobicContact CG2-CG 4Å; E79-K81 PolarHBondContact O-N 3.39Å; K81-S92 WeakPolarHBondContact O-CB 3.33Å; K81-A110 CarbonylContact O-C 3.51Å; K81-A110 VanDerWaalsContact O-CA 3.3Å; K81-A110 WeakPolarHBondContact O-CA 3.01Å; K81-G111 PolarHBondContact O-N 3.14Å
82	N	93.3	Very high	90	Very high	38 Å²	38	73.6 Å²	73.6	20%	0.203	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-68.7	158.4	172.9	-68.1	-15.1	0	0	0	111	N71 C80 T89 Y90 K91 S92 G111	N71-N82 PolarHBondContact ND2-OD1 3.35Å; N71-N82 PolarHBondContact OD1-N 2.89Å; C80-N82 PolarHBondContact O-N 3.44Å; N82-T89 HydrophobicContact CB-CG2 3.94Å; N82-Y90 WeakPolarHBondContact CA-O 3.43Å; N82-Y90 VanDerWaalsContact CB-O 3.32Å; N82-Y90 WeakPolarHBondContact CB-O 3.32Å; N82-K91 WeakPolarHBondContact OD1-CA 3.44Å; N82-S92 PolarHBondContact OD1-N 2.96Å; N82-G111 WeakPolarHBondContact O-CA 3.27Å
83	C	93.2	Very high	90.4	Very high	2 Å²	2	69 Å²	69	1%	0.014	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	148.4	176	-48.9	0	0	0	0	109.9	T89 Y90 C108 G111 V112 V113	C83-T89 CarbonylContact O-C 3.53Å; C83-T89 WeakPolarHBondContact O-CA 3.39Å; C83-Y90 PolarHBondContact N-O 3.23Å; C83-Y90 PolarHBondContact O-N 3.18Å; C83-C108 HydrophobicContact CB-CB 3.74Å; C83-C108 WeakPolarHBondContact CB-SG 3.44Å; C83-C108 PolarHBondContact N-SG 3.41Å; C83-C108 WeakPolarHBondContact SG-CA 3.28Å; C83-C108 WeakPolarHBondContact SG-CB 3.41Å; C83-C108 CovalentContact SG-SG 2.03Å; C83-C108 PolarHBondContact SG-SG 2.96Å; C83-G111 VanDerWaalsContact SG-C 3.6Å; C83-V112 PolarHBondContact SG-O 3.46Å; C83-V113 HydrophobicContact CB-CG2 3.53Å
84	V	93.1	Very high	91	Very high	91 Å²	91	66 Å²	66	55%	0.552	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.2	167.9	-178.4	0	0	0	0	107.4	V88	V84-V88 WeakPolarHBondContact CA-O 3.28Å
85	Y	91.3	Very high	91.7	Very high	29 Å²	29	68.5 Å²	68.5	11%	0.114	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	118.6	178.3	179.5	-104.9	0	0	0	109.4	D87 V88 Y90 W96 L106 V113 L176	Y85-D87 VanDerWaalsContact C-N 3.31Å; Y85-D87 PolarHBondContact O-N 3.45Å; Y85-V88 PolarHBondContact N-O 3.1Å; Y85-V88 PolarHBondContact O-N 3.15Å; Y85-V88 VanDerWaalsContact O-N 3.08Å; Y85-Y90 HydrophobicContact CD1-CE2 4.28Å; Y85-W96 AromaticContact CD1-CZ2 3.86Å; Y85-W96 HydrophobicContact CD1-CZ2 3.86Å; Y85-W96 AromaticContact CD1-NE1 3.83Å; Y85-W96 HydrophobicContact CG-CZ2 4.01Å; Y85-L106 HydrophobicContact CD1-CD2 4.33Å; Y85-L106 HydrophobicContact CD2-CD2 4.22Å; Y85-L106 HydrophobicContact CE1-CD2 3.86Å; Y85-L106 HydrophobicContact CE2-CD2 3.76Å; Y85-L106 HydrophobicContact CG-CD2 4.5Å; Y85-V113 HydrophobicContact CD2-CG1 4.29Å; Y85-L176 HydrophobicContact CD2-CD1 3.58Å; Y85-L176 HydrophobicContact CE2-CD1 3.94Å
86	L	91.2	Very high	92	Very high	108 Å²	108	69.1 Å²	69.1	57%	0.565	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	50.3	-176	-57.4	176.1	0	0	0	111.9	V88	L86-V88 PolarHBondContact O-N 2.77Å
87	D	90.8	Very high	92.1	Very high	158 Å²	158	71.9 Å²	71.9	85%	0.845	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	7	-178.3	-55.2	-47.8	0	0	0	116	Y85	Y85-D87 VanDerWaalsContact C-N 3.31Å; Y85-D87 PolarHBondContact O-N 3.45Å
88	V	92.8	Very high	92.2	Very high	72 Å²	72	71.7 Å²	71.7	44%	0.436	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.1	173.6	-177.8	0	0	0	0	109.8	V84 Y85 L86 Y90	V84-V88 WeakPolarHBondContact CA-O 3.28Å; Y85-V88 PolarHBondContact N-O 3.1Å; Y85-V88 PolarHBondContact O-N 3.15Å; Y85-V88 VanDerWaalsContact O-N 3.08Å; L86-V88 PolarHBondContact O-N 2.77Å; V88-Y90 HydrophobicContact CB-CD2 4.46Å; V88-Y90 HydrophobicContact CB-CE2 3.68Å; V88-Y90 HydrophobicContact CG1-CD2 4.26Å; V88-Y90 HydrophobicContact CG1-CE1 4.32Å; V88-Y90 HydrophobicContact CG1-CE2 3.64Å; V88-Y90 WeakPolarHBondContact O-CD2 3.33Å
89	T	93.4	Very high	92.2	Very high	90 Å²	90	74.6 Å²	74.6	55%	0.552	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.8	175.7	-60.8	0	0	0	0	110.4	N82 C83	N82-T89 HydrophobicContact CB-CG2 3.94Å; C83-T89 CarbonylContact O-C 3.53Å; C83-T89 WeakPolarHBondContact O-CA 3.39Å
90	Y	93.6	Very high	92	Very high	46 Å²	46	76.1 Å²	76.1	18%	0.18	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.7	176.8	-64.8	-89.5	0	0	0	110.6	N82 C83 Y85 V88 E94 W96	N82-Y90 WeakPolarHBondContact CA-O 3.43Å; N82-Y90 VanDerWaalsContact CB-O 3.32Å; N82-Y90 WeakPolarHBondContact CB-O 3.32Å; C83-Y90 PolarHBondContact N-O 3.23Å; C83-Y90 PolarHBondContact O-N 3.18Å; Y85-Y90 HydrophobicContact CD1-CE2 4.28Å; V88-Y90 HydrophobicContact CB-CD2 4.46Å; V88-Y90 HydrophobicContact CB-CE2 3.68Å; V88-Y90 HydrophobicContact CG1-CD2 4.26Å; V88-Y90 HydrophobicContact CG1-CE1 4.32Å; V88-Y90 HydrophobicContact CG1-CE2 3.64Å; V88-Y90 WeakPolarHBondContact O-CD2 3.33Å; Y90-E94 WeakPolarHBondContact CA-OE2 3.38Å; Y90-W96 AromaticContact CD1-CD2 3.75Å; Y90-W96 HydrophobicContact CD1-CD2 3.75Å; Y90-W96 AromaticContact CD1-CE3 3.49Å; Y90-W96 HydrophobicContact CD1-CE3 3.49Å; Y90-W96 VanDerWaalsContact CD1-CE3 3.49Å; Y90-W96 HydrophobicContact CD1-CG 4.45Å; Y90-W96 HydrophobicContact CD1-CH2 4.03Å; Y90-W96 HydrophobicContact CD1-CZ2 4.24Å; Y90-W96 AromaticContact CD1-CZ3 3.64Å; Y90-W96 HydrophobicContact CD1-CZ3 3.64Å; Y90-W96 AromaticContact CD2-CH2 3.74Å; Y90-W96 HydrophobicContact CD2-CH2 3.74Å; Y90-W96 AromaticContact CD2-CZ2 3.77Å; Y90-W96 HydrophobicContact CD2-CZ2 3.77Å; Y90-W96 HydrophobicContact CD2-CZ3 4.19Å; Y90-W96 HydrophobicContact CE1-CB 4.45Å; Y90-W96 AromaticContact CE1-CD2 3.51Å; Y90-W96 HydrophobicContact CE1-CD2 3.51Å; Y90-W96 AromaticContact CE1-CE2 3.72Å; Y90-W96 AromaticContact CE1-CE3 3.78Å; Y90-W96 HydrophobicContact CE1-CE3 3.78Å; Y90-W96 AromaticContact CE1-CG 3.83Å; Y90-W96 HydrophobicContact CE1-CG 3.83Å; Y90-W96 HydrophobicContact CE1-CH2 4.46Å; Y90-W96 HydrophobicContact CE1-CZ2 4.22Å; Y90-W96 HydrophobicContact CE1-CZ3 4.25Å; Y90-W96 AromaticContact CE2-CE2 3.92Å; Y90-W96 HydrophobicContact CE2-CH2 4.22Å; Y90-W96 AromaticContact CE2-CZ2 3.77Å; Y90-W96 HydrophobicContact CE2-CZ2 3.77Å; Y90-W96 HydrophobicContact CG-CD2 4.34Å; Y90-W96 AromaticContact CG-CE3 3.96Å; Y90-W96 HydrophobicContact CG-CE3 3.96Å; Y90-W96 AromaticContact CG-CH2 3.63Å; Y90-W96 HydrophobicContact CG-CH2 3.63Å; Y90-W96 HydrophobicContact CG-CZ2 4.01Å; Y90-W96 AromaticContact CG-CZ3 3.59Å; Y90-W96 HydrophobicContact CG-CZ3 3.59Å; Y90-W96 AromaticContact CZ-CD2 3.94Å; Y90-W96 AromaticContact CZ-CE2 3.64Å; Y90-W96 AromaticContact CZ-CZ2 3.99Å; Y90-W96 AromaticContact CZ-NE1 3.74Å
91	K	93.3	Very high	91.9	Very high	138 Å²	138	76.7 Å²	76.7	60%	0.6	40%	0.399	S	S	*	.			trans	-70.8	145	176.7	-60.8	177.4	-177.9	173.3	0	110.5	N82 G93 E94	N82-K91 WeakPolarHBondContact OD1-CA 3.44Å; K91-G93 PolarHBondContact O-N 2.03Å; K91-G93 VanDerWaalsContact O-N 3.15Å; K91-E94 HydrophobicContact CB-CG 3.97Å; K91-E94 VanDerWaalsContact CB-OE1 3.31Å; K91-E94 WeakPolarHBondContact CB-OE1 3.49Å; K91-E94 WeakPolarHBondContact CD-OE1 3.37Å; K91-E94 WeakPolarHBondContact CG-OE1 3.02Å; K91-E94 PolarHBondContact N-OE2 3.3Å; K91-E94 VanDerWaalsContact O-CB 3.29Å; K91-E94 WeakPolarHBondContact O-CB 3.4Å; K91-E94 PolarHBondContact O-N 3.24Å
92	S	92.8	Very high	91.7	Very high	28 Å²	28	74.3 Å²	74.3	20%	0.196	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	121.4	173.2	172.6	0	0	0	0	111.1	C80 K81 N82 A110	C80-S92 WeakPolarHBondContact CB-OG 2.97Å; K81-S92 WeakPolarHBondContact O-CB 3.33Å; N82-S92 PolarHBondContact OD1-N 2.96Å; S92-A110 PolarHBondContact OG-N 3.44Å; S92-A110 VanDerWaalsContact OG-N 3.11Å
93	G	91.4	Very high	91.5	Very high	51 Å²	51	73.5 Å²	73.5	53%	0.526	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.2	-16.2	-173.1	0	0	0	0	0	113.2	K91 C108	K91-G93 PolarHBondContact O-N 2.03Å; K91-G93 VanDerWaalsContact O-N 3.15Å; G93-C108 PolarHBondContact N-O 2.83Å
94	E	94.7	Very high	91.4	Very high	72 Å²	72	77.2 Å²	77.2	34%	0.336	41%	0.406	S	S	.	.			trans	-70.5	145.9	177.9	-73.5	177.4	-175.8	0	0	112.2	Y90 K91 T107 C108	Y90-E94 WeakPolarHBondContact CA-OE2 3.38Å; K91-E94 HydrophobicContact CB-CG 3.97Å; K91-E94 VanDerWaalsContact CB-OE1 3.31Å; K91-E94 WeakPolarHBondContact CB-OE1 3.49Å; K91-E94 WeakPolarHBondContact CD-OE1 3.37Å; K91-E94 WeakPolarHBondContact CG-OE1 3.02Å; K91-E94 PolarHBondContact N-OE2 3.3Å; K91-E94 VanDerWaalsContact O-CB 3.29Å; K91-E94 WeakPolarHBondContact O-CB 3.4Å; K91-E94 PolarHBondContact O-N 3.24Å; E94-T107 WeakPolarHBondContact O-CA 3.42Å; E94-C108 PolarHBondContact O-N 3.38Å
95	Q	94.1	Very high	91.3	Very high	118 Å²	118	76.1 Å²	76.1	55%	0.551	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	138.9	175.2	-55.6	-171.9	-6.8	0	0	108.9	L106 T107	Q95-L106 VanDerWaalsContact CA-O 3.28Å; Q95-L106 WeakPolarHBondContact CA-O 3.3Å; Q95-T107 HydrophobicContact CG-CG2 3.92Å; Q95-T107 WeakPolarHBondContact CG-OG1 3.18Å
96	W	93.8	Very high	91.4	Very high	36 Å²	36	74.8 Å²	74.8	14%	0.136	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.7	179.5	65.4	102.5	0	0	0	111	Y85 Y90 R105 L106 C108 V113	Y85-W96 AromaticContact CD1-CZ2 3.86Å; Y85-W96 HydrophobicContact CD1-CZ2 3.86Å; Y85-W96 AromaticContact CD1-NE1 3.83Å; Y85-W96 HydrophobicContact CG-CZ2 4.01Å; Y90-W96 AromaticContact CD1-CD2 3.75Å; Y90-W96 HydrophobicContact CD1-CD2 3.75Å; Y90-W96 AromaticContact CD1-CE3 3.49Å; Y90-W96 HydrophobicContact CD1-CE3 3.49Å; Y90-W96 VanDerWaalsContact CD1-CE3 3.49Å; Y90-W96 HydrophobicContact CD1-CG 4.45Å; Y90-W96 HydrophobicContact CD1-CH2 4.03Å; Y90-W96 HydrophobicContact CD1-CZ2 4.24Å; Y90-W96 AromaticContact CD1-CZ3 3.64Å; Y90-W96 HydrophobicContact CD1-CZ3 3.64Å; Y90-W96 AromaticContact CD2-CH2 3.74Å; Y90-W96 HydrophobicContact CD2-CH2 3.74Å; Y90-W96 AromaticContact CD2-CZ2 3.77Å; Y90-W96 HydrophobicContact CD2-CZ2 3.77Å; Y90-W96 HydrophobicContact CD2-CZ3 4.19Å; Y90-W96 HydrophobicContact CE1-CB 4.45Å; Y90-W96 AromaticContact CE1-CD2 3.51Å; Y90-W96 HydrophobicContact CE1-CD2 3.51Å; Y90-W96 AromaticContact CE1-CE2 3.72Å; Y90-W96 AromaticContact CE1-CE3 3.78Å; Y90-W96 HydrophobicContact CE1-CE3 3.78Å; Y90-W96 AromaticContact CE1-CG 3.83Å; Y90-W96 HydrophobicContact CE1-CG 3.83Å; Y90-W96 HydrophobicContact CE1-CH2 4.46Å; Y90-W96 HydrophobicContact CE1-CZ2 4.22Å; Y90-W96 HydrophobicContact CE1-CZ3 4.25Å; Y90-W96 AromaticContact CE2-CE2 3.92Å; Y90-W96 HydrophobicContact CE2-CH2 4.22Å; Y90-W96 AromaticContact CE2-CZ2 3.77Å; Y90-W96 HydrophobicContact CE2-CZ2 3.77Å; Y90-W96 HydrophobicContact CG-CD2 4.34Å; Y90-W96 AromaticContact CG-CE3 3.96Å; Y90-W96 HydrophobicContact CG-CE3 3.96Å; Y90-W96 AromaticContact CG-CH2 3.63Å; Y90-W96 HydrophobicContact CG-CH2 3.63Å; Y90-W96 HydrophobicContact CG-CZ2 4.01Å; Y90-W96 AromaticContact CG-CZ3 3.59Å; Y90-W96 HydrophobicContact CG-CZ3 3.59Å; Y90-W96 AromaticContact CZ-CD2 3.94Å; Y90-W96 AromaticContact CZ-CE2 3.64Å; Y90-W96 AromaticContact CZ-CZ2 3.99Å; Y90-W96 AromaticContact CZ-NE1 3.74Å; W96-R105 CarbonylContact O-C 3.34Å; W96-R105 WeakPolarHBondContact O-CA 3.01Å; W96-L106 HydrophobicContact CD2-CB 3.9Å; W96-L106 VanDerWaalsContact CE2-CB 3.46Å; W96-L106 HydrophobicContact CE3-CB 4.4Å; W96-L106 HydrophobicContact CG-CB 4.42Å; W96-L106 HydrophobicContact CH2-CB 4.11Å; W96-L106 HydrophobicContact CZ2-CB 3.57Å; W96-L106 HydrophobicContact CZ2-CD2 4.17Å; W96-L106 HydrophobicContact CZ2-CG 4.38Å; W96-L106 HydrophobicContact CZ3-CB 4.5Å; W96-L106 PolarHBondContact N-O 3.04Å; W96-L106 PolarHBondContact O-N 2.82Å; W96-C108 HydrophobicContact CH2-CB 4.1Å; W96-C108 HydrophobicContact CZ3-CB 3.8Å; W96-V113 HydrophobicContact CH2-CG1 3.99Å; W96-V113 HydrophobicContact CH2-CG2 4.37Å; W96-V113 HydrophobicContact CZ2-CG1 4.01Å
97	M	90.7	Very high	91.6	Very high	73 Å²	73	70.9 Å²	70.9	36%	0.36	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	143.9	172.6	-63.1	-54.5	-65.2	0	0	109.6	S102 R104 R105 I118	M97-S102 WeakPolarHBondContact CE-O 3.24Å; M97-R104 WeakPolarHBondContact CA-O 3.36Å; M97-R104 WeakPolarHBondContact CE-O 3.46Å; M97-R105 HydrophobicContact SD-CB 3.8Å; M97-R105 HydrophobicContact SD-CG 4.01Å; M97-I118 HydrophobicContact CE-CD1 3.51Å; M97-I118 HydrophobicContact SD-CD1 4.16Å
98	S	89.7	Confident	91.7	Very high	8 Å²	8	63.3 Å²	63.3	6%	0.056	33%	0.327	C	S	.	.			trans	-65	136.6	173.9	178	0	0	0	0	110	Q100 D101 R104	S98-Q100 PolarHBondContact O-N 3.2Å; S98-Q100 PolarHBondContact OG-N 3.11Å; S98-Q100 PolarHBondContact OG-OE1 3.47Å; S98-D101 WeakPolarHBondContact CB-O 2.89Å; S98-D101 CarbonylContact O-C 3.58Å; S98-D101 PolarHBondContact OG-N 2.01Å; S98-R104 PolarHBondContact N-O 3.07Å
99	M	88.1	Confident	91.7	Very high	180 Å²	180	64.4 Å²	64.4	89%	0.887	33%	0.325	S	S	*	.	S	Bend	trans	-69	-23.6	172.5	-61.9	-63.4	-76	0	0	112
100	Q	87.4	Confident	91.6	Very high	132 Å²	132	60.5 Å²	60.5	62%	0.617	30%	0.302	S	S	*	.	S	Bend	trans	-91.4	-26.2	-178.8	-59.6	80.2	20.2	0	0	113	S98	S98-Q100 PolarHBondContact O-N 3.2Å; S98-Q100 PolarHBondContact OG-N 3.11Å; S98-Q100 PolarHBondContact OG-OE1 3.47Å
101	D	88.4	Confident	91.5	Very high	41 Å²	41	59.4 Å²	59.4	22%	0.219	31%	0.305	C	S	.	.			trans	-139.7	106.6	-179	-175.4	-9.4	0	0	0	110.4	S98 C103 R104 R117	S98-D101 WeakPolarHBondContact CB-O 2.89Å; S98-D101 CarbonylContact O-C 3.58Å; S98-D101 PolarHBondContact OG-N 2.01Å; D101-C103 PolarHBondContact O-N 3.25Å; D101-C103 WeakPolarHBondContact OD1-CA 2.96Å; D101-C103 WeakPolarHBondContact OD1-CB 3.42Å; D101-C103 PolarHBondContact OD1-N 3.25Å; D101-R104 HydrophobicContact CB-CB 3.87Å; D101-R104 PolarHBondContact O-N 3.02Å; D101-R117 IonicContact OD2-CZ 3.74Å; D101-R117 IonicContact OD2-NH1 3.06Å; D101-R117 PolarHBondContact OD2-NH1 3.28Å; D101-R117 IonicContact OD2-NH2 3.84Å
102	S	88.5	Confident	91.5	Very high	50 Å²	50	55.4 Å²	55.4	35%	0.35	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.8	178.5	66.8	0	0	0	0	113.2	M97 C134	M97-S102 WeakPolarHBondContact CE-O 3.24Å; S102-C134 WeakPolarHBondContact O-CB 3.34Å
103	C	89.3	Confident	91.5	Very high	21 Å²	21	54.3 Å²	54.3	14%	0.142	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	5.1	175.9	-75.2	0	0	0	0	114.3	D101 R117 I118 C134	D101-C103 PolarHBondContact O-N 3.25Å; D101-C103 WeakPolarHBondContact OD1-CA 2.96Å; D101-C103 WeakPolarHBondContact OD1-CB 3.42Å; D101-C103 PolarHBondContact OD1-N 3.25Å; C103-R117 WeakPolarHBondContact O-CA 3.49Å; C103-I118 WeakPolarHBondContact O-CB 3.31Å; C103-I118 PolarHBondContact O-N 3.48Å; C103-C134 WeakPolarHBondContact CA-SG 3.34Å; C103-C134 HydrophobicContact CB-CB 3.95Å; C103-C134 WeakPolarHBondContact CB-SG 3.49Å; C103-C134 WeakPolarHBondContact SG-CA 3.09Å; C103-C134 WeakPolarHBondContact SG-CB 2.93Å; C103-C134 PolarHBondContact SG-O 2.87Å; C103-C134 CovalentContact SG-SG 2.04Å; C103-C134 PolarHBondContact SG-SG 2.03Å
104	R	91.1	Very high	91.6	Very high	79 Å²	79	54 Å²	54	30%	0.298	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.8	-179.6	-168.9	-178.8	-167.5	167.3	13.7	110.4	M97 S98 D101 S115	M97-R104 WeakPolarHBondContact CA-O 3.36Å; M97-R104 WeakPolarHBondContact CE-O 3.46Å; S98-R104 PolarHBondContact N-O 3.07Å; D101-R104 HydrophobicContact CB-CB 3.87Å; D101-R104 PolarHBondContact O-N 3.02Å; R104-S115 WeakPolarHBondContact CG-OG 3.3Å; R104-S115 PolarHBondContact NE-OG 3.45Å; R104-S115 PolarHBondContact NH2-OG 3.39Å
105	R	91.6	Very high	91.4	Very high	69 Å²	69	50.8 Å²	50.8	26%	0.26	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.6	172.2	-171.6	178.5	-61.5	159.4	-4.7	109.3	W96 M97 S115 A116	W96-R105 CarbonylContact O-C 3.34Å; W96-R105 WeakPolarHBondContact O-CA 3.01Å; M97-R105 HydrophobicContact SD-CB 3.8Å; M97-R105 HydrophobicContact SD-CG 4.01Å; R105-S115 CarbonylContact O-C 3.54Å; R105-S115 WeakPolarHBondContact O-CA 3.43Å; R105-A116 PolarHBondContact N-O 2.79Å; R105-A116 PolarHBondContact O-N 3.08Å
106	L	93.7	Very high	91.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	153.9	172.2	-62.6	101.8	0	0	0	110.4	Y85 Q95 W96 V113 T114	Y85-L106 HydrophobicContact CD1-CD2 4.33Å; Y85-L106 HydrophobicContact CD2-CD2 4.22Å; Y85-L106 HydrophobicContact CE1-CD2 3.86Å; Y85-L106 HydrophobicContact CE2-CD2 3.76Å; Y85-L106 HydrophobicContact CG-CD2 4.5Å; Q95-L106 VanDerWaalsContact CA-O 3.28Å; Q95-L106 WeakPolarHBondContact CA-O 3.3Å; W96-L106 HydrophobicContact CD2-CB 3.9Å; W96-L106 VanDerWaalsContact CE2-CB 3.46Å; W96-L106 HydrophobicContact CE3-CB 4.4Å; W96-L106 HydrophobicContact CG-CB 4.42Å; W96-L106 HydrophobicContact CH2-CB 4.11Å; W96-L106 HydrophobicContact CZ2-CB 3.57Å; W96-L106 HydrophobicContact CZ2-CD2 4.17Å; W96-L106 HydrophobicContact CZ2-CG 4.38Å; W96-L106 HydrophobicContact CZ3-CB 4.5Å; W96-L106 PolarHBondContact N-O 3.04Å; W96-L106 PolarHBondContact O-N 2.82Å; L106-V113 HydrophobicContact CB-CG1 4.19Å; L106-V113 HydrophobicContact CD2-CG1 3.62Å; L106-V113 HydrophobicContact CG-CG1 4.49Å; L106-T114 CarbonylContact C-O 3.58Å; L106-T114 VanDerWaalsContact CA-O 3.24Å; L106-T114 WeakPolarHBondContact CA-O 3.23Å
107	T	93.9	Very high	91.1	Very high	26 Å²	26	50.1 Å²	50.1	16%	0.16	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	129.3	178.5	-62.4	0	0	0	0	109.3	E94 Q95 V113 T114	E94-T107 WeakPolarHBondContact O-CA 3.42Å; Q95-T107 HydrophobicContact CG-CG2 3.92Å; Q95-T107 WeakPolarHBondContact CG-OG1 3.18Å; T107-V113 CarbonylContact O-C 3.54Å; T107-V113 WeakPolarHBondContact O-CA 3.3Å; T107-T114 PolarHBondContact N-O 3.08Å; T107-T114 PolarHBondContact O-N 3.27Å; T107-T114 PolarHBondContact O-OG1 2.85Å
108	C	93.8	Very high	91	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128	173.4	173.8	0	0	0	0	110.3	C83 G93 E94 W96	C83-C108 HydrophobicContact CB-CB 3.74Å; C83-C108 WeakPolarHBondContact CB-SG 3.44Å; C83-C108 PolarHBondContact N-SG 3.41Å; C83-C108 WeakPolarHBondContact SG-CA 3.28Å; C83-C108 WeakPolarHBondContact SG-CB 3.41Å; C83-C108 CovalentContact SG-SG 2.03Å; C83-C108 PolarHBondContact SG-SG 2.96Å; G93-C108 PolarHBondContact N-O 2.83Å; E94-C108 PolarHBondContact O-N 3.38Å; W96-C108 HydrophobicContact CH2-CB 4.1Å; W96-C108 HydrophobicContact CZ3-CB 3.8Å
109	K	92.7	Very high	90.8	Very high	94 Å²	94	51 Å²	51	41%	0.409	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	117.6	169.7	-173.6	68.6	177.5	179.7	0	110.5	R64 G111 V112	R64-K109 PolarHBondContact O-NZ 3.15Å; K109-G111 VanDerWaalsContact C-N 3.27Å; K109-G111 PolarHBondContact O-N 2.04Å; K109-V112 PolarHBondContact N-O 3.44Å; K109-V112 PolarHBondContact O-N 2.88Å
110	A	91.7	Very high	90.5	Very high	8 Å²	8	44.5 Å²	44.5	7%	0.066	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	43.9	172.8	0	0	0	0	0	114	P66 V67 K81 S92 V112	P66-A110 HydrophobicContact CB-CB 4.31Å; P66-A110 HydrophobicContact CG-CB 4.32Å; V67-A110 HydrophobicContact CB-CB 4.1Å; V67-A110 HydrophobicContact CG2-CB 4.45Å; K81-A110 CarbonylContact O-C 3.51Å; K81-A110 VanDerWaalsContact O-CA 3.3Å; K81-A110 WeakPolarHBondContact O-CA 3.01Å; S92-A110 PolarHBondContact OG-N 3.44Å; S92-A110 VanDerWaalsContact OG-N 3.11Å; A110-V112 VanDerWaalsContact C-N 3.34Å
111	G	91.6	Very high	90.4	Very high	23 Å²	23	42.2 Å²	42.2	24%	0.237	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	-1.2	179.6	0	0	0	0	0	115.3	K81 N82 C83 K109	K81-G111 PolarHBondContact O-N 3.14Å; N82-G111 WeakPolarHBondContact O-CA 3.27Å; C83-G111 VanDerWaalsContact SG-C 3.6Å; K109-G111 VanDerWaalsContact C-N 3.27Å; K109-G111 PolarHBondContact O-N 2.04Å
112	V	92.7	Very high	90	Very high	55 Å²	55	42.7 Å²	42.7	33%	0.333	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	129	178.3	-176.5	0	0	0	0	109.8	C83 K109 A110 T114 M175	C83-V112 PolarHBondContact SG-O 3.46Å; K109-V112 PolarHBondContact N-O 3.44Å; K109-V112 PolarHBondContact O-N 2.88Å; A110-V112 VanDerWaalsContact C-N 3.34Å; V112-T114 HydrophobicContact CG1-CG2 4.29Å; V112-M175 HydrophobicContact CG1-SD 4.21Å
113	V	93.6	Very high	89.4	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.024	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.3	174	-177.3	0	0	0	0	109	C83 Y85 W96 L106 T107 I174 L176	C83-V113 HydrophobicContact CB-CG2 3.53Å; Y85-V113 HydrophobicContact CD2-CG1 4.29Å; W96-V113 HydrophobicContact CH2-CG1 3.99Å; W96-V113 HydrophobicContact CH2-CG2 4.37Å; W96-V113 HydrophobicContact CZ2-CG1 4.01Å; L106-V113 HydrophobicContact CB-CG1 4.19Å; L106-V113 HydrophobicContact CD2-CG1 3.62Å; L106-V113 HydrophobicContact CG-CG1 4.49Å; T107-V113 CarbonylContact O-C 3.54Å; T107-V113 WeakPolarHBondContact O-CA 3.3Å; V113-I174 PolarHBondContact O-N 3.37Å; V113-L176 HydrophobicContact CB-CD1 4.42Å
114	T	92	Very high	88.9	Confident	45 Å²	45	44.7 Å²	44.7	28%	0.276	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	149	172.6	60.2	0	0	0	0	110.1	L106 T107 V112	L106-T114 CarbonylContact C-O 3.58Å; L106-T114 VanDerWaalsContact CA-O 3.24Å; L106-T114 WeakPolarHBondContact CA-O 3.23Å; T107-T114 PolarHBondContact N-O 3.08Å; T107-T114 PolarHBondContact O-N 3.27Å; T107-T114 PolarHBondContact O-OG1 2.85Å; V112-T114 HydrophobicContact CG1-CG2 4.29Å
115	S	91.5	Very high	88.3	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.028	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.9	179.3	152.1	0	0	0	0	109.5	R104 R105 Q172	R104-S115 WeakPolarHBondContact CG-OG 3.3Å; R104-S115 PolarHBondContact NE-OG 3.45Å; R104-S115 PolarHBondContact NH2-OG 3.39Å; R105-S115 CarbonylContact O-C 3.54Å; R105-S115 WeakPolarHBondContact O-CA 3.43Å; S115-Q172 PolarHBondContact N-O 3.02Å; S115-Q172 WeakPolarHBondContact O-CA 3.1Å; S115-Q172 PolarHBondContact O-N 3.18Å
116	A	91	Very high	87.7	Confident	8 Å²	8	48.4 Å²	48.4	7%	0.066	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.3	169.9	0	0	0	0	0	110.7	R105 Q169 I170	R105-A116 PolarHBondContact N-O 2.79Å; R105-A116 PolarHBondContact O-N 3.08Å; A116-Q169 HydrophobicContact CB-CB 3.94Å; A116-Q169 HydrophobicContact CB-CG 4.34Å; A116-I170 VanDerWaalsContact CA-O 3.28Å; A116-I170 WeakPolarHBondContact CA-O 3.39Å
117	R	90.1	Very high	87.2	Confident	132 Å²	132	50.1 Å²	50.1	50%	0.498	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.5	167.3	-164.2	174.2	-172	93.4	5.1	108.7	D101 C103 I170	D101-R117 IonicContact OD2-CZ 3.74Å; D101-R117 IonicContact OD2-NH1 3.06Å; D101-R117 PolarHBondContact OD2-NH1 3.28Å; D101-R117 IonicContact OD2-NH2 3.84Å; C103-R117 WeakPolarHBondContact O-CA 3.49Å; R117-I170 PolarHBondContact N-O 2.72Å; R117-I170 PolarHBondContact O-N 3.1Å
118	I	87.7	Confident	86.8	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.077	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.9	174	-69.1	173.9	0	0	0	108.5	M97 C103 C134 A167	M97-I118 HydrophobicContact CE-CD1 3.51Å; M97-I118 HydrophobicContact SD-CD1 4.16Å; C103-I118 WeakPolarHBondContact O-CB 3.31Å; C103-I118 PolarHBondContact O-N 3.48Å; I118-C134 VanDerWaalsContact CG2-SG 3.54Å; I118-A167 HydrophobicContact CB-CB 4.35Å; I118-A167 HydrophobicContact CG1-CB 4.33Å; I118-A167 HydrophobicContact CG2-CB 3.41Å; I118-A167 VanDerWaalsContact CG2-CB 3.41Å
119	Q	86	Confident	86.4	Confident	86 Å²	86	66.5 Å²	66.5	40%	0.402	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.7	169.7	-64.1	-64.1	-22.9	0	0	109.3	A167 Q168 I170	Q119-A167 WeakPolarHBondContact O-CA 3.13Å; Q119-Q168 PolarHBondContact N-O 3.08Å; Q119-Q168 PolarHBondContact O-N 3.35Å; Q119-Q168 VanDerWaalsContact O-N 3.12Å; Q119-I170 HydrophobicContact CG-CD1 4.05Å; Q119-I170 HydrophobicContact CG-CG1 4.45Å
120	C	83.3	Confident	86.1	Confident	43 Å²	43	65 Å²	65	29%	0.291	35%	0.35	S	S	.	.			trans	-96.5	124.9	-176.2	-52.5	0	0	0	0	110.3	V122 C135	C120-V122 HydrophobicContact CB-CG2 4.11Å; C120-C135 HydrophobicContact CB-CB 3.7Å; C120-C135 WeakPolarHBondContact CB-SG 3.29Å; C120-C135 WeakPolarHBondContact SG-CA 3.41Å; C120-C135 WeakPolarHBondContact SG-CB 3.47Å; C120-C135 CovalentContact SG-SG 2.03Å; C120-C135 PolarHBondContact SG-SG 3.46Å
121	V	83.5	Confident	85.8	Confident	84 Å²	84	71.8 Å²	71.8	51%	0.509	39%	0.39	S	S	.	.			trans	-95.1	119	168.1	-179.3	0	0	0	0	107.9
122	V	80.1	Confident	85.5	Confident	50 Å²	50	74 Å²	74	30%	0.303	41%	0.413	S	S	.	.			trans	-121	99.1	-170.1	-173.8	0	0	0	0	109.6	C120 C124 A127 P136	C120-V122 HydrophobicContact CB-CG2 4.11Å; V122-C124 PolarHBondContact O-N 3.38Å; V122-A127 HydrophobicContact CG1-CB 3.35Å; V122-P136 HydrophobicContact CB-CG 4.46Å; V122-P136 HydrophobicContact CG1-CG 4.18Å; V122-P136 HydrophobicContact CG2-CG 3.52Å
123	P	75.9	Confident	85.1	Confident	85 Å²	85	76 Å²	76	55%	0.552	42%	0.421	S	S	*	.			trans	-85.1	34.2	-172.1	35.8	-37.1	0	0	0	112.7	F161	P123-F161 HydrophobicContact CG-CD2 4.47Å; P123-F161 HydrophobicContact CG-CE2 3.77Å; P123-F161 HydrophobicContact CG-CZ 4.01Å
124	C	79.7	Confident	84.8	Confident	29 Å²	29	77.1 Å²	77.1	20%	0.196	43%	0.429	C	S	.	.			trans	-140.2	141.2	178.7	74	0	0	0	0	111.3	V122 N126 C138 F161	V122-C124 PolarHBondContact O-N 3.38Å; C124-N126 VanDerWaalsContact C-N 3.34Å; C124-N126 PolarHBondContact O-N 2.82Å; C124-C138 HydrophobicContact CB-CB 3.89Å; C124-C138 WeakPolarHBondContact CB-SG 2.98Å; C124-C138 WeakPolarHBondContact SG-CB 3.47Å; C124-C138 CovalentContact SG-SG 2.03Å; C124-C138 PolarHBondContact SG-SG 3.3Å; C124-F161 HydrophobicContact CB-CZ 4.4Å
125	P	77.7	Confident	84.5	Confident	114 Å²	114	76.4 Å²	76.4	74%	0.74	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-27.4	-177	26.6	-33.7	0	0	0	113.2
126	N	79.4	Confident	84.3	Confident	111 Å²	111	77.6 Å²	77.6	59%	0.594	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	42.8	-171.9	-64.1	-34.7	0	0	0	112.5	C124 K128 P139	C124-N126 VanDerWaalsContact C-N 3.34Å; C124-N126 PolarHBondContact O-N 2.82Å; N126-K128 PolarHBondContact O-N 3.41Å; N126-P139 WeakPolarHBondContact O-CD 3.29Å; N126-P139 WeakPolarHBondContact O-CG 3.04Å
127	A	84	Confident	83.9	Confident	37 Å²	37	80.2 Å²	80.2	31%	0.306	45%	0.448	S	S	.	.			trans	-65.4	133.4	178.5	0	0	0	0	0	111.1	V122 P136	V122-A127 HydrophobicContact CG1-CB 3.35Å; A127-P136 HydrophobicContact CB-CB 3.87Å; A127-P136 HydrophobicContact CB-CG 4.01Å
128	K	85	Confident	83.3	Confident	135 Å²	135	75.2 Å²	75.2	59%	0.587	43%	0.433	S	S	*	.	B	Isolated β-bridge	trans	-104.7	128.7	179.8	-65.5	-171.3	177.4	-174.9	0	109.9	N126 P136 V137	N126-K128 PolarHBondContact O-N 3.41Å; K128-P136 CarbonylContact O-C 3.51Å; K128-P136 VanDerWaalsContact O-CA 3.3Å; K128-P136 WeakPolarHBondContact O-CA 3.37Å; K128-P136 WeakPolarHBondContact O-CB 3.47Å; K128-V137 PolarHBondContact N-O 2.91Å; K128-V137 PolarHBondContact O-N 2.99Å
129	R	86.4	Confident	82.8	Confident	235 Å²	235	77.2 Å²	77.2	89%	0.887	45%	0.447	S	S	*	.			trans	-72.6	136.5	169.7	-72.3	-173.2	177.1	-177.3	0.3	109.4	P136	R129-P136 HydrophobicContact CG-CB 4.2Å
130	V	85.1	Confident	81.9	Confident	63 Å²	63	82.9 Å²	82.9	38%	0.382	47%	0.474	S	S	.	.			trans	-119.4	130.9	175.8	-176.7	0	0	0	0	107.6	G132 L133 V137	V130-G132 PolarHBondContact O-N 3.01Å; V130-L133 HydrophobicContact CB-CB 4.48Å; V130-L133 HydrophobicContact CB-CD1 3.62Å; V130-L133 HydrophobicContact CG1-CD1 3.53Å; V130-L133 HydrophobicContact CG2-CD1 4.46Å; V130-L133 PolarHBondContact O-N 2.97Å; V130-V137 HydrophobicContact CG2-CG1 4.27Å; V130-V137 HydrophobicContact CG2-CG2 3.54Å
131	V	86.5	Confident	80.6	Confident	150 Å²	150	83.6 Å²	83.6	91%	0.909	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	132.7	178.8	-179.6	0	0	0	0	109.4	L133	V131-L133 VanDerWaalsContact C-N 3.34Å
132	G	83.9	Confident	78.9	Confident	69 Å²	69	85.9 Å²	85.9	71%	0.711	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	-14	-178.9	0	0	0	0	0	115.2	V130	V130-G132 PolarHBondContact O-N 3.01Å
133	L	84.9	Confident	77.5	Confident	96 Å²	96	92 Å²	92	50%	0.503	52%	0.52	S	S	.	.			trans	-97.4	144.7	172.8	-77	123.4	0	0	0	111	V130 V131	V130-L133 HydrophobicContact CB-CB 4.48Å; V130-L133 HydrophobicContact CB-CD1 3.62Å; V130-L133 HydrophobicContact CG1-CD1 3.53Å; V130-L133 HydrophobicContact CG2-CD1 4.46Å; V130-L133 PolarHBondContact O-N 2.97Å; V131-L133 VanDerWaalsContact C-N 3.34Å
134	C	86.5	Confident	76.3	Confident	29 Å²	29	90.4 Å²	90.4	20%	0.196	51%	0.511	C	S	.	.	S	Bend	trans	-70.2	-54.1	171.4	174.6	0	0	0	0	111.8	S102 C103 I118	S102-C134 WeakPolarHBondContact O-CB 3.34Å; C103-C134 WeakPolarHBondContact CA-SG 3.34Å; C103-C134 HydrophobicContact CB-CB 3.95Å; C103-C134 WeakPolarHBondContact CB-SG 3.49Å; C103-C134 WeakPolarHBondContact SG-CA 3.09Å; C103-C134 WeakPolarHBondContact SG-CB 2.93Å; C103-C134 PolarHBondContact SG-O 2.87Å; C103-C134 CovalentContact SG-SG 2.04Å; C103-C134 PolarHBondContact SG-SG 2.03Å; I118-C134 VanDerWaalsContact CG2-SG 3.54Å
135	C	86.8	Confident	74.9	Confident	29 Å²	29	97.8 Å²	97.8	20%	0.196	54%	0.54	C	S	.	.	S	Bend	trans	-91.4	141.7	-173.4	-61.9	0	0	0	0	111.2	C120	C120-C135 HydrophobicContact CB-CB 3.7Å; C120-C135 WeakPolarHBondContact CB-SG 3.29Å; C120-C135 WeakPolarHBondContact SG-CA 3.41Å; C120-C135 WeakPolarHBondContact SG-CB 3.47Å; C120-C135 CovalentContact SG-SG 2.03Å; C120-C135 PolarHBondContact SG-SG 3.46Å
136	P	86.2	Confident	73.6	Confident	29 Å²	29	97.6 Å²	97.6	19%	0.188	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-68.4	148.4	173.5	33.2	-36.4	0	0	0	109.8	V122 A127 K128 R129	V122-P136 HydrophobicContact CB-CG 4.46Å; V122-P136 HydrophobicContact CG1-CG 4.18Å; V122-P136 HydrophobicContact CG2-CG 3.52Å; A127-P136 HydrophobicContact CB-CB 3.87Å; A127-P136 HydrophobicContact CB-CG 4.01Å; K128-P136 CarbonylContact O-C 3.51Å; K128-P136 VanDerWaalsContact O-CA 3.3Å; K128-P136 WeakPolarHBondContact O-CA 3.37Å; K128-P136 WeakPolarHBondContact O-CB 3.47Å; R129-P136 HydrophobicContact CG-CB 4.2Å
137	V	84	Confident	72.2	Confident	63 Å²	63	95.8 Å²	95.8	38%	0.382	54%	0.537	S	S	.	.	B	Isolated β-bridge	trans	-99.4	143.1	178.6	-57.2	0	0	0	0	109.7	K128 V130	K128-V137 PolarHBondContact N-O 2.91Å; K128-V137 PolarHBondContact O-N 2.99Å; V130-V137 HydrophobicContact CG2-CG1 4.27Å; V130-V137 HydrophobicContact CG2-CG2 3.54Å
138	C	76.9	Confident	71	Confident	27 Å²	27	100.8 Å²	100.8	18%	0.182	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-82	129.9	171.8	-60.6	0	0	0	0	109	C124 Q140 F161	C124-C138 HydrophobicContact CB-CB 3.89Å; C124-C138 WeakPolarHBondContact CB-SG 2.98Å; C124-C138 WeakPolarHBondContact SG-CB 3.47Å; C124-C138 CovalentContact SG-SG 2.03Å; C124-C138 PolarHBondContact SG-SG 3.3Å; C138-Q140 PolarHBondContact O-N 3.19Å; C138-F161 HydrophobicContact CB-CE1 3.67Å; C138-F161 HydrophobicContact CB-CZ 3.69Å; C138-F161 WeakPolarHBondContact SG-CZ 3.41Å
139	P	76.8	Confident	69.6	Low	57 Å²	57	103.4 Å²	103.4	37%	0.37	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-59.7	129.4	174.1	24.5	-31.7	0	0	0	108.9	N126 G141	N126-P139 WeakPolarHBondContact O-CD 3.29Å; N126-P139 WeakPolarHBondContact O-CG 3.04Å; P139-G141 PolarHBondContact O-N 2.87Å
140	Q	66.8	Low	68.1	Low	206 Å²	206	99 Å²	99	96%	0.963	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-73.4	116.3	173.4	-52	-164.4	52.9	0	0	107.7	C138	C138-Q140 PolarHBondContact O-N 3.19Å
141	G	56.5	Low	66.7	Low	57 Å²	57	102.3 Å²	102.3	59%	0.588	56%	0.562	S	S	*	*			trans	107.2	124.7	176.8	0	0	0	0	0	113.5	P139	P139-G141 PolarHBondContact O-N 2.87Å
142	N	47.1	Very low	65.3	Low	132 Å²	132	101.2 Å²	101.2	71%	0.706	55%	0.55	S	S	*	.	S	Bend	cis	-146.4	59.5	26.5	-74.1	-28.6	0	0	0	113.4	C144	N142-C144 VanDerWaalsContact C-N 3.28Å; N142-C144 PolarHBondContact O-N 2.87Å
143	F	51	Low	63.9	Low	178 Å²	178	103.5 Å²	103.5	78%	0.781	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	8.6	175	-90.9	-80.3	0	0	0	115.1
144	C	51.5	Low	62.5	Low	53 Å²	53	100.2 Å²	100.2	36%	0.358	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	31.4	-177.3	-147.5	0	0	0	0	115.4	N142 C154	N142-C144 VanDerWaalsContact C-N 3.28Å; N142-C144 PolarHBondContact O-N 2.87Å; C144-C154 VanDerWaalsContact CA-SG 3.54Å; C144-C154 HydrophobicContact CB-CB 4.04Å; C144-C154 WeakPolarHBondContact CB-SG 3.31Å; C144-C154 WeakPolarHBondContact SG-CB 3.34Å; C144-C154 CovalentContact SG-SG 2Å; C144-C154 PolarHBondContact SG-SG 3.36Å
145	F	49.2	Very low	61	Low	183 Å²	183	101.2 Å²	101.2	80%	0.803	54%	0.536	S	S	*	.			trans	-119.1	6.3	-170.1	-112.7	-83.8	0	0	0	117.6
146	S	51.6	Low	59.6	Low	111 Å²	111	107.4 Å²	107.4	78%	0.776	56%	0.557	S	S	*	*	S	Bend	trans	-120.4	-1.8	-167	-165.6	0	0	0	0	118.8
147	S	48.9	Very low	58	Low	72 Å²	72	113.3 Å²	113.3	50%	0.503	58%	0.58	S	S	.	*			trans	-158.7	129.5	171.6	-62.1	0	0	0	0	111.6	F149 R150	S147-F149 PolarHBondContact O-N 2.02Å; S147-R150 PolarHBondContact O-N 3.49Å
148	I	59.4	Low	56.4	Low	142 Å²	142	114.6 Å²	114.6	73%	0.728	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-10.8	-179.6	-118.9	161.8	0	0	0	113.8	F151	I148-F151 HydrophobicContact CB-CE2 4.49Å; I148-F151 HydrophobicContact CG1-CE2 3.85Å; I148-F151 WeakPolarHBondContact O-CD2 3.31Å
149	F	56.6	Low	55.2	Low	190 Å²	190	118.9 Å²	118.9	83%	0.833	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-3.2	174.6	-76.7	-86	0	0	0	115.3	S147	S147-F149 PolarHBondContact O-N 2.02Å
150	R	54.7	Low	53.7	Low	142 Å²	142	119.3 Å²	119.3	54%	0.536	61%	0.61	S	S	.	*			trans	-101.9	0.2	-176.8	-85.3	-173.7	175.5	-165.8	2.3	115.5	S147 I152 Q153 C154	S147-R150 PolarHBondContact O-N 3.49Å; R150-I152 VanDerWaalsContact C-N 3.29Å; R150-I152 PolarHBondContact O-N 2.93Å; R150-Q153 PolarHBondContact O-N 2.79Å; R150-Q153 VanDerWaalsContact O-N 3.08Å; R150-C154 PolarHBondContact O-N 2.8Å; R150-C154 VanDerWaalsContact O-N 3.08Å
151	F	53.8	Low	52.8	Low	134 Å²	134	113.3 Å²	113.3	59%	0.588	58%	0.58	S	S	*	*	H	α-helix	trans	-58	-40.2	-179.2	-76.6	-72.1	0	0	0	112.9	I148 A155	I148-F151 HydrophobicContact CB-CE2 4.49Å; I148-F151 HydrophobicContact CG1-CE2 3.85Å; I148-F151 WeakPolarHBondContact O-CD2 3.31Å; F151-A155 PolarHBondContact O-N 3.13Å
152	I	57.9	Low	52.1	Low	127 Å²	127	115.6 Å²	115.6	65%	0.651	59%	0.587	S	S	*	*	H	α-helix	trans	-65.4	-43.9	176.4	-58.2	176.8	0	0	0	110.2	R150 C154 A155 Y156	R150-I152 VanDerWaalsContact C-N 3.29Å; R150-I152 PolarHBondContact O-N 2.93Å; I152-C154 VanDerWaalsContact C-N 3.35Å; I152-C154 PolarHBondContact O-N 3.21Å; I152-A155 PolarHBondContact O-N 3.13Å; I152-Y156 HydrophobicContact CG2-CD2 3.84Å; I152-Y156 HydrophobicContact CG2-CE2 3.84Å; I152-Y156 WeakPolarHBondContact O-CD2 3.38Å; I152-Y156 PolarHBondContact O-N 2.82Å
153	Q	55.2	Low	52	Low	117 Å²	117	116.5 Å²	116.5	55%	0.547	59%	0.585	S	S	.	*	H	α-helix	trans	-65.4	-33.3	-178.4	-75	-171.4	-23.7	0	0	113.7	R150 K157	R150-Q153 PolarHBondContact O-N 2.79Å; R150-Q153 VanDerWaalsContact O-N 3.08Å; Q153-K157 WeakPolarHBondContact O-CB 3.07Å; Q153-K157 PolarHBondContact O-N 3.1Å; Q153-K157 VanDerWaalsContact O-N 3.11Å
154	C	55.9	Low	51.8	Low	27 Å²	27	114.2 Å²	114.2	18%	0.182	57%	0.572	C	S	.	*	H	α-helix	trans	-71.7	-41.8	175.7	-80.2	0	0	0	0	113.2	C144 R150 I152 Y156 K157 C158	C144-C154 VanDerWaalsContact CA-SG 3.54Å; C144-C154 HydrophobicContact CB-CB 4.04Å; C144-C154 WeakPolarHBondContact CB-SG 3.31Å; C144-C154 WeakPolarHBondContact SG-CB 3.34Å; C144-C154 CovalentContact SG-SG 2Å; C144-C154 PolarHBondContact SG-SG 3.36Å; R150-C154 PolarHBondContact O-N 2.8Å; R150-C154 VanDerWaalsContact O-N 3.08Å; I152-C154 VanDerWaalsContact C-N 3.35Å; I152-C154 PolarHBondContact O-N 3.21Å; C154-Y156 VanDerWaalsContact C-N 3.31Å; C154-Y156 PolarHBondContact O-N 3.22Å; C154-K157 PolarHBondContact O-N 3.12Å; C154-K157 VanDerWaalsContact O-N 3.14Å; C154-C158 WeakPolarHBondContact O-CB 3.33Å; C154-C158 PolarHBondContact O-N 2.04Å
155	A	53.9	Low	51.4	Low	49 Å²	49	117.4 Å²	117.4	41%	0.405	59%	0.586	S	S	.	*	H	α-helix	trans	-60.2	-44.3	178.1	0	0	0	0	0	110.7	F151 I152 K157 C158 I159	F151-A155 PolarHBondContact O-N 3.13Å; I152-A155 PolarHBondContact O-N 3.13Å; A155-K157 PolarHBondContact O-N 2.88Å; A155-C158 PolarHBondContact O-N 2.88Å; A155-I159 WeakPolarHBondContact O-CB 3.41Å; A155-I159 WeakPolarHBondContact O-CD1 3.25Å; A155-I159 WeakPolarHBondContact O-CG1 3.35Å; A155-I159 PolarHBondContact O-N 3.36Å
156	Y	56.6	Low	51.3	Low	159 Å²	159	114 Å²	114	62%	0.624	58%	0.576	S	S	*	*	H	α-helix	trans	-64.1	-35.2	174.5	-86.4	-86.7	0	0	0	113.3	I152 C154 N160	I152-Y156 HydrophobicContact CG2-CD2 3.84Å; I152-Y156 HydrophobicContact CG2-CE2 3.84Å; I152-Y156 WeakPolarHBondContact O-CD2 3.38Å; I152-Y156 PolarHBondContact O-N 2.82Å; C154-Y156 VanDerWaalsContact C-N 3.31Å; C154-Y156 PolarHBondContact O-N 3.22Å; Y156-N160 WeakPolarHBondContact O-CB 2.98Å; Y156-N160 PolarHBondContact O-N 3.13Å; Y156-N160 PolarHBondContact O-ND2 3.15Å
157	K	52.9	Low	51.3	Low	154 Å²	154	110.2 Å²	110.2	67%	0.67	55%	0.551	S	S	*	*	H	α-helix	trans	-73.5	-36.1	176	-84.9	-179	175.2	-178.3	0	113.1	Q153 C154 A155 F161	Q153-K157 WeakPolarHBondContact O-CB 3.07Å; Q153-K157 PolarHBondContact O-N 3.1Å; Q153-K157 VanDerWaalsContact O-N 3.11Å; C154-K157 PolarHBondContact O-N 3.12Å; C154-K157 VanDerWaalsContact O-N 3.14Å; A155-K157 PolarHBondContact O-N 2.88Å; K157-F161 WeakPolarHBondContact O-CB 3.41Å; K157-F161 PolarHBondContact O-N 3.3Å
158	C	51.4	Low	51.6	Low	89 Å²	89	113.1 Å²	113.1	60%	0.601	56%	0.557	S	S	*	*	H	α-helix	trans	-72.2	-41.7	176.9	-75.4	0	0	0	0	112.7	C154 A155 N160 F161 S162	C154-C158 WeakPolarHBondContact O-CB 3.33Å; C154-C158 PolarHBondContact O-N 2.04Å; A155-C158 PolarHBondContact O-N 2.88Å; C158-N160 PolarHBondContact O-N 3.44Å; C158-F161 WeakPolarHBondContact O-CB 3.44Å; C158-F161 PolarHBondContact O-N 2.78Å; C158-S162 PolarHBondContact O-N 3.21Å
159	I	51.7	Low	51.5	Low	118 Å²	118	110.7 Å²	110.7	61%	0.605	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-36.7	175.9	-68	164.7	0	0	0	110.5	A155	A155-I159 WeakPolarHBondContact O-CB 3.41Å; A155-I159 WeakPolarHBondContact O-CD1 3.25Å; A155-I159 WeakPolarHBondContact O-CG1 3.35Å; A155-I159 PolarHBondContact O-N 3.36Å
160	N	44.7	Very low	51.5	Low	66 Å²	66	106.1 Å²	106.1	35%	0.353	53%	0.526	S	S	.	.	H	α-helix	trans	-71	-37.7	172.5	-84.9	-49.8	0	0	0	112.2	Y156 C158 S162 K163 Y164	Y156-N160 WeakPolarHBondContact O-CB 2.98Å; Y156-N160 PolarHBondContact O-N 3.13Å; Y156-N160 PolarHBondContact O-ND2 3.15Å; C158-N160 PolarHBondContact O-N 3.44Å; N160-S162 VanDerWaalsContact C-N 3.27Å; N160-S162 PolarHBondContact O-N 2.96Å; N160-K163 CarbonylContact O-C 3.57Å; N160-K163 WeakPolarHBondContact O-CA 3.05Å; N160-K163 PolarHBondContact O-N 3.29Å; N160-Y164 HydrophobicContact CB-CD2 3.79Å; N160-Y164 HydrophobicContact CB-CE2 3.68Å; N160-Y164 WeakPolarHBondContact O-CD2 3.42Å; N160-Y164 PolarHBondContact O-N 2.93Å
161	F	47.2	Very low	51.5	Low	80 Å²	80	104 Å²	104	35%	0.351	53%	0.53	S	S	.	.	H	α-helix	trans	-56.2	-37.3	-178.3	-133.4	-94.4	0	0	0	113.9	P123 C124 C138 K157 C158 K163 Y164	P123-F161 HydrophobicContact CG-CD2 4.47Å; P123-F161 HydrophobicContact CG-CE2 3.77Å; P123-F161 HydrophobicContact CG-CZ 4.01Å; C124-F161 HydrophobicContact CB-CZ 4.4Å; C138-F161 HydrophobicContact CB-CE1 3.67Å; C138-F161 HydrophobicContact CB-CZ 3.69Å; C138-F161 WeakPolarHBondContact SG-CZ 3.41Å; K157-F161 WeakPolarHBondContact O-CB 3.41Å; K157-F161 PolarHBondContact O-N 3.3Å; C158-F161 WeakPolarHBondContact O-CB 3.44Å; C158-F161 PolarHBondContact O-N 2.78Å; F161-K163 VanDerWaalsContact C-N 3.25Å; F161-K163 PolarHBondContact O-N 3.22Å; F161-Y164 PolarHBondContact O-N 3.18Å
162	S	43.1	Very low	51.8	Low	105 Å²	105	103.6 Å²	103.6	73%	0.734	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-20.5	175.5	-169.4	0	0	0	0	113.5	C158 N160	C158-S162 PolarHBondContact O-N 3.21Å; N160-S162 VanDerWaalsContact C-N 3.27Å; N160-S162 PolarHBondContact O-N 2.96Å
163	K	44.2	Very low	51.9	Low	151 Å²	151	102.1 Å²	102.1	66%	0.657	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-16.5	177.6	-78.7	-173.4	175.1	-177.8	0	113.6	N160 F161 N166	N160-K163 CarbonylContact O-C 3.57Å; N160-K163 WeakPolarHBondContact O-CA 3.05Å; N160-K163 PolarHBondContact O-N 3.29Å; F161-K163 VanDerWaalsContact C-N 3.25Å; F161-K163 PolarHBondContact O-N 3.22Å; K163-N166 PolarHBondContact O-ND2 2.95Å; K163-N166 VanDerWaalsContact O-ND2 3.15Å
164	Y	46.4	Very low	52.2	Low	129 Å²	129	98.4 Å²	98.4	51%	0.506	51%	0.512	S	S	.	.			trans	-93.4	5.5	-174.1	-82.8	-73.3	0	0	0	115.5	N160 F161 N166	N160-Y164 HydrophobicContact CB-CD2 3.79Å; N160-Y164 HydrophobicContact CB-CE2 3.68Å; N160-Y164 WeakPolarHBondContact O-CD2 3.42Å; N160-Y164 PolarHBondContact O-N 2.93Å; F161-Y164 PolarHBondContact O-N 3.18Å; Y164-N166 PolarHBondContact O-N 2.88Å
165	N	44.8	Very low	52.1	Low	121 Å²	121	104.5 Å²	104.5	65%	0.647	54%	0.54	S	S	*	.			trans	-73	39.5	161.5	-81.8	-30.1	0	0	0	112.1	A167	N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.49Å
166	N	46	Very low	52	Low	111 Å²	111	106.4 Å²	106.4	59%	0.594	54%	0.543	S	S	*	.			trans	-80	86.2	175.1	-79.1	-28.9	0	0	0	108.6	K163 Y164 Q168	K163-N166 PolarHBondContact O-ND2 2.95Å; K163-N166 VanDerWaalsContact O-ND2 3.15Å; Y164-N166 PolarHBondContact O-N 2.88Å; N166-Q168 PolarHBondContact O-N 2.87Å; N166-Q168 VanDerWaalsContact O-N 3.1Å
167	A	51.4	Low	51.3	Low	31 Å²	31	112.4 Å²	112.4	26%	0.256	57%	0.572	S	S	.	*			trans	-51.6	109.9	161.4	0	0	0	0	0	109.5	I118 Q119 N165	I118-A167 HydrophobicContact CB-CB 4.35Å; I118-A167 HydrophobicContact CG1-CB 4.33Å; I118-A167 HydrophobicContact CG2-CB 3.41Å; I118-A167 VanDerWaalsContact CG2-CB 3.41Å; Q119-A167 WeakPolarHBondContact O-CA 3.13Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.49Å
168	Q	56.2	Low	51.2	Low	134 Å²	134	110.4 Å²	110.4	63%	0.626	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.9	138.2	168.8	-70	-170.8	-50.3	0	0	108.9	Q119 N166	Q119-Q168 PolarHBondContact N-O 3.08Å; Q119-Q168 PolarHBondContact O-N 3.35Å; Q119-Q168 VanDerWaalsContact O-N 3.12Å; N166-Q168 PolarHBondContact O-N 2.87Å; N166-Q168 VanDerWaalsContact O-N 3.1Å
169	Q	56.9	Low	51.2	Low	91 Å²	91	111.5 Å²	111.5	43%	0.425	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.9	125.5	-177	-65.2	179.1	-67.7	0	0	109.1	A116 P171	A116-Q169 HydrophobicContact CB-CB 3.94Å; A116-Q169 HydrophobicContact CB-CG 4.34Å; Q169-P171 WeakPolarHBondContact O-CD 3.31Å
170	I	57.2	Low	51.2	Low	94 Å²	94	111.1 Å²	111.1	48%	0.482	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	100.9	165.5	-57.3	173.4	0	0	0	106.5	A116 R117 Q119 Q172	A116-I170 VanDerWaalsContact CA-O 3.28Å; A116-I170 WeakPolarHBondContact CA-O 3.39Å; R117-I170 PolarHBondContact N-O 2.72Å; R117-I170 PolarHBondContact O-N 3.1Å; Q119-I170 HydrophobicContact CG-CD1 4.05Å; Q119-I170 HydrophobicContact CG-CG1 4.45Å; I170-Q172 PolarHBondContact O-N 2.99Å
171	P	54.9	Low	51.6	Low	97 Å²	97	113.8 Å²	113.8	63%	0.63	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69	125.8	178.2	27.1	-31.1	0	0	0	109.6	Q169	Q169-P171 WeakPolarHBondContact O-CD 3.31Å
172	Q	60	Low	51.8	Low	125 Å²	125	115.9 Å²	115.9	58%	0.584	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.8	120.5	164.3	-67	-170.1	-50	0	0	108	S115 I170 I174	S115-Q172 PolarHBondContact N-O 3.02Å; S115-Q172 WeakPolarHBondContact O-CA 3.1Å; S115-Q172 PolarHBondContact O-N 3.18Å; I170-Q172 PolarHBondContact O-N 2.99Å; Q172-I174 PolarHBondContact O-N 2.98Å
173	P	59.6	Low	52.4	Low	96 Å²	96	116.6 Å²	116.6	62%	0.623	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.4	127.5	173.2	27.4	-30.8	0	0	0	108.7
174	I	61.5	Low	53	Low	40 Å²	40	114.1 Å²	114.1	21%	0.205	58%	0.575	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	108.2	163.1	-44.7	173	0	0	0	105.4	V113 Q172 L176	V113-I174 PolarHBondContact O-N 3.37Å; Q172-I174 PolarHBondContact O-N 2.98Å; I174-L176 HydrophobicContact CB-CG 4.45Å; I174-L176 HydrophobicContact CG2-CD1 4.4Å; I174-L176 HydrophobicContact CG2-CD2 3.75Å; I174-L176 HydrophobicContact CG2-CG 3.76Å; I174-L176 PolarHBondContact O-N 2.82Å; I174-L176 VanDerWaalsContact O-N 3.1Å
175	M	54.4	Low	53.5	Low	155 Å²	155	113 Å²	113	76%	0.764	58%	0.58	S	S	*	*			trans	-77.3	97.6	170.9	-63.3	-69.4	-80.1	0	0	107.1	V112	V112-M175 HydrophobicContact CG1-SD 4.21Å
176	L	51.6	Low	54.2	Low	88 Å²	88	112.3 Å²	112.3	46%	0.461	57%	0.574	S	S	.	*			trans	-92.7	121.4	169.9	-64.2	172	0	0	0	107.5	Y85 V113 I174	Y85-L176 HydrophobicContact CD2-CD1 3.58Å; Y85-L176 HydrophobicContact CE2-CD1 3.94Å; V113-L176 HydrophobicContact CB-CD1 4.42Å; I174-L176 HydrophobicContact CB-CG 4.45Å; I174-L176 HydrophobicContact CG2-CD1 4.4Å; I174-L176 HydrophobicContact CG2-CD2 3.75Å; I174-L176 HydrophobicContact CG2-CG 3.76Å; I174-L176 PolarHBondContact O-N 2.82Å; I174-L176 VanDerWaalsContact O-N 3.1Å
177	K	41	Very low	55	Low	286 Å²	286	112.5 Å²	112.5	100%	1.243	57%	0.573	S	S	*	*			trans	-70.6	0	174.6	-81.1	-176.4	175.3	-179.2	0	110.8

Retrieved 177 of 177 residues in 120.3 ms (Link to these results)

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