G4LY33_SCHMA Loading...

Tar DNA-binding protein, putative

AlphaFold DB , UniProt , Accession G4LY33, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 417 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	74.2	Confident	240 Å²	240	96.5 Å²	96.5	100%	1.182	46%	0.457	S	S	*	.				0	100	0	-76.5	175.8	173.9	0	0	106.7	L3	M1-L3 PolarHBondContact O-N 3.05Å
2	Q	49.4	Very low	74.4	Confident	145 Å²	145	91.1 Å²	91.1	68%	0.678	44%	0.435	S	S	*	.			trans	-63.3	119.3	169.3	-83.6	159.3	-43.2	0	0	106.9	T4 D24	Q2-T4 PolarHBondContact O-N 3.34Å; Q2-T4 VanDerWaalsContact O-N 3.09Å; Q2-D24 VanDerWaalsContact NE2-CG 3.26Å; Q2-D24 PolarHBondContact NE2-OD1 2.68Å; Q2-D24 PolarHBondContact NE2-OD2 3.32Å
3	L	56.6	Low	74.2	Confident	163 Å²	163	93.5 Å²	93.5	85%	0.853	45%	0.445	S	S	*	.			trans	-70.3	100.7	170.7	-82.6	148.2	0	0	0	106.3	M1 R5	M1-L3 PolarHBondContact O-N 3.05Å; L3-R5 PolarHBondContact O-N 3.33Å; L3-R5 VanDerWaalsContact O-N 3.1Å
4	T	62.7	Low	74.1	Confident	83 Å²	83	97.5 Å²	97.5	51%	0.509	47%	0.471	S	S	.	.			trans	-60	115.8	170.9	41.2	0	0	0	0	107.8	Q2 Y6	Q2-T4 PolarHBondContact O-N 3.34Å; Q2-T4 VanDerWaalsContact O-N 3.09Å; T4-Y6 WeakPolarHBondContact O-CD2 3.08Å; T4-Y6 VanDerWaalsContact O-CE2 3.3Å; T4-Y6 WeakPolarHBondContact O-CE2 3.45Å; T4-Y6 WeakPolarHBondContact OG1-CE2 3.16Å; T4-Y6 PolarHBondContact OG1-OH 3.09Å
5	R	80.9	Confident	74.3	Confident	119 Å²	119	96.1 Å²	96.1	45%	0.449	47%	0.467	S	S	.	.			trans	-86.1	143	174.9	-64.8	175.4	177.5	-177.4	4.3	107.8	L3 L22 D26	L3-R5 PolarHBondContact O-N 3.33Å; L3-R5 VanDerWaalsContact O-N 3.1Å; R5-L22 HydrophobicContact CB-CB 4.29Å; R5-L22 HydrophobicContact CB-CD1 3.8Å; R5-L22 HydrophobicContact CB-CG 4.48Å; R5-L22 WeakPolarHBondContact O-CB 3.47Å; R5-L22 PolarHBondContact O-N 2.76Å; R5-D26 WeakPolarHBondContact CD-OD1 3.2Å; R5-D26 IonicContact CZ-OD1 3.56Å; R5-D26 IonicContact CZ-OD2 3.95Å; R5-D26 IonicContact NE-OD1 3.76Å; R5-D26 IonicContact NH1-OD1 2.68Å; R5-D26 PolarHBondContact NH1-OD1 3.49Å; R5-D26 IonicContact NH1-OD2 2.76Å; R5-D26 PolarHBondContact NH1-OD2 3.36Å
6	Y	84.5	Confident	74.7	Confident	102 Å²	102	100.3 Å²	100.3	40%	0.4	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	147.2	-178.9	-65.4	-92.7	0	0	0	110.2	T4 E19 V20 P21	T4-Y6 WeakPolarHBondContact O-CD2 3.08Å; T4-Y6 VanDerWaalsContact O-CE2 3.3Å; T4-Y6 WeakPolarHBondContact O-CE2 3.45Å; T4-Y6 WeakPolarHBondContact OG1-CE2 3.16Å; T4-Y6 PolarHBondContact OG1-OH 3.09Å; Y6-E19 HydrophobicContact CD1-CB 4.18Å; Y6-E19 HydrophobicContact CG-CB 4.4Å; Y6-V20 WeakPolarHBondContact CA-O 3.42Å; Y6-P21 HydrophobicContact CD1-CB 4.25Å; Y6-P21 HydrophobicContact CE1-CB 4Å
7	V	88.1	Confident	75.3	Confident	1 Å²	1	97 Å²	97	1%	0.006	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.5	173.1	54.2	0	0	0	0	110	I9 E19 V20 L22 L28 W71 F76	V7-I9 HydrophobicContact CG1-CD1 3.79Å; V7-I9 HydrophobicContact CG1-CG1 3.99Å; V7-I9 HydrophobicContact CG2-CG1 4.02Å; V7-E19 WeakPolarHBondContact O-CA 3.2Å; V7-V20 HydrophobicContact CG1-CB 4.2Å; V7-V20 WeakPolarHBondContact CG1-O 3.33Å; V7-V20 PolarHBondContact N-O 3.4Å; V7-V20 PolarHBondContact O-N 2.61Å; V7-L22 HydrophobicContact CB-CD2 4.23Å; V7-L22 HydrophobicContact CG1-CD2 3.78Å; V7-L22 HydrophobicContact CG1-CG 4.31Å; V7-L28 HydrophobicContact CG1-CD1 4.33Å; V7-L28 HydrophobicContact CG1-CD2 4.26Å; V7-W71 HydrophobicContact CB-CB 4.14Å; V7-W71 HydrophobicContact CB-CD2 4.2Å; V7-W71 HydrophobicContact CB-CE3 3.96Å; V7-W71 HydrophobicContact CB-CG 4.34Å; V7-W71 HydrophobicContact CG2-CB 4.22Å; V7-W71 HydrophobicContact CG2-CD2 4.06Å; V7-W71 HydrophobicContact CG2-CE3 3.35Å; V7-W71 HydrophobicContact CG2-CG 4.47Å; V7-W71 HydrophobicContact CG2-CZ3 3.96Å; V7-F76 HydrophobicContact CG2-CD2 3.44Å; V7-F76 VanDerWaalsContact CG2-CD2 3.44Å; V7-F76 HydrophobicContact CG2-CE2 3.74Å; V7-F76 HydrophobicContact CG2-CG 4.26Å
8	K	88.3	Confident	75.9	Confident	103 Å²	103	95.6 Å²	95.6	45%	0.448	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	115.5	176.7	-67.9	-178	-178.2	-176.9	0	110.7	P17 E19 F76	K8-P17 HydrophobicContact CB-CB 4.15Å; K8-E19 VanDerWaalsContact CE-OE1 3.23Å; K8-E19 WeakPolarHBondContact CE-OE1 3.37Å; K8-E19 HydrophobicContact CG-CG 4.02Å; K8-F76 PolarHBondContact O-N 3.32Å
9	I	89.4	Confident	76.6	Confident	0 Å²	0	96.4 Å²	96.4	0%	0	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133.8	-176.3	-52.4	-175.6	0	0	0	110.2	V7 P17 I18 V20 L28 L33 F37 L43 F76	V7-I9 HydrophobicContact CG1-CD1 3.79Å; V7-I9 HydrophobicContact CG1-CG1 3.99Å; V7-I9 HydrophobicContact CG2-CG1 4.02Å; I9-P17 CarbonylContact O-C 3.54Å; I9-P17 WeakPolarHBondContact O-CA 3.47Å; I9-I18 PolarHBondContact N-O 2.94Å; I9-I18 PolarHBondContact O-N 3.5Å; I9-V20 HydrophobicContact CB-CG2 4.35Å; I9-V20 HydrophobicContact CD1-CB 3.93Å; I9-V20 HydrophobicContact CD1-CG2 3.79Å; I9-V20 HydrophobicContact CG1-CG2 4.21Å; I9-L28 HydrophobicContact CD1-CD2 3.55Å; I9-L33 HydrophobicContact CD1-CD1 3.69Å; I9-L33 HydrophobicContact CG2-CD1 4.05Å; I9-F37 HydrophobicContact CB-CE2 4.05Å; I9-F37 HydrophobicContact CB-CZ 4.48Å; I9-F37 HydrophobicContact CG2-CD2 4.23Å; I9-F37 HydrophobicContact CG2-CE2 3.56Å; I9-F37 HydrophobicContact CG2-CZ 4.06Å; I9-L43 HydrophobicContact CD1-CD1 3.89Å; I9-L43 HydrophobicContact CD1-CD2 4.32Å; I9-L43 HydrophobicContact CG1-CD1 4.5Å; I9-L43 HydrophobicContact CG2-CD2 3.68Å; I9-F76 CarbonylContact C-O 3.55Å; I9-F76 VanDerWaalsContact CA-O 3.29Å; I9-F76 WeakPolarHBondContact CA-O 3.34Å; I9-F76 HydrophobicContact CG1-CB 4.47Å
10	C	87.2	Confident	77.2	Confident	4 Å²	4	91.7 Å²	91.7	3%	0.027	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.7	175.8	58.1	0	0	0	0	110.8	T12 T75 F76 C77 C78	C10-T12 WeakPolarHBondContact CB-O 3.48Å; C10-T75 HydrophobicContact CB-CG2 4.43Å; C10-F76 PolarHBondContact N-O 2.74Å; C10-F76 PolarHBondContact SG-O 3.14Å; C10-C77 CarbonylContact O-C 3.54Å; C10-C77 VanDerWaalsContact O-CA 3.3Å; C10-C77 WeakPolarHBondContact O-CA 3.29Å; C10-C77 PolarHBondContact SG-SG 2.91Å; C10-C78 PolarHBondContact O-N 2.77Å
11	E	85.4	Confident	77.7	Confident	101 Å²	101	90 Å²	90	47%	0.472	44%	0.443	S	S	.	.	S	Bend	trans	-71.4	-50.8	174.9	-172.3	178.7	162.2	0	0	110.5	F37 F80	E11-F37 HydrophobicContact CB-CD1 4.03Å; E11-F37 HydrophobicContact CB-CE1 3.87Å; E11-F37 HydrophobicContact CG-CD1 4.42Å; E11-F80 HydrophobicContact CG-CE2 3.81Å; E11-F80 HydrophobicContact CG-CZ 3.82Å
12	T	76.7	Confident	79.9	Confident	32 Å²	32	79.1 Å²	79.1	20%	0.196	39%	0.39	C	S	.	.	S	Bend	trans	-128.4	163.6	173.2	72.2	0	0	0	0	110.5	C10 D14 D15	C10-T12 WeakPolarHBondContact CB-O 3.48Å; T12-D14 PolarHBondContact O-N 2.98Å; T12-D14 VanDerWaalsContact O-N 3.12Å; T12-D15 PolarHBondContact N-OD2 3.44Å; T12-D15 PolarHBondContact O-N 3.35Å; T12-D15 VanDerWaalsContact O-N 3.11Å; T12-D15 PolarHBondContact OG1-OD2 3.47Å
13	E	71.7	Confident	81.7	Confident	122 Å²	122	75.8 Å²	75.8	57%	0.57	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.9	-175.5	-62.8	-170.5	124.2	0	0	113.9	Y53	E13-Y53 PolarHBondContact OE1-OH 2.48Å; E13-Y53 PolarHBondContact OE2-OH 3.45Å
14	D	72.7	Confident	83	Confident	150 Å²	150	74.2 Å²	74.2	80%	0.802	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.4	-178.6	-54.7	-55.3	0	0	0	112.7	T12	T12-D14 PolarHBondContact O-N 2.98Å; T12-D14 VanDerWaalsContact O-N 3.12Å
15	D	77.5	Confident	84	Confident	76 Å²	76	74.3 Å²	74.3	41%	0.406	36%	0.364	S	S	.	.	S	Bend	trans	-88.2	149.2	-177.4	-73.5	-54.7	0	0	0	112.5	T12	T12-D15 PolarHBondContact N-OD2 3.44Å; T12-D15 PolarHBondContact O-N 3.35Å; T12-D15 VanDerWaalsContact O-N 3.11Å; T12-D15 PolarHBondContact OG1-OD2 3.47Å
16	Q	81	Confident	84.1	Confident	164 Å²	164	71.1 Å²	71.1	77%	0.766	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-62.2	125.4	174	-175.4	65.1	31.9	0	0	109.7
17	P	85.1	Confident	84.3	Confident	44 Å²	44	66.4 Å²	66.4	29%	0.286	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.3	139.4	179.3	26.1	-34.7	0	0	0	111.2	K8 I9 T75	K8-P17 HydrophobicContact CB-CB 4.15Å; I9-P17 CarbonylContact O-C 3.54Å; I9-P17 WeakPolarHBondContact O-CA 3.47Å; P17-T75 HydrophobicContact CB-CG2 4.31Å
18	I	86.4	Confident	84.3	Confident	71 Å²	71	66.3 Å²	66.3	36%	0.364	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	137.1	172.2	-62	177	0	0	0	108.3	I9 V20 F37	I9-I18 PolarHBondContact N-O 2.94Å; I9-I18 PolarHBondContact O-N 3.5Å; I18-V20 HydrophobicContact CG2-CG2 4.21Å; I18-F37 HydrophobicContact CB-CZ 4.36Å; I18-F37 HydrophobicContact CD1-CE1 4.33Å; I18-F37 HydrophobicContact CD1-CZ 3.96Å; I18-F37 HydrophobicContact CG1-CZ 4.45Å
19	E	88.7	Confident	84.4	Confident	112 Å²	112	63 Å²	63	52%	0.523	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	115.2	173.8	-74.9	-174.2	164.6	0	0	110	Y6 V7 K8	Y6-E19 HydrophobicContact CD1-CB 4.18Å; Y6-E19 HydrophobicContact CG-CB 4.4Å; V7-E19 WeakPolarHBondContact O-CA 3.2Å; K8-E19 VanDerWaalsContact CE-OE1 3.23Å; K8-E19 WeakPolarHBondContact CE-OE1 3.37Å; K8-E19 HydrophobicContact CG-CG 4.02Å
20	V	88.5	Confident	84.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.4	-178.6	-173.3	0	0	0	0	109.1	Y6 V7 I9 I18 L28 T32 Q36	Y6-V20 WeakPolarHBondContact CA-O 3.42Å; V7-V20 HydrophobicContact CG1-CB 4.2Å; V7-V20 WeakPolarHBondContact CG1-O 3.33Å; V7-V20 PolarHBondContact N-O 3.4Å; V7-V20 PolarHBondContact O-N 2.61Å; I9-V20 HydrophobicContact CB-CG2 4.35Å; I9-V20 HydrophobicContact CD1-CB 3.93Å; I9-V20 HydrophobicContact CD1-CG2 3.79Å; I9-V20 HydrophobicContact CG1-CG2 4.21Å; I18-V20 HydrophobicContact CG2-CG2 4.21Å; V20-L28 HydrophobicContact CB-CD1 4.29Å; V20-L28 HydrophobicContact CG1-CD1 3.56Å; V20-T32 HydrophobicContact CG1-CG2 3.53Å; V20-Q36 HydrophobicContact CG2-CG 4.4Å
21	P	88.4	Confident	84.5	Confident	56 Å²	56	67.4 Å²	67.4	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	144.4	-178.4	28.3	-35.1	0	0	0	111.6	Y6 L28 T32	Y6-P21 HydrophobicContact CD1-CB 4.25Å; Y6-P21 HydrophobicContact CE1-CB 4Å; P21-L28 WeakPolarHBondContact O-CD1 3.26Å; P21-T32 HydrophobicContact CG-CG2 4.19Å
22	L	88.6	Confident	84.7	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.068	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-96.1	154.3	172.4	-61.7	171.1	0	0	0	110.5	R5 V7 L28 W71	R5-L22 HydrophobicContact CB-CB 4.29Å; R5-L22 HydrophobicContact CB-CD1 3.8Å; R5-L22 HydrophobicContact CB-CG 4.48Å; R5-L22 WeakPolarHBondContact O-CB 3.47Å; R5-L22 PolarHBondContact O-N 2.76Å; V7-L22 HydrophobicContact CB-CD2 4.23Å; V7-L22 HydrophobicContact CG1-CD2 3.78Å; V7-L22 HydrophobicContact CG1-CG 4.31Å; L22-L28 HydrophobicContact CD2-CB 3.77Å; L22-L28 HydrophobicContact CD2-CD1 4.32Å; L22-W71 HydrophobicContact CD1-CB 4.13Å; L22-W71 HydrophobicContact CD1-CD2 4.37Å; L22-W71 HydrophobicContact CD1-CG 3.68Å; L22-W71 HydrophobicContact CD2-CD2 4.12Å; L22-W71 HydrophobicContact CD2-CG 4.29Å; L22-W71 HydrophobicContact CD2-CZ2 4.1Å
23	E	88.2	Confident	85.3	Confident	74 Å²	74	62.6 Å²	62.6	35%	0.346	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-73	167.1	171.2	-64.5	-65.9	118.2	0	0	111.2	D25 D26 T27 L29	E23-D25 WeakPolarHBondContact CB-OD1 3.2Å; E23-D25 PolarHBondContact O-N 2.9Å; E23-D25 VanDerWaalsContact O-N 3.09Å; E23-D26 PolarHBondContact O-N 2.93Å; E23-D26 VanDerWaalsContact O-N 3.08Å; E23-T27 WeakPolarHBondContact CB-O 3.47Å; E23-T27 PolarHBondContact N-O 3.08Å; E23-L29 VanDerWaalsContact CD-CD1 3.47Å; E23-L29 HydrophobicContact CG-CD1 3.94Å; E23-L29 HydrophobicContact CG-CD2 4.48Å; E23-L29 HydrophobicContact CG-CG 3.73Å; E23-L29 VanDerWaalsContact OE1-CD1 3.31Å; E23-L29 WeakPolarHBondContact OE1-CD1 3.29Å
24	D	82.8	Confident	86.1	Confident	131 Å²	131	59.4 Å²	59.4	70%	0.701	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.3	179.6	-73.8	-44.4	0	0	0	113.8	Q2	Q2-D24 VanDerWaalsContact NE2-CG 3.26Å; Q2-D24 PolarHBondContact NE2-OD1 2.68Å; Q2-D24 PolarHBondContact NE2-OD2 3.32Å
25	D	82.9	Confident	86.8	Confident	84 Å²	84	56 Å²	56	45%	0.449	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.7	179.4	66.2	-6	0	0	0	113.7	E23 T27 R62	E23-D25 WeakPolarHBondContact CB-OD1 3.2Å; E23-D25 PolarHBondContact O-N 2.9Å; E23-D25 VanDerWaalsContact O-N 3.09Å; D25-T27 PolarHBondContact O-N 2.99Å; D25-T27 VanDerWaalsContact OD1-CB 3.29Å; D25-T27 WeakPolarHBondContact OD1-CB 3.45Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.34Å; D25-T27 PolarHBondContact OD1-N 3.22Å; D25-T27 PolarHBondContact OD1-OG1 2.9Å; D25-T27 PolarHBondContact OD2-OG1 2.77Å; D25-T27 VanDerWaalsContact OD2-OG1 3.13Å; D25-R62 IonicContact OD1-NH1 3.66Å; D25-R62 IonicContact OD2-NH1 3.43Å; D25-R62 PolarHBondContact OD2-NH1 2.74Å
26	D	84.2	Confident	87.2	Confident	53 Å²	53	57.4 Å²	57.4	28%	0.283	32%	0.316	S	S	.	.	S	Bend	trans	61.3	14.9	-172.8	-72.7	-47.3	0	0	0	114.1	R5 E23 W71	R5-D26 WeakPolarHBondContact CD-OD1 3.2Å; R5-D26 IonicContact CZ-OD1 3.56Å; R5-D26 IonicContact CZ-OD2 3.95Å; R5-D26 IonicContact NE-OD1 3.76Å; R5-D26 IonicContact NH1-OD1 2.68Å; R5-D26 PolarHBondContact NH1-OD1 3.49Å; R5-D26 IonicContact NH1-OD2 2.76Å; R5-D26 PolarHBondContact NH1-OD2 3.36Å; E23-D26 PolarHBondContact O-N 2.93Å; E23-D26 VanDerWaalsContact O-N 3.08Å; D26-W71 PolarHBondContact O-NE1 3.45Å
27	T	88.3	Confident	87.5	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.012	28%	0.282	C	S	.	.			trans	-91	155.8	172.8	71	0	0	0	0	111.5	E23 D25 R62 L63 F64	E23-T27 WeakPolarHBondContact CB-O 3.47Å; E23-T27 PolarHBondContact N-O 3.08Å; D25-T27 PolarHBondContact O-N 2.99Å; D25-T27 VanDerWaalsContact OD1-CB 3.29Å; D25-T27 WeakPolarHBondContact OD1-CB 3.45Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.34Å; D25-T27 PolarHBondContact OD1-N 3.22Å; D25-T27 PolarHBondContact OD1-OG1 2.9Å; D25-T27 PolarHBondContact OD2-OG1 2.77Å; D25-T27 VanDerWaalsContact OD2-OG1 3.13Å; T27-R62 PolarHBondContact OG1-NH1 2.9Å; T27-L63 WeakPolarHBondContact CA-O 3.38Å; T27-F64 HydrophobicContact CG2-CD1 3.91Å; T27-F64 HydrophobicContact CG2-CE1 3.85Å; T27-F64 HydrophobicContact CG2-CG 4.38Å; T27-F64 HydrophobicContact CG2-CZ 4.24Å
28	L	89	Confident	87.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124	170.4	175.1	71.8	0	0	0	109	V7 I9 V20 P21 L22 L33 L43 L63 W71	V7-L28 HydrophobicContact CG1-CD1 4.33Å; V7-L28 HydrophobicContact CG1-CD2 4.26Å; I9-L28 HydrophobicContact CD1-CD2 3.55Å; V20-L28 HydrophobicContact CB-CD1 4.29Å; V20-L28 HydrophobicContact CG1-CD1 3.56Å; P21-L28 WeakPolarHBondContact O-CD1 3.26Å; L22-L28 HydrophobicContact CD2-CB 3.77Å; L22-L28 HydrophobicContact CD2-CD1 4.32Å; L28-L33 HydrophobicContact CD2-CB 4.37Å; L28-L33 HydrophobicContact CD2-CD1 4.34Å; L28-L43 HydrophobicContact CD2-CD1 3.65Å; L28-L63 HydrophobicContact CB-CB 4.1Å; L28-L63 HydrophobicContact CD2-CD1 3.95Å; L28-L63 HydrophobicContact CG-CD1 4.39Å; L28-L63 PolarHBondContact N-O 3.29Å; L28-L63 WeakPolarHBondContact O-CB 3.27Å; L28-L63 PolarHBondContact O-N 3.12Å; L28-W71 HydrophobicContact CB-CH2 4.13Å; L28-W71 HydrophobicContact CB-CZ2 4.15Å
29	L	90.7	Very high	87	Confident	33 Å²	33	54.4 Å²	54.4	17%	0.173	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	135.8	174.5	-67.3	170.2	0	0	0	111.3	E23 S31 T32 L33 R62	E23-L29 VanDerWaalsContact CD-CD1 3.47Å; E23-L29 HydrophobicContact CG-CD1 3.94Å; E23-L29 HydrophobicContact CG-CD2 4.48Å; E23-L29 HydrophobicContact CG-CG 3.73Å; E23-L29 VanDerWaalsContact OE1-CD1 3.31Å; E23-L29 WeakPolarHBondContact OE1-CD1 3.29Å; L29-S31 WeakPolarHBondContact CB-OG 3.34Å; L29-S31 PolarHBondContact O-N 3.08Å; L29-T32 WeakPolarHBondContact O-CB 3.25Å; L29-T32 PolarHBondContact O-N 3.3Å; L29-T32 VanDerWaalsContact O-N 3.14Å; L29-L33 PolarHBondContact O-N 3.22Å; L29-R62 HydrophobicContact CD2-CG 3.77Å
30	L	88.9	Confident	86.9	Confident	26 Å²	26	49.2 Å²	49.2	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-31.6	172.2	-175.8	63.2	0	0	0	110.9	L33 T34 L58 D61	L30-L33 HydrophobicContact CD1-CD2 4.1Å; L30-L33 PolarHBondContact O-N 3.05Å; L30-T34 HydrophobicContact CD1-CG2 4.08Å; L30-T34 HydrophobicContact CG-CG2 4.13Å; L30-T34 WeakPolarHBondContact O-CB 3.48Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.49Å; L30-T34 PolarHBondContact O-N 3.03Å; L30-T34 PolarHBondContact O-OG1 3.39Å; L30-L58 HydrophobicContact CB-CD1 4.26Å; L30-L58 HydrophobicContact CD2-CD1 4.26Å; L30-L58 HydrophobicContact CD2-CD2 4.29Å; L30-D61 HydrophobicContact CB-CB 4.13Å; L30-D61 WeakPolarHBondContact CB-O 3.3Å; L30-D61 PolarHBondContact N-O 3.13Å
31	S	88.2	Confident	86.6	Confident	70 Å²	70	52.3 Å²	52.3	49%	0.49	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-43.8	172.4	55.8	0	0	0	0	112	L29 L33 T34 A35	L29-S31 WeakPolarHBondContact CB-OG 3.34Å; L29-S31 PolarHBondContact O-N 3.08Å; S31-L33 VanDerWaalsContact C-N 3.34Å; S31-T34 WeakPolarHBondContact CA-OG1 3.31Å; S31-T34 PolarHBondContact O-N 2.87Å; S31-T34 PolarHBondContact O-OG1 3.44Å; S31-T34 VanDerWaalsContact O-OG1 3.14Å; S31-A35 VanDerWaalsContact O-CB 3.29Å; S31-A35 WeakPolarHBondContact O-CB 3.45Å; S31-A35 PolarHBondContact O-N 2.57Å
32	T	89.6	Confident	86.6	Confident	33 Å²	33	50 Å²	50	20%	0.202	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-39.5	175.1	-52	0	0	0	0	111.1	V20 P21 L29	V20-T32 HydrophobicContact CG1-CG2 3.53Å; P21-T32 HydrophobicContact CG-CG2 4.19Å; L29-T32 WeakPolarHBondContact O-CB 3.25Å; L29-T32 PolarHBondContact O-N 3.3Å; L29-T32 VanDerWaalsContact O-N 3.14Å
33	L	89.5	Confident	86.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-47	175.9	-177.5	65	0	0	0	112.1	I9 L28 L29 L30 S31 A35 Q36 F37 C40 L43 L63	I9-L33 HydrophobicContact CD1-CD1 3.69Å; I9-L33 HydrophobicContact CG2-CD1 4.05Å; L28-L33 HydrophobicContact CD2-CB 4.37Å; L28-L33 HydrophobicContact CD2-CD1 4.34Å; L29-L33 PolarHBondContact O-N 3.22Å; L30-L33 HydrophobicContact CD1-CD2 4.1Å; L30-L33 PolarHBondContact O-N 3.05Å; S31-L33 VanDerWaalsContact C-N 3.34Å; L33-A35 VanDerWaalsContact C-N 3.3Å; L33-A35 PolarHBondContact O-N 3.09Å; L33-Q36 PolarHBondContact O-N 2.95Å; L33-F37 HydrophobicContact CD1-CD2 3.8Å; L33-F37 HydrophobicContact CD1-CE2 4.35Å; L33-F37 PolarHBondContact O-N 2.89Å; L33-C40 HydrophobicContact CD2-CB 4.33Å; L33-C40 VanDerWaalsContact CD2-SG 3.53Å; L33-C40 HydrophobicContact CG-CB 4.22Å; L33-L43 HydrophobicContact CD1-CD2 3.91Å; L33-L43 HydrophobicContact CD1-CG 4.46Å; L33-L43 HydrophobicContact CD2-CD1 4.37Å; L33-L43 HydrophobicContact CD2-CD2 3.96Å; L33-L43 HydrophobicContact CD2-CG 3.87Å; L33-L63 HydrophobicContact CD2-CD1 3.56Å
34	T	88.3	Confident	86.7	Confident	54 Å²	54	49 Å²	49	33%	0.331	28%	0.284	S	S	.	.	H	α-helix	trans	-71.9	-23.6	-179.3	51.4	0	0	0	0	113.1	L30 S31 Q36 F37 C40	L30-T34 HydrophobicContact CD1-CG2 4.08Å; L30-T34 HydrophobicContact CG-CG2 4.13Å; L30-T34 WeakPolarHBondContact O-CB 3.48Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.49Å; L30-T34 PolarHBondContact O-N 3.03Å; L30-T34 PolarHBondContact O-OG1 3.39Å; S31-T34 WeakPolarHBondContact CA-OG1 3.31Å; S31-T34 PolarHBondContact O-N 2.87Å; S31-T34 PolarHBondContact O-OG1 3.44Å; S31-T34 VanDerWaalsContact O-OG1 3.14Å; T34-Q36 VanDerWaalsContact C-N 3.3Å; T34-F37 WeakPolarHBondContact CA-O 3.38Å; T34-F37 CarbonylContact O-C 3.42Å; T34-C40 WeakPolarHBondContact CG2-O 3.43Å
35	A	88.1	Confident	86.9	Confident	78 Å²	78	43 Å²	43	65%	0.645	25%	0.252	S	S	*	.	H	α-helix	trans	-64.7	-33.5	170.7	0	0	0	0	0	112.5	S31 L33	S31-A35 VanDerWaalsContact O-CB 3.29Å; S31-A35 WeakPolarHBondContact O-CB 3.45Å; S31-A35 PolarHBondContact O-N 2.57Å; L33-A35 VanDerWaalsContact C-N 3.3Å; L33-A35 PolarHBondContact O-N 3.09Å
36	Q	86.8	Confident	86.9	Confident	107 Å²	107	46.5 Å²	46.5	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-90.7	-38.2	175.5	-60.7	-59.2	-25.8	0	0	112.2	V20 L33 T34	V20-Q36 HydrophobicContact CG2-CG 4.4Å; L33-Q36 PolarHBondContact O-N 2.95Å; T34-Q36 VanDerWaalsContact C-N 3.3Å
37	F	86.6	Confident	86.6	Confident	11 Å²	11	44.1 Å²	44.1	5%	0.048	25%	0.246	C	C	.	.	S	Bend	trans	-124.1	88.2	-176.5	-57.1	-78.7	0	0	0	110.3	I9 E11 I18 L33 T34 D39 C40 C78	I9-F37 HydrophobicContact CB-CE2 4.05Å; I9-F37 HydrophobicContact CB-CZ 4.48Å; I9-F37 HydrophobicContact CG2-CD2 4.23Å; I9-F37 HydrophobicContact CG2-CE2 3.56Å; I9-F37 HydrophobicContact CG2-CZ 4.06Å; E11-F37 HydrophobicContact CB-CD1 4.03Å; E11-F37 HydrophobicContact CB-CE1 3.87Å; E11-F37 HydrophobicContact CG-CD1 4.42Å; I18-F37 HydrophobicContact CB-CZ 4.36Å; I18-F37 HydrophobicContact CD1-CE1 4.33Å; I18-F37 HydrophobicContact CD1-CZ 3.96Å; I18-F37 HydrophobicContact CG1-CZ 4.45Å; L33-F37 HydrophobicContact CD1-CD2 3.8Å; L33-F37 HydrophobicContact CD1-CE2 4.35Å; L33-F37 PolarHBondContact O-N 2.89Å; T34-F37 WeakPolarHBondContact CA-O 3.38Å; T34-F37 CarbonylContact O-C 3.42Å; F37-D39 PolarHBondContact O-N 2.93Å; F37-C40 HydrophobicContact CB-CB 3.8Å; F37-C40 VanDerWaalsContact O-CB 3.27Å; F37-C40 WeakPolarHBondContact O-CB 3.48Å; F37-C40 PolarHBondContact O-N 2.94Å; F37-C40 VanDerWaalsContact O-N 3.14Å; F37-C78 VanDerWaalsContact CD2-SG 3.58Å; F37-C78 WeakPolarHBondContact CG-SG 3.43Å
38	P	79.6	Confident	86	Confident	97 Å²	97	47.8 Å²	47.8	63%	0.63	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	138.8	176	24.2	-32.2	0	0	0	109.6	C40	P38-C40 VanDerWaalsContact C-N 3.34Å; P38-C40 PolarHBondContact O-N 2.77Å
39	D	82	Confident	85.2	Confident	107 Å²	107	54.2 Å²	54.2	57%	0.572	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	0.9	-174.4	-57.7	-21.8	0	0	0	117.1	F37 T41 F80 P81	F37-D39 PolarHBondContact O-N 2.93Å; D39-T41 PolarHBondContact O-N 2.82Å; D39-F80 HydrophobicContact CB-CD1 4.03Å; D39-F80 HydrophobicContact CB-CE1 4.37Å; D39-F80 WeakPolarHBondContact O-CD1 3.49Å; D39-P81 VanDerWaalsContact O-CD 3.26Å; D39-P81 WeakPolarHBondContact O-CD 3.36Å
40	C	84.7	Confident	84.5	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.02	33%	0.33	C	S	.	.			trans	-69	124.7	176.2	-169.5	0	0	0	0	111.5	L33 T34 F37 P38 G42 C78 F80	L33-C40 HydrophobicContact CD2-CB 4.33Å; L33-C40 VanDerWaalsContact CD2-SG 3.53Å; L33-C40 HydrophobicContact CG-CB 4.22Å; T34-C40 WeakPolarHBondContact CG2-O 3.43Å; F37-C40 HydrophobicContact CB-CB 3.8Å; F37-C40 VanDerWaalsContact O-CB 3.27Å; F37-C40 WeakPolarHBondContact O-CB 3.48Å; F37-C40 PolarHBondContact O-N 2.94Å; F37-C40 VanDerWaalsContact O-N 3.14Å; P38-C40 VanDerWaalsContact C-N 3.34Å; P38-C40 PolarHBondContact O-N 2.77Å; C40-G42 PolarHBondContact SG-O 2.85Å; C40-C78 HydrophobicContact CB-CB 4.41Å; C40-C78 VanDerWaalsContact SG-CB 3.5Å; C40-C78 VanDerWaalsContact SG-SG 3.62Å; C40-F80 HydrophobicContact CB-CE1 4.08Å
41	T	84.1	Confident	84	Confident	66 Å²	66	55.6 Å²	55.6	41%	0.405	34%	0.337	S	S	.	.			trans	-105.3	-2.9	-179.3	52.5	0	0	0	0	113.7	D39 V79 P81	D39-T41 PolarHBondContact O-N 2.82Å; T41-V79 PolarHBondContact N-O 3.46Å; T41-V79 PolarHBondContact OG1-O 3.14Å; T41-P81 HydrophobicContact CG2-CB 4.07Å; T41-P81 HydrophobicContact CG2-CG 3.75Å
42	G	88	Confident	83.5	Confident	7 Å²	7	56 Å²	56	7%	0.072	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-176.1	179.3	0	0	0	0	0	112.2	C40 V79	C40-G42 PolarHBondContact SG-O 2.85Å; G42-V79 PolarHBondContact N-O 3.44Å; G42-V79 WeakPolarHBondContact O-CB 3.38Å; G42-V79 PolarHBondContact O-N 2.84Å
43	L	90	Very high	83.2	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.5	179.6	-66.4	175.5	0	0	0	110.5	I9 L28 L33 V56 L63 W71 F76 C77	I9-L43 HydrophobicContact CD1-CD1 3.89Å; I9-L43 HydrophobicContact CD1-CD2 4.32Å; I9-L43 HydrophobicContact CG1-CD1 4.5Å; I9-L43 HydrophobicContact CG2-CD2 3.68Å; L28-L43 HydrophobicContact CD2-CD1 3.65Å; L33-L43 HydrophobicContact CD1-CD2 3.91Å; L33-L43 HydrophobicContact CD1-CG 4.46Å; L33-L43 HydrophobicContact CD2-CD1 4.37Å; L33-L43 HydrophobicContact CD2-CD2 3.96Å; L33-L43 HydrophobicContact CD2-CG 3.87Å; L43-V56 HydrophobicContact CB-CB 3.85Å; L43-V56 HydrophobicContact CB-CG2 3.56Å; L43-V56 PolarHBondContact O-N 2.93Å; L43-L63 HydrophobicContact CD1-CD1 4Å; L43-L63 HydrophobicContact CG-CD1 4.15Å; L43-W71 HydrophobicContact CD1-CZ3 4.26Å; L43-F76 HydrophobicContact CB-CB 4.39Å; L43-F76 HydrophobicContact CB-CD1 4.41Å; L43-F76 HydrophobicContact CD1-CB 4.27Å; L43-F76 HydrophobicContact CD2-CB 4.31Å; L43-C77 WeakPolarHBondContact CA-O 3.23Å
44	K	88.6	Confident	82.8	Confident	64 Å²	64	62.8 Å²	62.8	28%	0.278	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151	167.9	63.3	175.5	-178.8	163.2	0	109	Y53 R54 F76 C77 V79	K44-Y53 HydrophobicContact CD-CD1 3.85Å; K44-Y53 HydrophobicContact CD-CE1 4.32Å; K44-Y53 HydrophobicContact CD-CG 4.04Å; K44-Y53 HydrophobicContact CG-CD1 4.16Å; K44-R54 CarbonylContact C-O 3.49Å; K44-R54 VanDerWaalsContact CA-O 3.25Å; K44-R54 WeakPolarHBondContact CA-O 3.37Å; K44-F76 CarbonylContact O-C 3.5Å; K44-F76 WeakPolarHBondContact O-CA 3.45Å; K44-C77 HydrophobicContact CG-CB 3.97Å; K44-C77 PolarHBondContact N-O 2.9Å; K44-C77 PolarHBondContact O-N 2.84Å; K44-V79 HydrophobicContact CB-CG2 3.8Å; K44-V79 HydrophobicContact CD-CG2 4.1Å; K44-V79 HydrophobicContact CG-CG2 3.74Å
45	Y	87.7	Confident	82.7	Confident	7 Å²	7	63.2 Å²	63.2	3%	0.027	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	157.2	174.2	68.3	-78.6	0	0	0	109.6	Y53 R54 V56 P66 D68 N74 F76	Y45-Y53 CarbonylContact O-C 3.54Å; Y45-Y53 VanDerWaalsContact O-CA 3.26Å; Y45-Y53 WeakPolarHBondContact O-CA 3.47Å; Y45-R54 HydrophobicContact CD1-CB 4.08Å; Y45-R54 WeakPolarHBondContact CD1-O 3.3Å; Y45-R54 HydrophobicContact CE1-CB 3.45Å; Y45-R54 VanDerWaalsContact CE1-CB 3.45Å; Y45-R54 HydrophobicContact CE2-CB 4.06Å; Y45-R54 VanDerWaalsContact CZ-CB 3.43Å; Y45-R54 PolarHBondContact N-O 2.74Å; Y45-R54 PolarHBondContact O-N 2.91Å; Y45-R54 WeakPolarHBondContact OH-CD 3.37Å; Y45-V56 HydrophobicContact CD1-CG2 4.03Å; Y45-V56 HydrophobicContact CE1-CG2 4.49Å; Y45-P66 HydrophobicContact CD1-CG 4.19Å; Y45-P66 HydrophobicContact CE1-CB 3.9Å; Y45-P66 HydrophobicContact CE1-CG 3.66Å; Y45-P66 WeakPolarHBondContact OH-CB 3.43Å; Y45-D68 PolarHBondContact OH-OD2 3.19Å; Y45-N74 HydrophobicContact CD2-CB 4.46Å; Y45-F76 HydrophobicContact CD1-CD1 4.01Å; Y45-F76 AromaticContact CD1-CE1 3.6Å; Y45-F76 HydrophobicContact CD1-CE1 3.6Å; Y45-F76 HydrophobicContact CE1-CE1 4.39Å; Y45-F76 HydrophobicContact CG-CD1 4.12Å; Y45-F76 AromaticContact CG-CE1 3.78Å; Y45-F76 HydrophobicContact CG-CE1 3.78Å; Y45-F76 HydrophobicContact CG-CZ 4.46Å
46	R	82.7	Confident	82.7	Confident	157 Å²	157	60.2 Å²	60.2	59%	0.592	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.1	177.2	-163.4	168.9	-173.9	-112.3	-1.1	109.5	G51	R46-G51 PolarHBondContact NE-O 3.47Å; R46-G51 PolarHBondContact NH2-O 3.1Å
47	S	77.9	Confident	82.8	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.021	36%	0.358	C	S	.	.			trans	-73	132.4	175.9	161.4	0	0	0	0	110.6	D49 S50 G51 C52 R54	S47-D49 VanDerWaalsContact C-N 3.33Å; S47-D49 PolarHBondContact O-N 3.26Å; S47-D49 PolarHBondContact OG-N 2.78Å; S47-S50 WeakPolarHBondContact CB-OG 3.29Å; S47-S50 PolarHBondContact OG-N 2.98Å; S47-S50 PolarHBondContact OG-OG 2.87Å; S47-G51 WeakPolarHBondContact O-CA 3.35Å; S47-G51 PolarHBondContact O-N 3.28Å; S47-C52 PolarHBondContact N-O 3.15Å; S47-R54 PolarHBondContact OG-NE 3.09Å; S47-R54 PolarHBondContact OG-NH2 2.94Å; S47-R54 VanDerWaalsContact OG-NH2 3.09Å
48	G	74.3	Confident	82.9	Confident	79 Å²	79	66.4 Å²	66.4	81%	0.814	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-38.6	174.1	0	0	0	0	0	113.1
49	D	73.6	Confident	83.3	Confident	135 Å²	135	65.4 Å²	65.4	72%	0.722	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-40.7	-175.7	-43.8	-53.5	0	0	0	112.9	S47 R54	S47-D49 VanDerWaalsContact C-N 3.33Å; S47-D49 PolarHBondContact O-N 3.26Å; S47-D49 PolarHBondContact OG-N 2.78Å; D49-R54 IonicContact OD2-NH1 3.74Å; D49-R54 IonicContact OD2-NH2 3.4Å; D49-R54 PolarHBondContact OD2-NH2 2.91Å
50	S	74.8	Confident	83.4	Confident	60 Å²	60	66.9 Å²	66.9	42%	0.42	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-13.9	-168.7	60.2	0	0	0	0	113.9	S47 C52	S47-S50 WeakPolarHBondContact CB-OG 3.29Å; S47-S50 PolarHBondContact OG-N 2.98Å; S47-S50 PolarHBondContact OG-OG 2.87Å; S50-C52 PolarHBondContact O-N 3.14Å; S50-C52 PolarHBondContact O-SG 3.35Å
51	G	78	Confident	83.5	Confident	27 Å²	27	71.9 Å²	71.9	28%	0.278	40%	0.398	S	S	.	.	S	Bend	trans	62.8	-0.2	-172.5	0	0	0	0	0	114.8	R46 S47	R46-G51 PolarHBondContact NE-O 3.47Å; R46-G51 PolarHBondContact NH2-O 3.1Å; S47-G51 WeakPolarHBondContact O-CA 3.35Å; S47-G51 PolarHBondContact O-N 3.28Å
52	C	78.2	Confident	83.7	Confident	78 Å²	78	72.8 Å²	72.8	53%	0.527	39%	0.394	S	S	.	.	S	Bend	trans	-88.6	158	179	-65.5	0	0	0	0	110.7	S47 S50	S47-C52 PolarHBondContact N-O 3.15Å; S50-C52 PolarHBondContact O-N 3.14Å; S50-C52 PolarHBondContact O-SG 3.35Å
53	Y	83.2	Confident	83.7	Confident	102 Å²	102	72.5 Å²	72.5	40%	0.4	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.8	170.2	-64.1	-78.2	0	0	0	110.7	E13 K44 Y45	E13-Y53 PolarHBondContact OE1-OH 2.48Å; E13-Y53 PolarHBondContact OE2-OH 3.45Å; K44-Y53 HydrophobicContact CD-CD1 3.85Å; K44-Y53 HydrophobicContact CD-CE1 4.32Å; K44-Y53 HydrophobicContact CD-CG 4.04Å; K44-Y53 HydrophobicContact CG-CD1 4.16Å; Y45-Y53 CarbonylContact O-C 3.54Å; Y45-Y53 VanDerWaalsContact O-CA 3.26Å; Y45-Y53 WeakPolarHBondContact O-CA 3.47Å
54	R	82.7	Confident	83.6	Confident	74 Å²	74	75.9 Å²	75.9	28%	0.279	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.5	166.3	-70.1	-176	-179.6	163	2.9	108.3	K44 Y45 S47 D49 D68	K44-R54 CarbonylContact C-O 3.49Å; K44-R54 VanDerWaalsContact CA-O 3.25Å; K44-R54 WeakPolarHBondContact CA-O 3.37Å; Y45-R54 HydrophobicContact CD1-CB 4.08Å; Y45-R54 WeakPolarHBondContact CD1-O 3.3Å; Y45-R54 HydrophobicContact CE1-CB 3.45Å; Y45-R54 VanDerWaalsContact CE1-CB 3.45Å; Y45-R54 HydrophobicContact CE2-CB 4.06Å; Y45-R54 VanDerWaalsContact CZ-CB 3.43Å; Y45-R54 PolarHBondContact N-O 2.74Å; Y45-R54 PolarHBondContact O-N 2.91Å; Y45-R54 WeakPolarHBondContact OH-CD 3.37Å; S47-R54 PolarHBondContact OG-NE 3.09Å; S47-R54 PolarHBondContact OG-NH2 2.94Å; S47-R54 VanDerWaalsContact OG-NH2 3.09Å; D49-R54 IonicContact OD2-NH1 3.74Å; D49-R54 IonicContact OD2-NH2 3.4Å; D49-R54 PolarHBondContact OD2-NH2 2.91Å; R54-D68 IonicContact CZ-OD2 3.86Å; R54-D68 IonicContact NH1-OD1 3.5Å; R54-D68 PolarHBondContact NH1-OD1 3.22Å; R54-D68 IonicContact NH1-OD2 2.61Å; R54-D68 PolarHBondContact NH1-OD2 2.8Å
55	G	85.7	Confident	83.4	Confident	63 Å²	63	75.3 Å²	75.3	65%	0.649	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	147.2	172	0	0	0	0	0	110.8
56	V	88.4	Confident	83	Confident	16 Å²	16	75.6 Å²	75.6	10%	0.097	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-85.6	135.9	170	-177.6	0	0	0	0	108.4	L43 Y45 L58 L63 F64 W71 F76	L43-V56 HydrophobicContact CB-CB 3.85Å; L43-V56 HydrophobicContact CB-CG2 3.56Å; L43-V56 PolarHBondContact O-N 2.93Å; Y45-V56 HydrophobicContact CD1-CG2 4.03Å; Y45-V56 HydrophobicContact CE1-CG2 4.49Å; V56-L58 PolarHBondContact O-N 3.1Å; V56-L63 HydrophobicContact CB-CD2 4.05Å; V56-L63 HydrophobicContact CG1-CB 4.03Å; V56-L63 HydrophobicContact CG1-CD2 3.73Å; V56-F64 WeakPolarHBondContact CG1-O 3.38Å; V56-W71 HydrophobicContact CG1-CH2 3.97Å; V56-W71 HydrophobicContact CG1-CZ3 4.38Å; V56-F76 HydrophobicContact CG2-CD1 3.5Å; V56-F76 VanDerWaalsContact CG2-CD1 3.5Å; V56-F76 HydrophobicContact CG2-CE1 3.59Å
57	R	88.4	Confident	82.3	Confident	176 Å²	176	74.8 Å²	74.8	66%	0.664	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	121.7	-179.6	-179.5	176.9	-174.8	168.9	0.4	109.5	L63 F64	R57-L63 WeakPolarHBondContact O-CA 3.4Å; R57-F64 HydrophobicContact CB-CB 4.4Å; R57-F64 PolarHBondContact O-N 2.81Å
58	L	88.4	Confident	81.7	Confident	72 Å²	72	79 Å²	79	38%	0.377	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.7	170.1	179	70.2	0	0	0	109	L30 V56 R62 L63	L30-L58 HydrophobicContact CB-CD1 4.26Å; L30-L58 HydrophobicContact CD2-CD1 4.26Å; L30-L58 HydrophobicContact CD2-CD2 4.29Å; V56-L58 PolarHBondContact O-N 3.1Å; L58-R62 WeakPolarHBondContact CA-O 3.4Å; L58-L63 HydrophobicContact CB-CD2 3.96Å; L58-L63 HydrophobicContact CD1-CD2 4.04Å; L58-L63 HydrophobicContact CD1-CG 3.84Å
59	L	88.2	Confident	80.9	Confident	76 Å²	76	77.4 Å²	77.4	40%	0.398	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	129.4	174.1	177.7	71.3	0	0	0	108.5	D61 R62 F64	L59-D61 VanDerWaalsContact C-N 3.34Å; L59-D61 PolarHBondContact O-N 3.43Å; L59-R62 PolarHBondContact N-O 2.76Å; L59-R62 WeakPolarHBondContact O-CA 3.32Å; L59-R62 WeakPolarHBondContact O-CB 3.26Å; L59-R62 PolarHBondContact O-N 2.83Å; L59-R62 VanDerWaalsContact O-O 3.09Å; L59-F64 HydrophobicContact CB-CD2 4.33Å; L59-F64 HydrophobicContact CB-CE2 3.84Å; L59-F64 HydrophobicContact CD2-CE2 4.35Å
60	D	85	Confident	80.7	Confident	138 Å²	138	77 Å²	77	74%	0.738	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	51.4	178.4	-58.3	-36.6	0	0	0	113.6	R62	D60-R62 PolarHBondContact O-N 2.79Å; D60-R62 VanDerWaalsContact O-N 3.08Å
61	D	85.9	Confident	80.7	Confident	108 Å²	108	74.4 Å²	74.4	58%	0.578	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	18.6	-177.2	-60.7	-37.8	0	0	0	115.1	L30 L59	L30-D61 HydrophobicContact CB-CB 4.13Å; L30-D61 WeakPolarHBondContact CB-O 3.3Å; L30-D61 PolarHBondContact N-O 3.13Å; L59-D61 VanDerWaalsContact C-N 3.34Å; L59-D61 PolarHBondContact O-N 3.43Å
62	R	88.5	Confident	80.3	Confident	85 Å²	85	77.9 Å²	77.9	32%	0.321	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.6	175.7	-70.6	173.1	-179.7	-93	-7.6	111.1	D25 T27 L29 L58 L59 D60 F64	D25-R62 IonicContact OD1-NH1 3.66Å; D25-R62 IonicContact OD2-NH1 3.43Å; D25-R62 PolarHBondContact OD2-NH1 2.74Å; T27-R62 PolarHBondContact OG1-NH1 2.9Å; L29-R62 HydrophobicContact CD2-CG 3.77Å; L58-R62 WeakPolarHBondContact CA-O 3.4Å; L59-R62 PolarHBondContact N-O 2.76Å; L59-R62 WeakPolarHBondContact O-CA 3.32Å; L59-R62 WeakPolarHBondContact O-CB 3.26Å; L59-R62 PolarHBondContact O-N 2.83Å; L59-R62 VanDerWaalsContact O-O 3.09Å; D60-R62 PolarHBondContact O-N 2.79Å; D60-R62 VanDerWaalsContact O-N 3.08Å; R62-F64 HydrophobicContact CB-CE2 3.98Å; R62-F64 HydrophobicContact CB-CZ 4.5Å; R62-F64 WeakPolarHBondContact O-CD2 3.27Å
63	L	88.7	Confident	80	Confident	0 Å²	0	78 Å²	78	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.6	173.9	-72.8	151.6	0	0	0	109	T27 L28 L33 L43 V56 R57 L58 W71	T27-L63 WeakPolarHBondContact CA-O 3.38Å; L28-L63 HydrophobicContact CB-CB 4.1Å; L28-L63 HydrophobicContact CD2-CD1 3.95Å; L28-L63 HydrophobicContact CG-CD1 4.39Å; L28-L63 PolarHBondContact N-O 3.29Å; L28-L63 WeakPolarHBondContact O-CB 3.27Å; L28-L63 PolarHBondContact O-N 3.12Å; L33-L63 HydrophobicContact CD2-CD1 3.56Å; L43-L63 HydrophobicContact CD1-CD1 4Å; L43-L63 HydrophobicContact CG-CD1 4.15Å; V56-L63 HydrophobicContact CB-CD2 4.05Å; V56-L63 HydrophobicContact CG1-CB 4.03Å; V56-L63 HydrophobicContact CG1-CD2 3.73Å; R57-L63 WeakPolarHBondContact O-CA 3.4Å; L58-L63 HydrophobicContact CB-CD2 3.96Å; L58-L63 HydrophobicContact CD1-CD2 4.04Å; L58-L63 HydrophobicContact CD1-CG 3.84Å; L63-W71 HydrophobicContact CB-CH2 4.22Å
64	F	87.6	Confident	79.7	Confident	74 Å²	74	75.7 Å²	75.7	33%	0.325	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	145.9	-176.9	-72.9	-98.4	0	0	0	111.1	T27 V56 R57 L59 R62	T27-F64 HydrophobicContact CG2-CD1 3.91Å; T27-F64 HydrophobicContact CG2-CE1 3.85Å; T27-F64 HydrophobicContact CG2-CG 4.38Å; T27-F64 HydrophobicContact CG2-CZ 4.24Å; V56-F64 WeakPolarHBondContact CG1-O 3.38Å; R57-F64 HydrophobicContact CB-CB 4.4Å; R57-F64 PolarHBondContact O-N 2.81Å; L59-F64 HydrophobicContact CB-CD2 4.33Å; L59-F64 HydrophobicContact CB-CE2 3.84Å; L59-F64 HydrophobicContact CD2-CE2 4.35Å; R62-F64 HydrophobicContact CB-CE2 3.98Å; R62-F64 HydrophobicContact CB-CZ 4.5Å; R62-F64 WeakPolarHBondContact O-CD2 3.27Å
65	P	83.9	Confident	79.7	Confident	51 Å²	51	75.3 Å²	75.3	33%	0.331	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-58.6	147.5	177.8	23	-32	0	0	0	111.3	W71	P65-W71 HydrophobicContact CB-CZ2 4.44Å
66	P	78.9	Confident	79.8	Confident	14 Å²	14	72.3 Å²	72.3	9%	0.091	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-57.4	150.8	173.1	-23.2	33.3	0	0	0	112.7	Y45 D68 G69 F76	Y45-P66 HydrophobicContact CD1-CG 4.19Å; Y45-P66 HydrophobicContact CE1-CB 3.9Å; Y45-P66 HydrophobicContact CE1-CG 3.66Å; Y45-P66 WeakPolarHBondContact OH-CB 3.43Å; P66-D68 PolarHBondContact O-N 2.75Å; P66-G69 PolarHBondContact O-N 3.33Å; P66-F76 HydrophobicContact CG-CE1 3.81Å; P66-F76 HydrophobicContact CG-CZ 3.86Å
67	T	69	Low	79.7	Confident	140 Å²	140	72 Å²	72	86%	0.859	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.4	177.2	44.8	0	0	0	0	113.9	G69	T67-G69 PolarHBondContact O-N 3.28Å
68	D	64.3	Low	79.7	Confident	91 Å²	91	64 Å²	64	49%	0.487	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	2.9	177.2	-45.1	-41.1	0	0	0	112.7	Y45 R54 P66	Y45-D68 PolarHBondContact OH-OD2 3.19Å; R54-D68 IonicContact CZ-OD2 3.86Å; R54-D68 IonicContact NH1-OD1 3.5Å; R54-D68 PolarHBondContact NH1-OD1 3.22Å; R54-D68 IonicContact NH1-OD2 2.61Å; R54-D68 PolarHBondContact NH1-OD2 2.8Å; P66-D68 PolarHBondContact O-N 2.75Å
69	G	57.9	Low	79.6	Confident	45 Å²	45	63.1 Å²	63.1	46%	0.464	36%	0.364	S	S	.	.	S	Bend	trans	94.1	6.6	149	0	0	0	0	0	118.1	P66 T67	P66-G69 PolarHBondContact O-N 3.33Å; T67-G69 PolarHBondContact O-N 3.28Å
70	Q	68.8	Low	79.3	Confident	126 Å²	126	62.7 Å²	62.7	59%	0.589	36%	0.359	S	S	*	.			trans	-156	138.9	168.2	-84.9	114.6	65.7	0	0	112.2	H72	Q70-H72 HydrophobicContact CB-CB 4.09Å; Q70-H72 HydrophobicContact CG-CB 4.42Å; Q70-H72 PolarHBondContact O-N 2.78Å
71	W	76.2	Confident	78.9	Confident	7 Å²	7	59.9 Å²	59.9	3%	0.027	35%	0.348	C	S	.	.	S	Bend	trans	-61.7	-29.2	158.2	-65.9	106.4	0	0	0	111.9	V7 L22 D26 L28 L43 V56 L63 P65 F76	V7-W71 HydrophobicContact CB-CB 4.14Å; V7-W71 HydrophobicContact CB-CD2 4.2Å; V7-W71 HydrophobicContact CB-CE3 3.96Å; V7-W71 HydrophobicContact CB-CG 4.34Å; V7-W71 HydrophobicContact CG2-CB 4.22Å; V7-W71 HydrophobicContact CG2-CD2 4.06Å; V7-W71 HydrophobicContact CG2-CE3 3.35Å; V7-W71 HydrophobicContact CG2-CG 4.47Å; V7-W71 HydrophobicContact CG2-CZ3 3.96Å; L22-W71 HydrophobicContact CD1-CB 4.13Å; L22-W71 HydrophobicContact CD1-CD2 4.37Å; L22-W71 HydrophobicContact CD1-CG 3.68Å; L22-W71 HydrophobicContact CD2-CD2 4.12Å; L22-W71 HydrophobicContact CD2-CG 4.29Å; L22-W71 HydrophobicContact CD2-CZ2 4.1Å; D26-W71 PolarHBondContact O-NE1 3.45Å; L28-W71 HydrophobicContact CB-CH2 4.13Å; L28-W71 HydrophobicContact CB-CZ2 4.15Å; L43-W71 HydrophobicContact CD1-CZ3 4.26Å; V56-W71 HydrophobicContact CG1-CH2 3.97Å; V56-W71 HydrophobicContact CG1-CZ3 4.38Å; L63-W71 HydrophobicContact CB-CH2 4.22Å; P65-W71 HydrophobicContact CB-CZ2 4.44Å; W71-F76 HydrophobicContact CE3-CD1 4.48Å; W71-F76 HydrophobicContact CE3-CD2 4.13Å; W71-F76 AromaticContact CE3-CE1 3.96Å; W71-F76 HydrophobicContact CE3-CE1 3.96Å; W71-F76 AromaticContact CE3-CE2 3.59Å; W71-F76 HydrophobicContact CE3-CE2 3.59Å; W71-F76 AromaticContact CE3-CZ 3.49Å; W71-F76 HydrophobicContact CE3-CZ 3.49Å; W71-F76 VanDerWaalsContact CE3-CZ 3.49Å; W71-F76 HydrophobicContact CZ3-CD1 4.15Å; W71-F76 HydrophobicContact CZ3-CD2 4.44Å; W71-F76 AromaticContact CZ3-CE1 3.88Å; W71-F76 HydrophobicContact CZ3-CE1 3.88Å; W71-F76 HydrophobicContact CZ3-CE2 4.21Å; W71-F76 HydrophobicContact CZ3-CG 4.44Å; W71-F76 AromaticContact CZ3-CZ 3.91Å; W71-F76 HydrophobicContact CZ3-CZ 3.91Å
72	H	68.2	Low	77.8	Confident	100 Å²	100	64.3 Å²	64.3	46%	0.463	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	130.5	-179.2	-54.7	85.2	0	0	0	110.7	Q70	Q70-H72 HydrophobicContact CB-CB 4.09Å; Q70-H72 HydrophobicContact CG-CB 4.42Å; Q70-H72 PolarHBondContact O-N 2.78Å
73	G	72.3	Confident	75.9	Confident	81 Å²	81	66.5 Å²	66.5	84%	0.835	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.1	-20.3	176.9	0	0	0	0	0	114.8
74	N	76.4	Confident	73.7	Confident	52 Å²	52	71.1 Å²	71.1	28%	0.278	42%	0.421	S	S	.	.			trans	-109.2	141.4	177.8	-68.1	-19.4	0	0	0	111.2	Y45 F76	Y45-N74 HydrophobicContact CD2-CB 4.46Å; N74-F76 HydrophobicContact CB-CE2 3.87Å; N74-F76 HydrophobicContact CB-CZ 4.09Å
75	T	83.1	Confident	71.6	Confident	67 Å²	67	76.4 Å²	76.4	41%	0.411	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.4	166.4	-54.7	0	0	0	0	108.4	C10 P17	C10-T75 HydrophobicContact CB-CG2 4.43Å; P17-T75 HydrophobicContact CB-CG2 4.31Å
76	F	87.4	Confident	69.9	Low	0 Å²	0	84.5 Å²	84.5	0%	0	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.7	178.9	-63.5	-98	0	0	0	109.6	V7 K8 I9 C10 L43 K44 Y45 V56 P66 W71 N74	V7-F76 HydrophobicContact CG2-CD2 3.44Å; V7-F76 VanDerWaalsContact CG2-CD2 3.44Å; V7-F76 HydrophobicContact CG2-CE2 3.74Å; V7-F76 HydrophobicContact CG2-CG 4.26Å; K8-F76 PolarHBondContact O-N 3.32Å; I9-F76 CarbonylContact C-O 3.55Å; I9-F76 VanDerWaalsContact CA-O 3.29Å; I9-F76 WeakPolarHBondContact CA-O 3.34Å; I9-F76 HydrophobicContact CG1-CB 4.47Å; C10-F76 PolarHBondContact N-O 2.74Å; C10-F76 PolarHBondContact SG-O 3.14Å; L43-F76 HydrophobicContact CB-CB 4.39Å; L43-F76 HydrophobicContact CB-CD1 4.41Å; L43-F76 HydrophobicContact CD1-CB 4.27Å; L43-F76 HydrophobicContact CD2-CB 4.31Å; K44-F76 CarbonylContact O-C 3.5Å; K44-F76 WeakPolarHBondContact O-CA 3.45Å; Y45-F76 HydrophobicContact CD1-CD1 4.01Å; Y45-F76 AromaticContact CD1-CE1 3.6Å; Y45-F76 HydrophobicContact CD1-CE1 3.6Å; Y45-F76 HydrophobicContact CE1-CE1 4.39Å; Y45-F76 HydrophobicContact CG-CD1 4.12Å; Y45-F76 AromaticContact CG-CE1 3.78Å; Y45-F76 HydrophobicContact CG-CE1 3.78Å; Y45-F76 HydrophobicContact CG-CZ 4.46Å; V56-F76 HydrophobicContact CG2-CD1 3.5Å; V56-F76 VanDerWaalsContact CG2-CD1 3.5Å; V56-F76 HydrophobicContact CG2-CE1 3.59Å; P66-F76 HydrophobicContact CG-CE1 3.81Å; P66-F76 HydrophobicContact CG-CZ 3.86Å; W71-F76 HydrophobicContact CE3-CD1 4.48Å; W71-F76 HydrophobicContact CE3-CD2 4.13Å; W71-F76 AromaticContact CE3-CE1 3.96Å; W71-F76 HydrophobicContact CE3-CE1 3.96Å; W71-F76 AromaticContact CE3-CE2 3.59Å; W71-F76 HydrophobicContact CE3-CE2 3.59Å; W71-F76 AromaticContact CE3-CZ 3.49Å; W71-F76 HydrophobicContact CE3-CZ 3.49Å; W71-F76 VanDerWaalsContact CE3-CZ 3.49Å; W71-F76 HydrophobicContact CZ3-CD1 4.15Å; W71-F76 HydrophobicContact CZ3-CD2 4.44Å; W71-F76 AromaticContact CZ3-CE1 3.88Å; W71-F76 HydrophobicContact CZ3-CE1 3.88Å; W71-F76 HydrophobicContact CZ3-CE2 4.21Å; W71-F76 HydrophobicContact CZ3-CG 4.44Å; W71-F76 AromaticContact CZ3-CZ 3.91Å; W71-F76 HydrophobicContact CZ3-CZ 3.91Å; N74-F76 HydrophobicContact CB-CE2 3.87Å; N74-F76 HydrophobicContact CB-CZ 4.09Å
77	C	86.9	Confident	67.9	Low	10 Å²	10	93.5 Å²	93.5	7%	0.068	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.3	174.9	-52.4	0	0	0	0	110.2	C10 L43 K44	C10-C77 CarbonylContact O-C 3.54Å; C10-C77 VanDerWaalsContact O-CA 3.3Å; C10-C77 WeakPolarHBondContact O-CA 3.29Å; C10-C77 PolarHBondContact SG-SG 2.91Å; L43-C77 WeakPolarHBondContact CA-O 3.23Å; K44-C77 HydrophobicContact CG-CB 3.97Å; K44-C77 PolarHBondContact N-O 2.9Å; K44-C77 PolarHBondContact O-N 2.84Å
78	C	88	Confident	66.8	Low	7 Å²	7	91.5 Å²	91.5	5%	0.047	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	141.2	173.7	-68.6	0	0	0	0	112.2	C10 F37 C40 F80	C10-C78 PolarHBondContact O-N 2.77Å; F37-C78 VanDerWaalsContact CD2-SG 3.58Å; F37-C78 WeakPolarHBondContact CG-SG 3.43Å; C40-C78 HydrophobicContact CB-CB 4.41Å; C40-C78 VanDerWaalsContact SG-CB 3.5Å; C40-C78 VanDerWaalsContact SG-SG 3.62Å; C78-F80 HydrophobicContact CB-CD2 4.34Å; C78-F80 HydrophobicContact CB-CE2 3.53Å; C78-F80 HydrophobicContact CB-CZ 3.67Å
79	V	85.5	Confident	65.6	Low	54 Å²	54	93.9 Å²	93.9	33%	0.327	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110.5	174	-178.9	0	0	0	0	108.2	T41 G42 K44	T41-V79 PolarHBondContact N-O 3.46Å; T41-V79 PolarHBondContact OG1-O 3.14Å; G42-V79 PolarHBondContact N-O 3.44Å; G42-V79 WeakPolarHBondContact O-CB 3.38Å; G42-V79 PolarHBondContact O-N 2.84Å; K44-V79 HydrophobicContact CB-CG2 3.8Å; K44-V79 HydrophobicContact CD-CG2 4.1Å; K44-V79 HydrophobicContact CG-CG2 3.74Å
80	F	83.3	Confident	64.7	Low	67 Å²	67	99.8 Å²	99.8	29%	0.294	53%	0.531	S	S	.	.			trans	-92.6	142.7	174.9	-60.6	-80.7	0	0	0	110.4	E11 D39 C40 C78 K82	E11-F80 HydrophobicContact CG-CE2 3.81Å; E11-F80 HydrophobicContact CG-CZ 3.82Å; D39-F80 HydrophobicContact CB-CD1 4.03Å; D39-F80 HydrophobicContact CB-CE1 4.37Å; D39-F80 WeakPolarHBondContact O-CD1 3.49Å; C40-F80 HydrophobicContact CB-CE1 4.08Å; C78-F80 HydrophobicContact CB-CD2 4.34Å; C78-F80 HydrophobicContact CB-CE2 3.53Å; C78-F80 HydrophobicContact CB-CZ 3.67Å; F80-K82 PolarHBondContact O-N 2.83Å; F80-K82 VanDerWaalsContact O-N 3.1Å
81	P	75.4	Confident	63.3	Low	79 Å²	79	101.2 Å²	101.2	51%	0.513	54%	0.543	S	S	.	.			trans	-63.2	116.8	-179.1	24.1	-29.5	0	0	0	109.3	D39 T41 C83	D39-P81 VanDerWaalsContact O-CD 3.26Å; D39-P81 WeakPolarHBondContact O-CD 3.36Å; T41-P81 HydrophobicContact CG2-CB 4.07Å; T41-P81 HydrophobicContact CG2-CG 3.75Å; P81-C83 PolarHBondContact O-N 3.23Å
82	K	63.7	Low	61.6	Low	201 Å²	201	105.6 Å²	105.6	87%	0.874	58%	0.575	S	S	*	*			trans	-71.8	110.9	170.8	-68.6	-176.6	-179.9	178.5	0	107.7	F80 S84	F80-K82 PolarHBondContact O-N 2.83Å; F80-K82 VanDerWaalsContact O-N 3.1Å; K82-S84 VanDerWaalsContact C-N 3.3Å; K82-S84 PolarHBondContact O-N 3.46Å
83	C	47.5	Very low	60.7	Low	130 Å²	130	109.4 Å²	109.4	88%	0.878	60%	0.597	S	S	*	*			trans	-56.5	90.8	171.4	-88.3	0	0	0	0	110.8	P81 K85	P81-C83 PolarHBondContact O-N 3.23Å; C83-K85 PolarHBondContact O-N 2.86Å
84	S	42.3	Very low	59.3	Low	97 Å²	97	111.8 Å²	111.8	68%	0.678	59%	0.591	S	S	*	*			trans	-80.3	103.3	173.2	-162.9	0	0	0	0	108	K82 R86	K82-S84 VanDerWaalsContact C-N 3.3Å; K82-S84 PolarHBondContact O-N 3.46Å; S84-R86 PolarHBondContact O-N 3.13Å
85	K	45.2	Very low	57.7	Low	185 Å²	185	115.2 Å²	115.2	80%	0.804	62%	0.619	S	S	*	*			trans	-68.7	61.2	-175.8	-169.4	179.6	171.8	-179.5	0	112.4	C83	C83-K85 PolarHBondContact O-N 2.86Å
86	R	47.1	Very low	55.7	Low	222 Å²	222	120.6 Å²	120.6	84%	0.838	64%	0.637	S	S	*	*			trans	-116.9	110	173.4	-70.6	-174.1	179.8	173.3	0.7	111	S84	S84-R86 PolarHBondContact O-N 3.13Å
87	K	37.4	Very low	53.9	Low	203 Å²	203	128.4 Å²	128.4	88%	0.883	68%	0.675	S	S	*	*			trans	13.1	114.2	157.6	-83.1	-177.7	164.8	-171.3	0	119.1
88	A	45.6	Very low	51.6	Low	97 Å²	97	136.3 Å²	136.3	80%	0.802	71%	0.708	S	S	*	*			trans	-157.5	101	139.3	0	0	0	0	0	103.8
89	D	38.8	Very low	49.8	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	74%	0.735	S	S	*	*				39	130	86	-85.1	-39.8	0	0	0	114.4
90	E	40.1	Very low	47.8	Very low	168 Å²	168	146.8 Å²	146.8	79%	0.785	75%	0.754	S	S	*	*			trans	92.3	101.6	174.5	-51.8	-72.5	111.7	0	0	117.6
91	D	39.7	Very low	45.8	Very low	156 Å²	156	152.4 Å²	152.4	83%	0.834	77%	0.773	S	S	*	*			trans	39	95.3	146.2	-77.1	-37	0	0	0	120.4
92	S	40.4	Very low	44.4	Very low	100 Å²	100	154.2 Å²	154.2	70%	0.699	77%	0.773	S	S	*	*			trans	-157.9	122.2	137.7	-166.8	0	0	0	0	110.3	D94	S92-D94 PolarHBondContact O-N 3.12Å
93	L	47.7	Very low	43.3	Very low	179 Å²	179	150.8 Å²	150.8	94%	0.937	76%	0.764	S	S	*	*			trans	-69.3	73.6	175.6	-69.7	163.9	0	0	0	110.5
94	D	43	Very low	43.4	Very low	131 Å²	131	150.9 Å²	150.9	70%	0.701	75%	0.75	S	S	*	*			trans	-131.7	95.5	166	-84.5	-60.8	0	0	0	108.5	S92 K96	S92-D94 PolarHBondContact O-N 3.12Å; D94-K96 PolarHBondContact O-N 3.11Å
95	S	42.7	Very low	43.9	Very low	124 Å²	124	155.6 Å²	155.6	87%	0.867	76%	0.758	S	S	*	*			trans	-63.3	73.5	170.2	-65.5	0	0	0	0	110.3	M97	S95-M97 PolarHBondContact O-N 3.11Å
96	K	41.4	Very low	44.6	Very low	181 Å²	181	151.1 Å²	151.1	79%	0.787	75%	0.746	S	S	*	*			trans	-68.3	86.9	166.2	-125.8	172.9	-175.8	170.4	0	106.7	D94 K98	D94-K96 PolarHBondContact O-N 3.11Å; K96-K98 PolarHBondContact O-N 2.62Å
97	M	50.7	Low	45.7	Very low	164 Å²	164	141.8 Å²	141.8	81%	0.808	72%	0.715	S	S	*	*			trans	-47.3	110.3	157.9	-82.6	175.2	92.1	0	0	106.1	S95 L99	S95-M97 PolarHBondContact O-N 3.11Å; M97-L99 PolarHBondContact O-N 3.34Å
98	K	38.6	Very low	47.8	Very low	175 Å²	175	133.7 Å²	133.7	76%	0.761	68%	0.682	S	S	*	*			trans	-68.7	73.7	171.8	-74.7	177.1	178.3	164.1	0	107.7	K96 K100	K96-K98 PolarHBondContact O-N 2.62Å; K98-K100 VanDerWaalsContact C-N 3.28Å; K98-K100 PolarHBondContact O-N 3.3Å
99	L	50.1	Low	49.8	Very low	114 Å²	114	132 Å²	132	60%	0.597	66%	0.66	S	S	*	*			trans	-58.5	104.3	152.6	-148.9	73.1	0	0	0	103.7	M97 R101	M97-L99 PolarHBondContact O-N 3.34Å; L99-R101 PolarHBondContact O-N 2.9Å
100	K	42.9	Very low	52.2	Low	168 Å²	168	125.2 Å²	125.2	73%	0.73	62%	0.623	S	S	*	*			trans	-46.9	109.6	170.2	-91.4	178.1	169.9	174.3	0	105.6	K98 F102	K98-K100 VanDerWaalsContact C-N 3.28Å; K98-K100 PolarHBondContact O-N 3.3Å; K100-F102 PolarHBondContact O-N 2.72Å
101	R	42.1	Very low	54.6	Low	184 Å²	184	118.1 Å²	118.1	69%	0.694	59%	0.591	S	S	*	*			trans	-53.2	107	173.7	-74.3	-179.2	172.3	172.1	-9.3	106.3	L99 D103	L99-R101 PolarHBondContact O-N 2.9Å; R101-D103 WeakPolarHBondContact CB-OD2 3.41Å; R101-D103 PolarHBondContact O-N 2.74Å
102	F	46.4	Very low	57	Low	118 Å²	118	110.7 Å²	110.7	52%	0.518	55%	0.551	S	S	.	*			trans	-73.7	71.5	167.5	-99	-89.3	0	0	0	106.3	K100 K104 T108	K100-F102 PolarHBondContact O-N 2.72Å; F102-K104 PolarHBondContact O-N 2.95Å; F102-T108 HydrophobicContact CE1-CG2 3.56Å; F102-T108 HydrophobicContact CZ-CG2 4.05Å
103	D	40.4	Very low	59.3	Low	129 Å²	129	107.7 Å²	107.7	69%	0.69	53%	0.527	S	S	*	.			trans	-72.9	118.5	168	-74.7	-51.9	0	0	0	107.2	R101	R101-D103 WeakPolarHBondContact CB-OD2 3.41Å; R101-D103 PolarHBondContact O-N 2.74Å
104	K	49	Very low	61.3	Low	131 Å²	131	102.6 Å²	102.6	57%	0.57	50%	0.501	S	S	*	.	S	Bend	trans	95.9	117.1	-174.5	-56.7	-177.4	176.5	-160.8	0	115.1	F102 T106	F102-K104 PolarHBondContact O-N 2.95Å; K104-T106 HydrophobicContact CB-CG2 4.37Å; K104-T106 PolarHBondContact O-N 2.95Å
105	K	52.8	Low	63.6	Low	196 Å²	196	96.3 Å²	96.3	85%	0.852	47%	0.467	S	S	*	.			trans	-64.1	51.2	174.7	-62	171.4	178.9	173	0	112.7
106	T	60.8	Low	65.7	Low	92 Å²	92	90.9 Å²	90.9	56%	0.564	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-99.3	123.7	175.6	57.9	0	0	0	0	108.9	K104 T108	K104-T106 HydrophobicContact CB-CG2 4.37Å; K104-T106 PolarHBondContact O-N 2.95Å; T106-T108 PolarHBondContact O-N 3.38Å
107	C	69.4	Low	67.9	Low	26 Å²	26	90.9 Å²	90.9	18%	0.176	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-57.3	129.9	174.8	-57.3	0	0	0	0	110.4	R155 F156 A157 Y159 Q162	C107-R155 HydrophobicContact CB-CG 4.27Å; C107-F156 WeakPolarHBondContact CB-O 3.27Å; C107-F156 PolarHBondContact SG-O 3.18Å; C107-A157 VanDerWaalsContact SG-C 3.53Å; C107-A157 PolarHBondContact SG-O 2.81Å; C107-Y159 PolarHBondContact SG-N 3.13Å; C107-Q162 VanDerWaalsContact CA-OE1 3.27Å
108	T	80.7	Confident	69.6	Low	32 Å²	32	93.2 Å²	93.2	20%	0.196	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-91.4	148.5	172.2	57.1	0	0	0	0	110.3	F102 T106 L110 Q162	F102-T108 HydrophobicContact CE1-CG2 3.56Å; F102-T108 HydrophobicContact CZ-CG2 4.05Å; T106-T108 PolarHBondContact O-N 3.38Å; T108-L110 PolarHBondContact O-N 2.74Å; T108-Q162 PolarHBondContact O-OE1 2.88Å; T108-Q162 PolarHBondContact OG1-NE2 2.99Å; T108-Q162 PolarHBondContact OG1-OE1 2.84Å
109	D	87.2	Confident	71.9	Confident	61 Å²	61	84.9 Å²	84.9	33%	0.326	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-59.6	126.7	168.5	-55.9	-17.8	0	0	0	109	I154 R155 P182	D109-I154 CarbonylContact C-O 3.52Å; D109-I154 WeakPolarHBondContact CA-O 3.43Å; D109-R155 VanDerWaalsContact OD1-CD 3.32Å; D109-R155 WeakPolarHBondContact OD1-CD 3.42Å; D109-R155 IonicContact OD1-NH1 3.79Å; D109-P182 WeakPolarHBondContact O-CD 3.19Å; D109-P182 WeakPolarHBondContact O-CG 3.4Å
110	L	89.7	Confident	73.8	Confident	0 Å²	0	83 Å²	83	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	141.9	171.3	-56.1	-175.9	0	0	0	109.2	T108 F153 I154 F156 Q162 C165 L166 V179 R180 I181	T108-L110 PolarHBondContact O-N 2.74Å; L110-F153 CarbonylContact O-C 3.52Å; L110-F153 WeakPolarHBondContact O-CA 3.48Å; L110-I154 HydrophobicContact CB-CG1 3.83Å; L110-I154 HydrophobicContact CD1-CD1 4.46Å; L110-I154 HydrophobicContact CD1-CG1 4.46Å; L110-I154 PolarHBondContact N-O 2.91Å; L110-I154 PolarHBondContact O-N 3.49Å; L110-F156 HydrophobicContact CD1-CD2 4.17Å; L110-F156 HydrophobicContact CD1-CE2 3.93Å; L110-Q162 HydrophobicContact CD1-CG 3.82Å; L110-Q162 HydrophobicContact CD2-CG 3.74Å; L110-Q162 HydrophobicContact CG-CG 3.96Å; L110-C165 HydrophobicContact CD1-CB 4.42Å; L110-L166 HydrophobicContact CD1-CD2 4.37Å; L110-L166 HydrophobicContact CD1-CG 4.19Å; L110-L166 HydrophobicContact CD2-CD1 3.98Å; L110-L166 HydrophobicContact CD2-CD2 4.03Å; L110-L166 HydrophobicContact CD2-CG 4.12Å; L110-V179 HydrophobicContact CB-CG1 3.95Å; L110-V179 HydrophobicContact CD1-CG1 3.72Å; L110-V179 HydrophobicContact CG-CG1 4.43Å; L110-R180 WeakPolarHBondContact CA-O 3.36Å; L110-I181 HydrophobicContact CD2-CG1 3.9Å
111	I	90.5	Very high	76.1	Confident	19 Å²	19	79 Å²	79	10%	0.097	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.7	169.2	-172	171.7	0	0	0	109.3	L113 Y151 G152 F153 V179 R180 P182	I111-L113 HydrophobicContact CD1-CD2 3.71Å; I111-L113 HydrophobicContact CD1-CG 4.47Å; I111-L113 HydrophobicContact CG1-CD2 3.89Å; I111-L113 HydrophobicContact CG1-CG 4.28Å; I111-Y151 HydrophobicContact CD1-CD2 3.99Å; I111-Y151 HydrophobicContact CG1-CD2 4.32Å; I111-G152 WeakPolarHBondContact CA-O 3.34Å; I111-F153 HydrophobicContact CB-CD1 4.06Å; I111-F153 HydrophobicContact CB-CE1 3.83Å; I111-F153 HydrophobicContact CD1-CE1 4.04Å; I111-F153 HydrophobicContact CD1-CZ 3.94Å; I111-F153 HydrophobicContact CG1-CD1 4.38Å; I111-F153 HydrophobicContact CG1-CE1 3.98Å; I111-F153 HydrophobicContact CG1-CZ 4.2Å; I111-V179 WeakPolarHBondContact O-CA 3.47Å; I111-R180 HydrophobicContact CG2-CG 3.44Å; I111-R180 VanDerWaalsContact CG2-CG 3.44Å; I111-R180 WeakPolarHBondContact CG2-O 3.25Å; I111-R180 PolarHBondContact N-O 2.91Å; I111-R180 PolarHBondContact O-N 2.99Å; I111-P182 HydrophobicContact CB-CB 4.07Å; I111-P182 HydrophobicContact CB-CG 4.46Å; I111-P182 HydrophobicContact CG2-CB 3.94Å
112	V	91	Very high	78.5	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.4	173.8	-169.2	0	0	0	0	108	L115 F128 Y151 G152 I154 C177 V179	V112-L115 HydrophobicContact CB-CD1 4.27Å; V112-L115 HydrophobicContact CB-CD2 4.31Å; V112-L115 HydrophobicContact CB-CG 4.32Å; V112-L115 HydrophobicContact CG1-CD1 4.3Å; V112-L115 HydrophobicContact CG1-CD2 3.47Å; V112-L115 VanDerWaalsContact CG1-CD2 3.47Å; V112-L115 HydrophobicContact CG1-CG 3.85Å; V112-F128 HydrophobicContact CG1-CE2 4.22Å; V112-F128 HydrophobicContact CG1-CZ 4Å; V112-F128 HydrophobicContact CG2-CE2 4.01Å; V112-F128 HydrophobicContact CG2-CZ 3.98Å; V112-Y151 CarbonylContact O-C 3.56Å; V112-Y151 WeakPolarHBondContact O-CA 3.2Å; V112-Y151 VanDerWaalsContact O-CB 3.31Å; V112-Y151 WeakPolarHBondContact O-CB 3.48Å; V112-G152 PolarHBondContact N-O 3.06Å; V112-G152 PolarHBondContact O-N 2.82Å; V112-I154 HydrophobicContact CG2-CD1 3.81Å; V112-I154 HydrophobicContact CG2-CG1 3.89Å; V112-I154 HydrophobicContact CG2-CG2 4.09Å; V112-C177 HydrophobicContact CG1-CB 4.15Å; V112-V179 HydrophobicContact CB-CG2 4.42Å; V112-V179 HydrophobicContact CG1-CG2 3.97Å; V112-V179 HydrophobicContact CG2-CG2 4.09Å
113	L	88.5	Confident	80.6	Confident	37 Å²	37	71.7 Å²	71.7	19%	0.194	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	157.7	-178.7	-62.8	176.8	0	0	0	111.2	I111 L115 Y151 C177 D178	I111-L113 HydrophobicContact CD1-CD2 3.71Å; I111-L113 HydrophobicContact CD1-CG 4.47Å; I111-L113 HydrophobicContact CG1-CD2 3.89Å; I111-L113 HydrophobicContact CG1-CG 4.28Å; L113-L115 VanDerWaalsContact C-N 3.26Å; L113-L115 PolarHBondContact O-N 2.96Å; L113-Y151 HydrophobicContact CD2-CG 4.47Å; L113-C177 WeakPolarHBondContact O-CA 3.37Å; L113-D178 HydrophobicContact CB-CB 4.25Å; L113-D178 PolarHBondContact N-O 3.07Å; L113-D178 PolarHBondContact O-N 3.1Å
114	N	89.8	Confident	83	Confident	72 Å²	72	65.6 Å²	65.6	39%	0.385	31%	0.311	S	S	.	.	S	Bend	trans	62	31.6	178	-161	37.9	0	0	0	113.9	G150 R175 Q176	N114-G150 PolarHBondContact N-O 2.88Å; N114-R175 WeakPolarHBondContact O-CD 3.45Å; N114-R175 PolarHBondContact O-NE 2.9Å; N114-R175 VanDerWaalsContact OD1-CZ 3.28Å; N114-R175 PolarHBondContact OD1-NE 2.81Å; N114-R175 PolarHBondContact OD1-NH2 3.29Å; N114-Q176 PolarHBondContact ND2-O 2.81Å
115	L	89.9	Confident	85.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.303	C	S	.	.			trans	-62.6	143.7	173.4	-70.5	173.1	0	0	0	110.8	V112 L113 W117 L124 G150 I172	V112-L115 HydrophobicContact CB-CD1 4.27Å; V112-L115 HydrophobicContact CB-CD2 4.31Å; V112-L115 HydrophobicContact CB-CG 4.32Å; V112-L115 HydrophobicContact CG1-CD1 4.3Å; V112-L115 HydrophobicContact CG1-CD2 3.47Å; V112-L115 VanDerWaalsContact CG1-CD2 3.47Å; V112-L115 HydrophobicContact CG1-CG 3.85Å; L113-L115 VanDerWaalsContact C-N 3.26Å; L113-L115 PolarHBondContact O-N 2.96Å; L115-W117 PolarHBondContact O-N 3.25Å; L115-L124 HydrophobicContact CD1-CD1 4.23Å; L115-L124 HydrophobicContact CD1-CD2 3.88Å; L115-L124 HydrophobicContact CD2-CD1 3.95Å; L115-L124 HydrophobicContact CD2-CD2 4.44Å; L115-L124 HydrophobicContact CD2-CG 4.33Å; L115-G150 PolarHBondContact N-O 2.62Å; L115-I172 HydrophobicContact CD2-CD1 3.88Å
116	P	87.7	Confident	87	Confident	10 Å²	10	61.1 Å²	61.1	7%	0.065	30%	0.295	C	S	.	.			trans	-52.4	137.9	166.3	-20.9	29.9	0	0	0	110.6	R118 A119 I172 E173 R175	P116-R118 PolarHBondContact O-N 3.12Å; P116-R118 VanDerWaalsContact O-N 3.13Å; P116-A119 HydrophobicContact CB-CB 4.08Å; P116-A119 HydrophobicContact CG-CB 4.26Å; P116-A119 VanDerWaalsContact O-CB 3.29Å; P116-A119 WeakPolarHBondContact O-CB 3.32Å; P116-A119 PolarHBondContact O-N 3.27Å; P116-I172 HydrophobicContact CG-CG2 4.29Å; P116-I172 WeakPolarHBondContact CG-O 3.49Å; P116-E173 WeakPolarHBondContact CB-OE2 3.48Å; P116-E173 HydrophobicContact CG-CB 3.93Å; P116-E173 HydrophobicContact CG-CG 4.33Å; P116-R175 HydrophobicContact CG-CB 4.18Å
117	W	87.9	Confident	88.5	Confident	181 Å²	181	59.3 Å²	59.3	69%	0.686	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18	-179.4	-62.5	-21.9	0	0	0	113.5	L115 S148	L115-W117 PolarHBondContact O-N 3.25Å; W117-S148 VanDerWaalsContact O-CB 3.28Å; W117-S148 WeakPolarHBondContact O-CB 2.81Å
118	R	87.2	Confident	89.6	Confident	212 Å²	212	58 Å²	58	80%	0.8	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.2	175	-63.2	-177.8	-179.1	171.2	-0.7	113.4	P116 D120	P116-R118 PolarHBondContact O-N 3.12Å; P116-R118 VanDerWaalsContact O-N 3.13Å; R118-D120 PolarHBondContact O-N 3.33Å
119	A	86.6	Confident	90.1	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.008	28%	0.28	C	S	.	.			trans	-66.6	125.7	-179.4	0	0	0	0	0	109.8	P116 L124 I139	P116-A119 HydrophobicContact CB-CB 4.08Å; P116-A119 HydrophobicContact CG-CB 4.26Å; P116-A119 VanDerWaalsContact O-CB 3.29Å; P116-A119 WeakPolarHBondContact O-CB 3.32Å; P116-A119 PolarHBondContact O-N 3.27Å; A119-L124 HydrophobicContact CB-CD1 3.98Å; A119-I139 VanDerWaalsContact O-CD1 3.3Å; A119-I139 WeakPolarHBondContact O-CD1 3.02Å
120	D	89.3	Confident	90.2	Very high	74 Å²	74	62.2 Å²	62.2	40%	0.396	29%	0.292	S	S	.	.			trans	-101.9	171.3	176.2	-72.8	-44.1	0	0	0	110.7	R118 D122 T123 L124 R141	R118-D120 PolarHBondContact O-N 3.33Å; D120-D122 PolarHBondContact O-N 3.39Å; D120-T123 PolarHBondContact N-OG1 3.02Å; D120-T123 WeakPolarHBondContact O-CB 3.49Å; D120-T123 PolarHBondContact O-N 3.35Å; D120-T123 VanDerWaalsContact O-N 3.13Å; D120-L124 WeakPolarHBondContact O-CD1 3.39Å; D120-L124 PolarHBondContact O-N 2.76Å; D120-R141 IonicContact OD1-CZ 3.05Å; D120-R141 IonicContact OD1-NH1 3.78Å; D120-R141 IonicContact OD1-NH2 3.95Å; D120-R141 PolarHBondContact OD1-NH2 3.36Å
121	E	91.3	Very high	90.2	Very high	84 Å²	84	64.1 Å²	64.1	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-32.8	-177.2	-65.2	-179.1	170	0	0	111.7	L124 R125 I137 I139	E121-L124 PolarHBondContact O-N 3.48Å; E121-R125 WeakPolarHBondContact O-CB 3.36Å; E121-R125 PolarHBondContact O-N 3.1Å; E121-I137 HydrophobicContact CB-CG2 4.02Å; E121-I137 HydrophobicContact CG-CG2 4.15Å; E121-I139 HydrophobicContact CG-CB 4.45Å; E121-I139 HydrophobicContact CG-CD1 3.95Å; E121-I139 HydrophobicContact CG-CG1 3.98Å
122	D	91.6	Very high	90.1	Very high	109 Å²	109	64.1 Å²	64.1	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-66	-41.7	174.7	-59	-47	0	0	0	111.7	D120 L124 R125 D126	D120-D122 PolarHBondContact O-N 3.39Å; D122-L124 VanDerWaalsContact C-N 3.29Å; D122-L124 PolarHBondContact O-N 2.75Å; D122-R125 WeakPolarHBondContact O-CB 3.31Å; D122-R125 PolarHBondContact O-N 3.29Å; D122-R125 VanDerWaalsContact O-N 3.1Å; D122-D126 PolarHBondContact O-N 3.28Å
123	T	91.1	Very high	90.1	Very high	40 Å²	40	69.4 Å²	69.4	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-41.7	175.3	-45.9	0	0	0	0	111.6	D120 Y127 I172	D120-T123 PolarHBondContact N-OG1 3.02Å; D120-T123 WeakPolarHBondContact O-CB 3.49Å; D120-T123 PolarHBondContact O-N 3.35Å; D120-T123 VanDerWaalsContact O-N 3.13Å; T123-Y127 WeakPolarHBondContact O-CB 3.45Å; T123-Y127 PolarHBondContact O-N 2.76Å; T123-I172 HydrophobicContact CG2-CG2 4.03Å
124	L	91.5	Very high	90.2	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.4	-39.5	175.6	-89.8	66.9	0	0	0	111.2	L115 A119 D120 E121 D122 Y127 F128 I137 I139 I154	L115-L124 HydrophobicContact CD1-CD1 4.23Å; L115-L124 HydrophobicContact CD1-CD2 3.88Å; L115-L124 HydrophobicContact CD2-CD1 3.95Å; L115-L124 HydrophobicContact CD2-CD2 4.44Å; L115-L124 HydrophobicContact CD2-CG 4.33Å; A119-L124 HydrophobicContact CB-CD1 3.98Å; D120-L124 WeakPolarHBondContact O-CD1 3.39Å; D120-L124 PolarHBondContact O-N 2.76Å; E121-L124 PolarHBondContact O-N 3.48Å; D122-L124 VanDerWaalsContact C-N 3.29Å; D122-L124 PolarHBondContact O-N 2.75Å; L124-Y127 PolarHBondContact O-N 3.09Å; L124-F128 HydrophobicContact CB-CD2 4.28Å; L124-F128 HydrophobicContact CG-CD2 4.36Å; L124-F128 HydrophobicContact CG-CE2 4.21Å; L124-F128 WeakPolarHBondContact O-CB 3.45Å; L124-F128 VanDerWaalsContact O-CD2 3.27Å; L124-F128 WeakPolarHBondContact O-CD2 3.22Å; L124-F128 PolarHBondContact O-N 2.62Å; L124-I137 HydrophobicContact CB-CG2 4Å; L124-I137 HydrophobicContact CD2-CG2 4.1Å; L124-I139 HydrophobicContact CD1-CD1 3.95Å; L124-I139 HydrophobicContact CD2-CD1 4.21Å; L124-I139 HydrophobicContact CD2-CG1 4.04Å; L124-I154 HydrophobicContact CD2-CG2 4.17Å
125	R	93.1	Very high	90.3	Very high	107 Å²	107	69.1 Å²	69.1	40%	0.404	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-54.9	178	-173.2	178.9	-63.7	-78.4	-2.3	110.6	E121 D122 Y127 F128 S129 L134 I137	E121-R125 WeakPolarHBondContact O-CB 3.36Å; E121-R125 PolarHBondContact O-N 3.1Å; D122-R125 WeakPolarHBondContact O-CB 3.31Å; D122-R125 PolarHBondContact O-N 3.29Å; D122-R125 VanDerWaalsContact O-N 3.1Å; R125-Y127 VanDerWaalsContact C-N 3.26Å; R125-Y127 PolarHBondContact O-N 3.42Å; R125-F128 PolarHBondContact O-N 3.18Å; R125-S129 WeakPolarHBondContact O-CA 3.49Å; R125-S129 WeakPolarHBondContact O-CB 3.35Å; R125-S129 PolarHBondContact O-N 3.11Å; R125-L134 HydrophobicContact CG-CD1 4.45Å; R125-I137 HydrophobicContact CB-CD1 3.47Å; R125-I137 VanDerWaalsContact CB-CD1 3.47Å; R125-I137 HydrophobicContact CG-CD1 3.97Å
126	D	91.9	Very high	90.2	Very high	126 Å²	126	71.7 Å²	71.7	67%	0.674	35%	0.346	S	S	*	.	H	α-helix	trans	-59.9	-40.3	-177.2	-68.8	-10.2	0	0	0	111.2	D122	D122-D126 PolarHBondContact O-N 3.28Å
127	Y	91.9	Very high	90.4	Very high	54 Å²	54	72.1 Å²	72.1	21%	0.212	35%	0.347	C	S	.	.	H	α-helix	trans	-71.2	-51	179.3	-172.3	-97.1	0	0	0	113	T123 L124 R125 Q130 H170 T171 I172	T123-Y127 WeakPolarHBondContact O-CB 3.45Å; T123-Y127 PolarHBondContact O-N 2.76Å; L124-Y127 PolarHBondContact O-N 3.09Å; R125-Y127 VanDerWaalsContact C-N 3.26Å; R125-Y127 PolarHBondContact O-N 3.42Å; Y127-Q130 VanDerWaalsContact O-CD 3.26Å; Y127-Q130 WeakPolarHBondContact O-CG 3.49Å; Y127-Q130 PolarHBondContact O-NE2 3.47Å; Y127-H170 HydrophobicContact CE1-CB 3.87Å; Y127-H170 AromaticContact CE1-ND1 3.5Å; Y127-H170 WeakPolarHBondContact CE1-ND1 3.48Å; Y127-H170 WeakPolarHBondContact OH-CA 3.5Å; Y127-T171 VanDerWaalsContact CE2-O 3.25Å; Y127-T171 WeakPolarHBondContact CE2-O 3.19Å; Y127-T171 PolarHBondContact OH-N 3.2Å; Y127-T171 PolarHBondContact OH-O 3.24Å; Y127-I172 HydrophobicContact CD1-CD1 3.82Å; Y127-I172 HydrophobicContact CD1-CG1 3.76Å; Y127-I172 HydrophobicContact CD2-CG1 4.16Å; Y127-I172 HydrophobicContact CE1-CD1 4.22Å; Y127-I172 HydrophobicContact CE1-CG1 3.87Å; Y127-I172 HydrophobicContact CE2-CG1 4.27Å; Y127-I172 HydrophobicContact CG-CD1 4.21Å; Y127-I172 HydrophobicContact CG-CG1 3.9Å
128	F	92.3	Very high	90.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-81.3	-17.1	-174.5	-72.4	-69.5	0	0	0	113.4	V112 L124 R125 Q130 Y131 L134 I154 F156 C165 H170 I172 V179	V112-F128 HydrophobicContact CG1-CE2 4.22Å; V112-F128 HydrophobicContact CG1-CZ 4Å; V112-F128 HydrophobicContact CG2-CE2 4.01Å; V112-F128 HydrophobicContact CG2-CZ 3.98Å; L124-F128 HydrophobicContact CB-CD2 4.28Å; L124-F128 HydrophobicContact CG-CD2 4.36Å; L124-F128 HydrophobicContact CG-CE2 4.21Å; L124-F128 WeakPolarHBondContact O-CB 3.45Å; L124-F128 VanDerWaalsContact O-CD2 3.27Å; L124-F128 WeakPolarHBondContact O-CD2 3.22Å; L124-F128 PolarHBondContact O-N 2.62Å; R125-F128 PolarHBondContact O-N 3.18Å; F128-Q130 PolarHBondContact O-N 2.86Å; F128-Q130 VanDerWaalsContact O-N 3.12Å; F128-Y131 HydrophobicContact CD1-CD2 4.16Å; F128-Y131 HydrophobicContact CD1-CE2 4.25Å; F128-Y131 PolarHBondContact O-N 3.2Å; F128-Y131 VanDerWaalsContact O-N 3.08Å; F128-L134 HydrophobicContact CB-CD1 3.68Å; F128-L134 HydrophobicContact CB-CD2 4.1Å; F128-L134 HydrophobicContact CB-CG 4.36Å; F128-I154 HydrophobicContact CB-CD1 4.36Å; F128-I154 HydrophobicContact CD1-CD1 3.73Å; F128-I154 HydrophobicContact CD2-CD1 3.83Å; F128-I154 HydrophobicContact CD2-CG2 4.37Å; F128-I154 HydrophobicContact CE1-CD1 3.9Å; F128-I154 HydrophobicContact CE2-CD1 4Å; F128-I154 HydrophobicContact CG-CD1 3.71Å; F128-I154 HydrophobicContact CZ-CD1 4.04Å; F128-F156 HydrophobicContact CB-CE1 4.47Å; F128-F156 HydrophobicContact CB-CZ 4.14Å; F128-F156 HydrophobicContact CD1-CZ 4.36Å; F128-C165 VanDerWaalsContact CE1-SG 3.59Å; F128-H170 AromaticContact CE1-CE1 3.87Å; F128-H170 AromaticContact CE1-CG 3.83Å; F128-H170 AromaticContact CE1-ND1 3.57Å; F128-I172 HydrophobicContact CE2-CD1 3.89Å; F128-I172 HydrophobicContact CZ-CD1 4.15Å; F128-V179 HydrophobicContact CE1-CG2 3.87Å; F128-V179 HydrophobicContact CZ-CG2 3.77Å
129	S	91.4	Very high	90.8	Very high	59 Å²	59	57.4 Å²	57.4	41%	0.413	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	175.6	-172.2	0	0	0	0	113.2	R125 Y131 G132	R125-S129 WeakPolarHBondContact O-CA 3.49Å; R125-S129 WeakPolarHBondContact O-CB 3.35Å; R125-S129 PolarHBondContact O-N 3.11Å; S129-Y131 PolarHBondContact O-N 3.32Å; S129-G132 WeakPolarHBondContact CA-O 3.22Å; S129-G132 PolarHBondContact O-N 2.98Å
130	Q	90.4	Very high	91	Very high	122 Å²	122	60.3 Å²	60.3	57%	0.57	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.8	173.8	75.4	-170.2	-10.5	0	0	113.3	Y127 F128	Y127-Q130 VanDerWaalsContact O-CD 3.26Å; Y127-Q130 WeakPolarHBondContact O-CG 3.49Å; Y127-Q130 PolarHBondContact O-NE2 3.47Å; F128-Q130 PolarHBondContact O-N 2.86Å; F128-Q130 VanDerWaalsContact O-N 3.12Å
131	Y	89.8	Confident	91.1	Very high	40 Å²	40	61.4 Å²	61.4	16%	0.157	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-29.6	179	-62.1	-72.8	0	0	0	112.4	F128 S129 A161 M164 C165 E168 H170	F128-Y131 HydrophobicContact CD1-CD2 4.16Å; F128-Y131 HydrophobicContact CD1-CE2 4.25Å; F128-Y131 PolarHBondContact O-N 3.2Å; F128-Y131 VanDerWaalsContact O-N 3.08Å; S129-Y131 PolarHBondContact O-N 3.32Å; Y131-A161 VanDerWaalsContact O-CB 3.23Å; Y131-A161 WeakPolarHBondContact O-CB 3.27Å; Y131-M164 HydrophobicContact CD1-CB 4.13Å; Y131-C165 HydrophobicContact CD2-CB 4.33Å; Y131-C165 HydrophobicContact CG-CB 4.28Å; Y131-E168 WeakPolarHBondContact CE1-OE2 3.49Å; Y131-E168 PolarHBondContact OH-OE2 3.28Å; Y131-H170 AromaticContact CE2-CE1 3.53Å; Y131-H170 AromaticContact CE2-ND1 3.82Å; Y131-H170 AromaticContact CZ-CE1 3.61Å; Y131-H170 PolarHBondContact OH-CE1 3.49Å
132	G	88	Confident	90.8	Very high	18 Å²	18	59.8 Å²	59.8	19%	0.186	30%	0.301	C	S	.	.	S	Bend	trans	160.1	178.5	179.4	0	0	0	0	0	112.1	S129	S129-G132 WeakPolarHBondContact CA-O 3.22Å; S129-G132 PolarHBondContact O-N 2.98Å
133	D	90.1	Very high	90.3	Very high	111 Å²	111	59.3 Å²	59.3	59%	0.594	30%	0.303	S	S	*	.			trans	-68.6	134.4	-175.5	-67.8	-32.3	0	0	0	112.4	F156 A157	D133-F156 CarbonylContact O-C 3.52Å; D133-F156 WeakPolarHBondContact O-CA 3.44Å; D133-A157 HydrophobicContact CB-CB 4.08Å; D133-A157 PolarHBondContact O-N 3.46Å
134	L	91.6	Very high	90.1	Very high	19 Å²	19	63.4 Å²	63.4	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115.9	179.1	-67.6	159.1	0	0	0	110.4	R125 F128 I137 I154 R155 F156	R125-L134 HydrophobicContact CG-CD1 4.45Å; F128-L134 HydrophobicContact CB-CD1 3.68Å; F128-L134 HydrophobicContact CB-CD2 4.1Å; F128-L134 HydrophobicContact CB-CG 4.36Å; L134-I137 HydrophobicContact CB-CD1 4.16Å; L134-I137 HydrophobicContact CB-CG1 4.13Å; L134-I137 HydrophobicContact CD1-CD1 3.76Å; L134-I137 HydrophobicContact CD1-CG1 4.24Å; L134-I154 HydrophobicContact CD2-CB 4.08Å; L134-R155 CarbonylContact C-O 3.44Å; L134-F156 HydrophobicContact CD2-CD1 3.77Å; L134-F156 HydrophobicContact CD2-CE1 3.56Å; L134-F156 HydrophobicContact CD2-CE2 4.4Å; L134-F156 HydrophobicContact CD2-CG 4.29Å; L134-F156 HydrophobicContact CD2-CZ 3.91Å; L134-F156 HydrophobicContact CG-CD1 4.35Å; L134-F156 HydrophobicContact CG-CE1 4.15Å
135	V	90.9	Very high	90	Very high	85 Å²	85	66.9 Å²	66.9	52%	0.515	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-31.9	176.7	-177.3	0	0	0	0	111.3	R155 A157	V135-R155 PolarHBondContact N-O 3.18Å; V135-A157 VanDerWaalsContact CG2-CA 3.46Å; V135-A157 HydrophobicContact CG2-CB 3.62Å
136	M	88.1	Confident	89.6	Confident	54 Å²	54	67.5 Å²	67.5	27%	0.266	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	136.7	-178.8	-170.8	-168	-176.2	0	0	110.1	Q138 I154 R155	M136-Q138 HydrophobicContact CE-CB 4.1Å; M136-I154 CarbonylContact O-C 3.55Å; M136-I154 VanDerWaalsContact O-CA 3.29Å; M136-I154 WeakPolarHBondContact O-CA 3.35Å; M136-R155 HydrophobicContact CB-CB 3.76Å; M136-R155 PolarHBondContact N-O 3.21Å; M136-R155 PolarHBondContact O-N 3.26Å
137	I	93.2	Very high	89.2	Confident	18 Å²	18	67.5 Å²	67.5	9%	0.092	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.1	167.7	-54.6	174.9	0	0	0	105.6	E121 L124 R125 L134 F153 I154	E121-I137 HydrophobicContact CB-CG2 4.02Å; E121-I137 HydrophobicContact CG-CG2 4.15Å; L124-I137 HydrophobicContact CB-CG2 4Å; L124-I137 HydrophobicContact CD2-CG2 4.1Å; R125-I137 HydrophobicContact CB-CD1 3.47Å; R125-I137 VanDerWaalsContact CB-CD1 3.47Å; R125-I137 HydrophobicContact CG-CD1 3.97Å; L134-I137 HydrophobicContact CB-CD1 4.16Å; L134-I137 HydrophobicContact CB-CG1 4.13Å; L134-I137 HydrophobicContact CD1-CD1 3.76Å; L134-I137 HydrophobicContact CD1-CG1 4.24Å; I137-F153 CarbonylContact C-O 3.54Å; I137-F153 WeakPolarHBondContact CA-O 3.15Å; I137-I154 HydrophobicContact CG2-CG2 4.38Å
138	Q	90.2	Very high	89	Confident	72 Å²	72	65.6 Å²	65.6	34%	0.336	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	110.4	178.5	-173	178.9	44	0	0	110.6	M136 K140 G152 F153	M136-Q138 HydrophobicContact CE-CB 4.1Å; Q138-K140 VanDerWaalsContact NE2-NZ 3.16Å; Q138-G152 CarbonylContact O-C 3.4Å; Q138-G152 WeakPolarHBondContact O-CA 3.08Å; Q138-F153 PolarHBondContact N-O 2.75Å; Q138-F153 PolarHBondContact O-N 3.29Å
139	I	92.3	Very high	88.7	Confident	12 Å²	12	70.7 Å²	70.7	6%	0.062	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.7	175	-62.6	178.2	0	0	0	109.5	A119 E121 L124 R141	A119-I139 VanDerWaalsContact O-CD1 3.3Å; A119-I139 WeakPolarHBondContact O-CD1 3.02Å; E121-I139 HydrophobicContact CG-CB 4.45Å; E121-I139 HydrophobicContact CG-CD1 3.95Å; E121-I139 HydrophobicContact CG-CG1 3.98Å; L124-I139 HydrophobicContact CD1-CD1 3.95Å; L124-I139 HydrophobicContact CD2-CD1 4.21Å; L124-I139 HydrophobicContact CD2-CG1 4.04Å; I139-R141 HydrophobicContact CG2-CG 4.4Å; I139-R141 PolarHBondContact O-N 3.44Å
140	K	90.5	Very high	88.4	Confident	63 Å²	63	68.3 Å²	68.3	27%	0.274	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.7	177.7	-66.3	-59.8	-178.6	-173.2	0	109.8	Q138 K149 Y151 F153	Q138-K140 VanDerWaalsContact NE2-NZ 3.16Å; K140-K149 VanDerWaalsContact O-CB 3.32Å; K140-K149 WeakPolarHBondContact O-CB 3.39Å; K140-K149 PolarHBondContact O-N 3.41Å; K140-Y151 HydrophobicContact CB-CD2 4.22Å; K140-Y151 HydrophobicContact CB-CE1 4.11Å; K140-Y151 HydrophobicContact CB-CE2 3.72Å; K140-Y151 HydrophobicContact CG-CD2 4.14Å; K140-Y151 HydrophobicContact CG-CE2 3.5Å; K140-Y151 VanDerWaalsContact CG-CE2 3.5Å; K140-Y151 PolarHBondContact N-O 3.26Å; K140-F153 HydrophobicContact CD-CE2 4.48Å; K140-F153 HydrophobicContact CG-CD2 4.22Å; K140-F153 HydrophobicContact CG-CE2 3.95Å
141	R	91.3	Very high	88.5	Confident	96 Å²	96	65.9 Å²	65.9	36%	0.362	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	155.3	173.8	-55.3	-176.1	-173.5	-143.3	-5.3	110.4	D120 I139 Q147	D120-R141 IonicContact OD1-CZ 3.05Å; D120-R141 IonicContact OD1-NH1 3.78Å; D120-R141 IonicContact OD1-NH2 3.95Å; D120-R141 PolarHBondContact OD1-NH2 3.36Å; I139-R141 HydrophobicContact CG2-CG 4.4Å; I139-R141 PolarHBondContact O-N 3.44Å; R141-Q147 CarbonylContact C-O 3.48Å; R141-Q147 VanDerWaalsContact CA-O 3.28Å; R141-Q147 WeakPolarHBondContact CA-O 3.32Å
142	D	84.8	Confident	88.6	Confident	51 Å²	51	64 Å²	64	27%	0.273	33%	0.333	S	S	.	.			trans	-67	123.6	168.7	178.8	-2.2	0	0	0	109.1	V144 T145 Q146 Q147	D142-V144 PolarHBondContact O-N 3.42Å; D142-V144 PolarHBondContact OD1-N 3.33Å; D142-V144 VanDerWaalsContact OD1-N 3.1Å; D142-T145 VanDerWaalsContact CB-OG1 3.27Å; D142-T145 WeakPolarHBondContact CB-OG1 3.12Å; D142-T145 VanDerWaalsContact CG-OG1 3.22Å; D142-T145 WeakPolarHBondContact OD2-CG2 3.15Å; D142-T145 PolarHBondContact OD2-OG1 2.9Å; D142-Q146 WeakPolarHBondContact O-CA 3.35Å; D142-Q146 PolarHBondContact O-N 3.44Å; D142-Q147 PolarHBondContact N-O 2.93Å
143	P	82.4	Confident	88.8	Confident	98 Å²	98	65 Å²	65	64%	0.636	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.9	-177.8	24.1	-35.3	0	0	0	113.5	Q146	P143-Q146 PolarHBondContact O-NE2 3.36Å
144	V	87.1	Confident	89	Confident	126 Å²	126	59.7 Å²	59.7	76%	0.764	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-54.5	-176.6	-176.5	0	0	0	0	111.2	D142	D142-V144 PolarHBondContact O-N 3.42Å; D142-V144 PolarHBondContact OD1-N 3.33Å; D142-V144 VanDerWaalsContact OD1-N 3.1Å
145	T	88.7	Confident	88.9	Confident	73 Å²	73	63 Å²	63	45%	0.448	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.9	-174.8	63.8	0	0	0	0	113.5	D142 Q147	D142-T145 VanDerWaalsContact CB-OG1 3.27Å; D142-T145 WeakPolarHBondContact CB-OG1 3.12Å; D142-T145 VanDerWaalsContact CG-OG1 3.22Å; D142-T145 WeakPolarHBondContact OD2-CG2 3.15Å; D142-T145 PolarHBondContact OD2-OG1 2.9Å; T145-Q147 PolarHBondContact O-N 2.91Å; T145-Q147 PolarHBondContact OG1-N 3.33Å
146	Q	84.6	Confident	88.9	Confident	120 Å²	120	59 Å²	59	56%	0.561	29%	0.291	S	S	*	.			trans	55	12.3	-170.5	-67.2	-64.2	-45	0	0	114.3	D142 P143	D142-Q146 WeakPolarHBondContact O-CA 3.35Å; D142-Q146 PolarHBondContact O-N 3.44Å; P143-Q146 PolarHBondContact O-NE2 3.36Å
147	Q	84.2	Confident	88.9	Confident	126 Å²	126	58.6 Å²	58.6	59%	0.589	30%	0.296	S	S	*	.			trans	-77.5	141.8	177.4	-65.4	-170.1	25.3	0	0	110.7	R141 D142 T145 K149	R141-Q147 CarbonylContact C-O 3.48Å; R141-Q147 VanDerWaalsContact CA-O 3.28Å; R141-Q147 WeakPolarHBondContact CA-O 3.32Å; D142-Q147 PolarHBondContact N-O 2.93Å; T145-Q147 PolarHBondContact O-N 2.91Å; T145-Q147 PolarHBondContact OG1-N 3.33Å; Q147-K149 PolarHBondContact O-N 3.36Å
148	S	86.4	Confident	88.5	Confident	14 Å²	14	62.4 Å²	62.4	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	133.1	174.6	-178.1	0	0	0	0	110.6	W117 G150	W117-S148 VanDerWaalsContact O-CB 3.28Å; W117-S148 WeakPolarHBondContact O-CB 2.81Å; S148-G150 PolarHBondContact O-N 2.85Å; S148-G150 PolarHBondContact OG-N 3.41Å
149	K	87	Confident	88.3	Confident	108 Å²	108	63.1 Å²	63.1	47%	0.47	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	1.7	173.4	-62.4	-173.7	177.2	-177	0	112.5	K140 Q147 Y151	K140-K149 VanDerWaalsContact O-CB 3.32Å; K140-K149 WeakPolarHBondContact O-CB 3.39Å; K140-K149 PolarHBondContact O-N 3.41Å; Q147-K149 PolarHBondContact O-N 3.36Å; K149-Y151 VanDerWaalsContact C-N 3.3Å; K149-Y151 HydrophobicContact CB-CD1 3.66Å; K149-Y151 HydrophobicContact CB-CE1 3.43Å; K149-Y151 VanDerWaalsContact CB-CE1 3.43Å; K149-Y151 HydrophobicContact CD-CE1 3.83Å; K149-Y151 HydrophobicContact CG-CE1 4.27Å; K149-Y151 PolarHBondContact O-N 2.84Å
150	G	85.8	Confident	87.9	Confident	8 Å²	8	67.5 Å²	67.5	8%	0.082	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.5	21.4	-178.4	0	0	0	0	0	113.7	N114 L115 S148	N114-G150 PolarHBondContact N-O 2.88Å; L115-G150 PolarHBondContact N-O 2.62Å; S148-G150 PolarHBondContact O-N 2.85Å; S148-G150 PolarHBondContact OG-N 3.41Å
151	Y	91.2	Very high	87.8	Confident	71 Å²	71	64.7 Å²	64.7	28%	0.278	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.2	170.5	73.9	-83.6	0	0	0	112.1	I111 V112 L113 K140 K149 F153	I111-Y151 HydrophobicContact CD1-CD2 3.99Å; I111-Y151 HydrophobicContact CG1-CD2 4.32Å; V112-Y151 CarbonylContact O-C 3.56Å; V112-Y151 WeakPolarHBondContact O-CA 3.2Å; V112-Y151 VanDerWaalsContact O-CB 3.31Å; V112-Y151 WeakPolarHBondContact O-CB 3.48Å; L113-Y151 HydrophobicContact CD2-CG 4.47Å; K140-Y151 HydrophobicContact CB-CD2 4.22Å; K140-Y151 HydrophobicContact CB-CE1 4.11Å; K140-Y151 HydrophobicContact CB-CE2 3.72Å; K140-Y151 HydrophobicContact CG-CD2 4.14Å; K140-Y151 HydrophobicContact CG-CE2 3.5Å; K140-Y151 VanDerWaalsContact CG-CE2 3.5Å; K140-Y151 PolarHBondContact N-O 3.26Å; K149-Y151 VanDerWaalsContact C-N 3.3Å; K149-Y151 HydrophobicContact CB-CD1 3.66Å; K149-Y151 HydrophobicContact CB-CE1 3.43Å; K149-Y151 VanDerWaalsContact CB-CE1 3.43Å; K149-Y151 HydrophobicContact CD-CE1 3.83Å; K149-Y151 HydrophobicContact CG-CE1 4.27Å; K149-Y151 PolarHBondContact O-N 2.84Å; Y151-F153 HydrophobicContact CD2-CE2 4.23Å; Y151-F153 AromaticContact CE2-CE2 3.93Å; Y151-F153 HydrophobicContact CE2-CE2 3.93Å; Y151-F153 HydrophobicContact CE2-CZ 4.38Å
152	G	91.8	Very high	87.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	176.6	179.9	0	0	0	0	0	111.9	I111 V112 Q138	I111-G152 WeakPolarHBondContact CA-O 3.34Å; V112-G152 PolarHBondContact N-O 3.06Å; V112-G152 PolarHBondContact O-N 2.82Å; Q138-G152 CarbonylContact O-C 3.4Å; Q138-G152 WeakPolarHBondContact O-CA 3.08Å
153	F	93.1	Very high	87.5	Confident	40 Å²	40	59.1 Å²	59.1	18%	0.175	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.5	175.1	-64.1	-90.4	0	0	0	109.7	L110 I111 I137 Q138 K140 Y151 P182	L110-F153 CarbonylContact O-C 3.52Å; L110-F153 WeakPolarHBondContact O-CA 3.48Å; I111-F153 HydrophobicContact CB-CD1 4.06Å; I111-F153 HydrophobicContact CB-CE1 3.83Å; I111-F153 HydrophobicContact CD1-CE1 4.04Å; I111-F153 HydrophobicContact CD1-CZ 3.94Å; I111-F153 HydrophobicContact CG1-CD1 4.38Å; I111-F153 HydrophobicContact CG1-CE1 3.98Å; I111-F153 HydrophobicContact CG1-CZ 4.2Å; I137-F153 CarbonylContact C-O 3.54Å; I137-F153 WeakPolarHBondContact CA-O 3.15Å; Q138-F153 PolarHBondContact N-O 2.75Å; Q138-F153 PolarHBondContact O-N 3.29Å; K140-F153 HydrophobicContact CD-CE2 4.48Å; K140-F153 HydrophobicContact CG-CD2 4.22Å; K140-F153 HydrophobicContact CG-CE2 3.95Å; Y151-F153 HydrophobicContact CD2-CE2 4.23Å; Y151-F153 AromaticContact CE2-CE2 3.93Å; Y151-F153 HydrophobicContact CE2-CE2 3.93Å; Y151-F153 HydrophobicContact CE2-CZ 4.38Å; F153-P182 HydrophobicContact CD1-CG 4.41Å; F153-P182 HydrophobicContact CE1-CB 3.99Å; F153-P182 HydrophobicContact CE1-CG 4.13Å
154	I	93.5	Very high	87.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.1	174.2	63.5	176	0	0	0	109.6	D109 L110 V112 L124 F128 L134 M136 I137 F156	D109-I154 CarbonylContact C-O 3.52Å; D109-I154 WeakPolarHBondContact CA-O 3.43Å; L110-I154 HydrophobicContact CB-CG1 3.83Å; L110-I154 HydrophobicContact CD1-CD1 4.46Å; L110-I154 HydrophobicContact CD1-CG1 4.46Å; L110-I154 PolarHBondContact N-O 2.91Å; L110-I154 PolarHBondContact O-N 3.49Å; V112-I154 HydrophobicContact CG2-CD1 3.81Å; V112-I154 HydrophobicContact CG2-CG1 3.89Å; V112-I154 HydrophobicContact CG2-CG2 4.09Å; L124-I154 HydrophobicContact CD2-CG2 4.17Å; F128-I154 HydrophobicContact CB-CD1 4.36Å; F128-I154 HydrophobicContact CD1-CD1 3.73Å; F128-I154 HydrophobicContact CD2-CD1 3.83Å; F128-I154 HydrophobicContact CD2-CG2 4.37Å; F128-I154 HydrophobicContact CE1-CD1 3.9Å; F128-I154 HydrophobicContact CE2-CD1 4Å; F128-I154 HydrophobicContact CG-CD1 3.71Å; F128-I154 HydrophobicContact CZ-CD1 4.04Å; L134-I154 HydrophobicContact CD2-CB 4.08Å; M136-I154 CarbonylContact O-C 3.55Å; M136-I154 VanDerWaalsContact O-CA 3.29Å; M136-I154 WeakPolarHBondContact O-CA 3.35Å; I137-I154 HydrophobicContact CG2-CG2 4.38Å; I154-F156 HydrophobicContact CD1-CE2 3.92Å; I154-F156 HydrophobicContact CD1-CZ 4.2Å
155	R	89.9	Confident	87.8	Confident	88 Å²	88	52.8 Å²	52.8	33%	0.332	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.7	172.6	-175.7	177.7	57.9	-158.2	3.3	109.4	C107 D109 L134 V135 M136	C107-R155 HydrophobicContact CB-CG 4.27Å; D109-R155 VanDerWaalsContact OD1-CD 3.32Å; D109-R155 WeakPolarHBondContact OD1-CD 3.42Å; D109-R155 IonicContact OD1-NH1 3.79Å; L134-R155 CarbonylContact C-O 3.44Å; V135-R155 PolarHBondContact N-O 3.18Å; M136-R155 HydrophobicContact CB-CB 3.76Å; M136-R155 PolarHBondContact N-O 3.21Å; M136-R155 PolarHBondContact O-N 3.26Å
156	F	91.6	Very high	87.7	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	153.5	173.7	-71.5	-77.7	0	0	0	111.7	C107 L110 F128 D133 L134 I154 A161 Q162 C165	C107-F156 WeakPolarHBondContact CB-O 3.27Å; C107-F156 PolarHBondContact SG-O 3.18Å; L110-F156 HydrophobicContact CD1-CD2 4.17Å; L110-F156 HydrophobicContact CD1-CE2 3.93Å; F128-F156 HydrophobicContact CB-CE1 4.47Å; F128-F156 HydrophobicContact CB-CZ 4.14Å; F128-F156 HydrophobicContact CD1-CZ 4.36Å; D133-F156 CarbonylContact O-C 3.52Å; D133-F156 WeakPolarHBondContact O-CA 3.44Å; L134-F156 HydrophobicContact CD2-CD1 3.77Å; L134-F156 HydrophobicContact CD2-CE1 3.56Å; L134-F156 HydrophobicContact CD2-CE2 4.4Å; L134-F156 HydrophobicContact CD2-CG 4.29Å; L134-F156 HydrophobicContact CD2-CZ 3.91Å; L134-F156 HydrophobicContact CG-CD1 4.35Å; L134-F156 HydrophobicContact CG-CE1 4.15Å; I154-F156 HydrophobicContact CD1-CE2 3.92Å; I154-F156 HydrophobicContact CD1-CZ 4.2Å; F156-A161 HydrophobicContact CB-CB 4.08Å; F156-A161 HydrophobicContact CD1-CB 3.64Å; F156-A161 HydrophobicContact CE1-CB 4.22Å; F156-A161 HydrophobicContact CG-CB 3.89Å; F156-Q162 HydrophobicContact CB-CB 4.48Å; F156-Q162 HydrophobicContact CD2-CB 4.12Å; F156-C165 HydrophobicContact CE2-CB 3.57Å; F156-C165 HydrophobicContact CZ-CB 3.81Å
157	A	87.7	Confident	87.7	Confident	46 Å²	46	47.3 Å²	47.3	38%	0.38	24%	0.242	S	C	.	.	S	Bend	trans	-69.9	-41.5	169.9	0	0	0	0	0	110.6	C107 D133 V135	C107-A157 VanDerWaalsContact SG-C 3.53Å; C107-A157 PolarHBondContact SG-O 2.81Å; D133-A157 HydrophobicContact CB-CB 4.08Å; D133-A157 PolarHBondContact O-N 3.46Å; V135-A157 VanDerWaalsContact CG2-CA 3.46Å; V135-A157 HydrophobicContact CG2-CB 3.62Å
158	D	85.3	Confident	87.5	Confident	97 Å²	97	46.8 Å²	46.8	52%	0.519	24%	0.239	S	C	.	.	S	Bend	trans	-107.3	138	-176.6	-69	-36	0	0	0	112.9	T160 A161 Q162	D158-T160 PolarHBondContact O-N 3.2Å; D158-A161 HydrophobicContact CB-CB 4.35Å; D158-A161 WeakPolarHBondContact O-CB 3.06Å; D158-A161 PolarHBondContact O-N 2.83Å; D158-Q162 PolarHBondContact O-N 3.03Å
159	Y	84.6	Confident	87.4	Confident	88 Å²	88	54.8 Å²	54.8	35%	0.345	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-33.5	176.8	179.2	-102.1	0	0	0	111.4	C107 A161 Q162 V163	C107-Y159 PolarHBondContact SG-N 3.13Å; Y159-A161 VanDerWaalsContact C-N 3.34Å; Y159-A161 PolarHBondContact O-N 3.36Å; Y159-Q162 WeakPolarHBondContact O-CB 3.23Å; Y159-Q162 PolarHBondContact O-N 3.44Å; Y159-V163 HydrophobicContact CD1-CG2 4.1Å; Y159-V163 HydrophobicContact CE1-CG2 3.59Å; Y159-V163 HydrophobicContact CE2-CG2 4.29Å; Y159-V163 WeakPolarHBondContact O-CG2 3.37Å; Y159-V163 PolarHBondContact O-N 3.04Å
160	T	85.2	Confident	87.5	Confident	103 Å²	103	49.8 Å²	49.8	63%	0.632	25%	0.246	S	C	*	.	H	α-helix	trans	-60	-43.7	176	-49.6	0	0	0	0	111.5	D158 Q162 V163 M164	D158-T160 PolarHBondContact O-N 3.2Å; T160-Q162 VanDerWaalsContact C-N 3.32Å; T160-Q162 PolarHBondContact O-N 2.79Å; T160-V163 PolarHBondContact O-N 3.06Å; T160-M164 WeakPolarHBondContact O-CG 3.38Å; T160-M164 PolarHBondContact O-N 2.76Å
161	A	87.5	Confident	87.6	Confident	5 Å²	5	52.6 Å²	52.6	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-40	176.9	0	0	0	0	0	111.5	Y131 F156 D158 Y159 V163 M164 C165	Y131-A161 VanDerWaalsContact O-CB 3.23Å; Y131-A161 WeakPolarHBondContact O-CB 3.27Å; F156-A161 HydrophobicContact CB-CB 4.08Å; F156-A161 HydrophobicContact CD1-CB 3.64Å; F156-A161 HydrophobicContact CE1-CB 4.22Å; F156-A161 HydrophobicContact CG-CB 3.89Å; D158-A161 HydrophobicContact CB-CB 4.35Å; D158-A161 WeakPolarHBondContact O-CB 3.06Å; D158-A161 PolarHBondContact O-N 2.83Å; Y159-A161 VanDerWaalsContact C-N 3.34Å; Y159-A161 PolarHBondContact O-N 3.36Å; A161-V163 PolarHBondContact O-N 3.09Å; A161-M164 PolarHBondContact O-N 2.8Å; A161-C165 WeakPolarHBondContact O-CB 3.46Å; A161-C165 PolarHBondContact O-N 2.79Å
162	Q	87.3	Confident	87.5	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.019	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-45.6	175.4	-170.3	-168.3	-43.9	0	0	112.4	C107 T108 L110 F156 D158 Y159 T160 C165 L166	C107-Q162 VanDerWaalsContact CA-OE1 3.27Å; T108-Q162 PolarHBondContact O-OE1 2.88Å; T108-Q162 PolarHBondContact OG1-NE2 2.99Å; T108-Q162 PolarHBondContact OG1-OE1 2.84Å; L110-Q162 HydrophobicContact CD1-CG 3.82Å; L110-Q162 HydrophobicContact CD2-CG 3.74Å; L110-Q162 HydrophobicContact CG-CG 3.96Å; F156-Q162 HydrophobicContact CB-CB 4.48Å; F156-Q162 HydrophobicContact CD2-CB 4.12Å; D158-Q162 PolarHBondContact O-N 3.03Å; Y159-Q162 WeakPolarHBondContact O-CB 3.23Å; Y159-Q162 PolarHBondContact O-N 3.44Å; T160-Q162 VanDerWaalsContact C-N 3.32Å; T160-Q162 PolarHBondContact O-N 2.79Å; Q162-C165 PolarHBondContact O-N 2.9Å; Q162-L166 HydrophobicContact CG-CD1 4.27Å; Q162-L166 WeakPolarHBondContact O-CG 3.37Å; Q162-L166 PolarHBondContact O-N 2.78Å
163	V	83.9	Confident	87.1	Confident	26 Å²	26	54.6 Å²	54.6	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-44.6	-180	172	0	0	0	0	111.1	Y159 T160 A161 C165 L166 A167 P392	Y159-V163 HydrophobicContact CD1-CG2 4.1Å; Y159-V163 HydrophobicContact CE1-CG2 3.59Å; Y159-V163 HydrophobicContact CE2-CG2 4.29Å; Y159-V163 WeakPolarHBondContact O-CG2 3.37Å; Y159-V163 PolarHBondContact O-N 3.04Å; T160-V163 PolarHBondContact O-N 3.06Å; A161-V163 PolarHBondContact O-N 3.09Å; V163-C165 VanDerWaalsContact C-N 3.33Å; V163-C165 PolarHBondContact O-N 3.01Å; V163-L166 PolarHBondContact O-N 2.89Å; V163-A167 PolarHBondContact O-N 3.14Å; V163-A167 VanDerWaalsContact O-N 3.1Å; V163-P392 HydrophobicContact CG1-CB 4.12Å
164	M	86.2	Confident	86.6	Confident	91 Å²	91	60.7 Å²	60.7	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-43.3	176.4	-67.8	-64	-70	0	0	111.6	Y131 T160 A161 L166 A167	Y131-M164 HydrophobicContact CD1-CB 4.13Å; T160-M164 WeakPolarHBondContact O-CG 3.38Å; T160-M164 PolarHBondContact O-N 2.76Å; A161-M164 PolarHBondContact O-N 2.8Å; M164-L166 PolarHBondContact O-N 3.48Å; M164-A167 PolarHBondContact O-N 3.43Å
165	C	89.3	Confident	86.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-40.4	175.9	-176	0	0	0	0	112	L110 F128 Y131 F156 A161 Q162 V163 A167 H170	L110-C165 HydrophobicContact CD1-CB 4.42Å; F128-C165 VanDerWaalsContact CE1-SG 3.59Å; Y131-C165 HydrophobicContact CD2-CB 4.33Å; Y131-C165 HydrophobicContact CG-CB 4.28Å; F156-C165 HydrophobicContact CE2-CB 3.57Å; F156-C165 HydrophobicContact CZ-CB 3.81Å; A161-C165 WeakPolarHBondContact O-CB 3.46Å; A161-C165 PolarHBondContact O-N 2.79Å; Q162-C165 PolarHBondContact O-N 2.9Å; V163-C165 VanDerWaalsContact C-N 3.33Å; V163-C165 PolarHBondContact O-N 3.01Å; C165-A167 VanDerWaalsContact C-N 3.27Å; C165-A167 PolarHBondContact O-N 3.3Å; C165-H170 PolarHBondContact O-CE1 2.77Å; C165-H170 PolarHBondContact O-NE2 3.24Å
166	L	86.8	Confident	86	Confident	42 Å²	42	67 Å²	67	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-70.7	-23.4	179	-76.5	169.4	0	0	0	113.5	L110 Q162 V163 M164 V179 I181	L110-L166 HydrophobicContact CD1-CD2 4.37Å; L110-L166 HydrophobicContact CD1-CG 4.19Å; L110-L166 HydrophobicContact CD2-CD1 3.98Å; L110-L166 HydrophobicContact CD2-CD2 4.03Å; L110-L166 HydrophobicContact CD2-CG 4.12Å; Q162-L166 HydrophobicContact CG-CD1 4.27Å; Q162-L166 WeakPolarHBondContact O-CG 3.37Å; Q162-L166 PolarHBondContact O-N 2.78Å; V163-L166 PolarHBondContact O-N 2.89Å; M164-L166 PolarHBondContact O-N 3.48Å; L166-V179 HydrophobicContact CD2-CG1 4.26Å; L166-I181 HydrophobicContact CD1-CD1 4.05Å; L166-I181 HydrophobicContact CD1-CG1 3.92Å; L166-I181 HydrophobicContact CD2-CG1 4.47Å
167	A	83.9	Confident	85.9	Confident	35 Å²	35	67.4 Å²	67.4	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-76.3	-25.7	-179.6	0	0	0	0	0	113.4	V163 M164 C165 A396	V163-A167 PolarHBondContact O-N 3.14Å; V163-A167 VanDerWaalsContact O-N 3.1Å; M164-A167 PolarHBondContact O-N 3.43Å; C165-A167 VanDerWaalsContact C-N 3.27Å; C165-A167 PolarHBondContact O-N 3.3Å; A167-A396 HydrophobicContact CB-CB 3.47Å; A167-A396 VanDerWaalsContact CB-CB 3.47Å
168	E	80.4	Confident	85.8	Confident	115 Å²	115	69.2 Å²	69.2	54%	0.537	34%	0.343	S	S	.	.	S	Bend	trans	-103.2	154.3	-171.8	-165.7	143.4	-141	0	0	113.4	Y131 H170	Y131-E168 WeakPolarHBondContact CE1-OE2 3.49Å; Y131-E168 PolarHBondContact OH-OE2 3.28Å; E168-H170 PolarHBondContact O-CD2 2.89Å; E168-H170 VanDerWaalsContact O-CD2 3.25Å; E168-H170 PolarHBondContact O-NE2 2.99Å
169	R	84.1	Confident	86	Confident	183 Å²	183	65.2 Å²	65.2	69%	0.691	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-87.7	126.8	170.8	-73.3	-175.3	168.9	-168.2	-5.9	109.9
170	H	88.5	Confident	86	Confident	3 Å²	3	66 Å²	66	1%	0.014	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.4	-175.7	-59.1	-72.6	0	0	0	110.9	Y127 F128 Y131 C165 E168 Q176 C177 V179	Y127-H170 HydrophobicContact CE1-CB 3.87Å; Y127-H170 AromaticContact CE1-ND1 3.5Å; Y127-H170 WeakPolarHBondContact CE1-ND1 3.48Å; Y127-H170 WeakPolarHBondContact OH-CA 3.5Å; F128-H170 AromaticContact CE1-CE1 3.87Å; F128-H170 AromaticContact CE1-CG 3.83Å; F128-H170 AromaticContact CE1-ND1 3.57Å; Y131-H170 AromaticContact CE2-CE1 3.53Å; Y131-H170 AromaticContact CE2-ND1 3.82Å; Y131-H170 AromaticContact CZ-CE1 3.61Å; Y131-H170 PolarHBondContact OH-CE1 3.49Å; C165-H170 PolarHBondContact O-CE1 2.77Å; C165-H170 PolarHBondContact O-NE2 3.24Å; E168-H170 PolarHBondContact O-CD2 2.89Å; E168-H170 VanDerWaalsContact O-CD2 3.25Å; E168-H170 PolarHBondContact O-NE2 2.99Å; H170-Q176 CarbonylContact O-C 3.59Å; H170-Q176 WeakPolarHBondContact O-CA 3.22Å; H170-C177 HydrophobicContact CB-CB 4.12Å; H170-C177 PolarHBondContact O-N 2.84Å; H170-V179 HydrophobicContact CB-CG2 4.41Å; H170-V179 WeakPolarHBondContact CD2-CG2 3.44Å
171	T	88.8	Confident	85.9	Confident	66 Å²	66	64.6 Å²	64.6	41%	0.405	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	113.9	172.9	-58.2	0	0	0	0	108.9	Y127 R175	Y127-T171 VanDerWaalsContact CE2-O 3.25Å; Y127-T171 WeakPolarHBondContact CE2-O 3.19Å; Y127-T171 PolarHBondContact OH-N 3.2Å; Y127-T171 PolarHBondContact OH-O 3.24Å; T171-R175 WeakPolarHBondContact CA-O 3.37Å
172	I	88.2	Confident	85.4	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.6	-177.2	-56.8	176.3	0	0	0	107.3	L115 P116 T123 Y127 F128 N174 R175 C177	L115-I172 HydrophobicContact CD2-CD1 3.88Å; P116-I172 HydrophobicContact CG-CG2 4.29Å; P116-I172 WeakPolarHBondContact CG-O 3.49Å; T123-I172 HydrophobicContact CG2-CG2 4.03Å; Y127-I172 HydrophobicContact CD1-CD1 3.82Å; Y127-I172 HydrophobicContact CD1-CG1 3.76Å; Y127-I172 HydrophobicContact CD2-CG1 4.16Å; Y127-I172 HydrophobicContact CE1-CD1 4.22Å; Y127-I172 HydrophobicContact CE1-CG1 3.87Å; Y127-I172 HydrophobicContact CE2-CG1 4.27Å; Y127-I172 HydrophobicContact CG-CD1 4.21Å; Y127-I172 HydrophobicContact CG-CG1 3.9Å; F128-I172 HydrophobicContact CE2-CD1 3.89Å; F128-I172 HydrophobicContact CZ-CD1 4.15Å; I172-N174 VanDerWaalsContact C-N 3.32Å; I172-N174 PolarHBondContact O-N 3.06Å; I172-R175 PolarHBondContact N-O 2.86Å; I172-R175 WeakPolarHBondContact O-CB 3.38Å; I172-R175 PolarHBondContact O-N 2.88Å; I172-C177 HydrophobicContact CD1-CB 4.41Å
173	E	83	Confident	84.4	Confident	109 Å²	109	71.7 Å²	71.7	51%	0.509	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	44.7	-178.8	-56.5	-173.4	144.4	0	0	114.4	P116 R175	P116-E173 WeakPolarHBondContact CB-OE2 3.48Å; P116-E173 HydrophobicContact CG-CB 3.93Å; P116-E173 HydrophobicContact CG-CG 4.33Å; E173-R175 PolarHBondContact O-N 2.77Å
174	N	83.8	Confident	83.1	Confident	167 Å²	167	74.5 Å²	74.5	89%	0.893	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	16.4	-176.3	-52.8	-37.1	0	0	0	115.3	I172	I172-N174 VanDerWaalsContact C-N 3.32Å; I172-N174 PolarHBondContact O-N 3.06Å
175	R	85.3	Confident	81.3	Confident	93 Å²	93	79.9 Å²	79.9	35%	0.351	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.5	174.9	-164	171.4	-179.4	149.6	-1.4	110.6	N114 P116 T171 I172 E173 C177	N114-R175 WeakPolarHBondContact O-CD 3.45Å; N114-R175 PolarHBondContact O-NE 2.9Å; N114-R175 VanDerWaalsContact OD1-CZ 3.28Å; N114-R175 PolarHBondContact OD1-NE 2.81Å; N114-R175 PolarHBondContact OD1-NH2 3.29Å; P116-R175 HydrophobicContact CG-CB 4.18Å; T171-R175 WeakPolarHBondContact CA-O 3.37Å; I172-R175 PolarHBondContact N-O 2.86Å; I172-R175 WeakPolarHBondContact O-CB 3.38Å; I172-R175 PolarHBondContact O-N 2.88Å; E173-R175 PolarHBondContact O-N 2.77Å; R175-C177 PolarHBondContact O-N 2.81Å; R175-C177 PolarHBondContact O-SG 2.81Å
176	Q	85.5	Confident	79.2	Confident	128 Å²	128	87.7 Å²	87.7	60%	0.598	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	121.4	175.7	-68	-172.3	-54.4	0	0	110.1	N114 H170	N114-Q176 PolarHBondContact ND2-O 2.81Å; H170-Q176 CarbonylContact O-C 3.59Å; H170-Q176 WeakPolarHBondContact O-CA 3.22Å
177	C	89.1	Confident	76.9	Confident	10 Å²	10	95.2 Å²	95.2	7%	0.068	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.3	179.4	-60.4	0	0	0	0	109.4	V112 L113 H170 I172 R175	V112-C177 HydrophobicContact CG1-CB 4.15Å; L113-C177 WeakPolarHBondContact O-CA 3.37Å; H170-C177 HydrophobicContact CB-CB 4.12Å; H170-C177 PolarHBondContact O-N 2.84Å; I172-C177 HydrophobicContact CD1-CB 4.41Å; R175-C177 PolarHBondContact O-N 2.81Å; R175-C177 PolarHBondContact O-SG 2.81Å
178	D	85.3	Confident	74.8	Confident	83 Å²	83	96.7 Å²	96.7	44%	0.444	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.3	-179.9	-179.7	26.3	0	0	0	109.1	L113	L113-D178 HydrophobicContact CB-CB 4.25Å; L113-D178 PolarHBondContact N-O 3.07Å; L113-D178 PolarHBondContact O-N 3.1Å
179	V	89.2	Confident	72.8	Confident	13 Å²	13	98 Å²	98	8%	0.079	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.4	-179.1	-177.8	0	0	0	0	108.5	L110 I111 V112 F128 L166 H170	L110-V179 HydrophobicContact CB-CG1 3.95Å; L110-V179 HydrophobicContact CD1-CG1 3.72Å; L110-V179 HydrophobicContact CG-CG1 4.43Å; I111-V179 WeakPolarHBondContact O-CA 3.47Å; V112-V179 HydrophobicContact CB-CG2 4.42Å; V112-V179 HydrophobicContact CG1-CG2 3.97Å; V112-V179 HydrophobicContact CG2-CG2 4.09Å; F128-V179 HydrophobicContact CE1-CG2 3.87Å; F128-V179 HydrophobicContact CZ-CG2 3.77Å; L166-V179 HydrophobicContact CD2-CG1 4.26Å; H170-V179 HydrophobicContact CB-CG2 4.41Å; H170-V179 WeakPolarHBondContact CD2-CG2 3.44Å
180	R	84.4	Confident	70.8	Confident	106 Å²	106	99.8 Å²	99.8	40%	0.4	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	166.2	-179.2	65.7	-171.8	-166.4	-171.7	4.5	111.9	L110 I111	L110-R180 WeakPolarHBondContact CA-O 3.36Å; I111-R180 HydrophobicContact CG2-CG 3.44Å; I111-R180 VanDerWaalsContact CG2-CG 3.44Å; I111-R180 WeakPolarHBondContact CG2-O 3.25Å; I111-R180 PolarHBondContact N-O 2.91Å; I111-R180 PolarHBondContact O-N 2.99Å
181	I	84.1	Confident	68.6	Low	73 Å²	73	107.4 Å²	107.4	37%	0.374	54%	0.536	S	S	.	.			trans	-73.9	123.7	169.9	-59.1	175.2	0	0	0	107.8	L110 L166 I183	L110-I181 HydrophobicContact CD2-CG1 3.9Å; L166-I181 HydrophobicContact CD1-CD1 4.05Å; L166-I181 HydrophobicContact CD1-CG1 3.92Å; L166-I181 HydrophobicContact CD2-CG1 4.47Å; I181-I183 PolarHBondContact O-N 3.48Å
182	P	76.1	Confident	66.8	Low	36 Å²	36	110.6 Å²	110.6	23%	0.234	55%	0.547	C	S	.	.			trans	-64.7	130.3	177.1	24	-27.1	0	0	0	109.5	D109 I111 F153 S184	D109-P182 WeakPolarHBondContact O-CD 3.19Å; D109-P182 WeakPolarHBondContact O-CG 3.4Å; I111-P182 HydrophobicContact CB-CB 4.07Å; I111-P182 HydrophobicContact CB-CG 4.46Å; I111-P182 HydrophobicContact CG2-CB 3.94Å; F153-P182 HydrophobicContact CD1-CG 4.41Å; F153-P182 HydrophobicContact CE1-CB 3.99Å; F153-P182 HydrophobicContact CE1-CG 4.13Å; P182-S184 PolarHBondContact O-N 3.29Å
183	I	66.5	Low	65.1	Low	122 Å²	122	114.6 Å²	114.6	63%	0.626	57%	0.571	S	S	*	*			trans	-69.1	105.8	171.2	-55.6	171.5	0	0	0	106.1	I181 K185	I181-I183 PolarHBondContact O-N 3.48Å; I183-K185 PolarHBondContact O-N 3.41Å
184	S	55.9	Low	64.1	Low	85 Å²	85	111.2 Å²	111.2	59%	0.594	56%	0.559	S	S	*	*			trans	-60.8	130.5	174.4	55.6	0	0	0	0	108	P182 M186	P182-S184 PolarHBondContact O-N 3.29Å; S184-M186 PolarHBondContact O-N 2.99Å
185	K	48.9	Very low	63.7	Low	204 Å²	204	109.1 Å²	109.1	89%	0.887	54%	0.539	S	S	*	.			trans	-69.8	61.7	176.8	-62	178.9	-178.3	178.5	0	110	I183 E187	I183-K185 PolarHBondContact O-N 3.41Å; K185-E187 VanDerWaalsContact C-N 3.25Å; K185-E187 PolarHBondContact O-N 3.45Å
186	M	44.7	Very low	63.7	Low	164 Å²	164	108.1 Å²	108.1	81%	0.808	54%	0.537	S	S	*	.			trans	-69.8	96	162.7	-90.6	-169.9	118.4	0	0	107.2	S184 G188	S184-M186 PolarHBondContact O-N 2.99Å; M186-G188 PolarHBondContact O-N 3.27Å; M186-G188 VanDerWaalsContact O-N 3.11Å
187	E	39.7	Very low	63.8	Low	200 Å²	200	102 Å²	102	94%	0.935	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-29.9	106.1	161.8	-137	119.5	-160.3	0	0	110.8	K185	K185-E187 VanDerWaalsContact C-N 3.25Å; K185-E187 PolarHBondContact O-N 3.45Å
188	G	39	Very low	63.8	Low	65 Å²	65	104.2 Å²	104.2	67%	0.67	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	165.2	-53.7	173	0	0	0	0	0	118.2	M186 R190	M186-G188 PolarHBondContact O-N 3.27Å; M186-G188 VanDerWaalsContact O-N 3.11Å; G188-R190 PolarHBondContact O-N 2.93Å
189	D	38.2	Very low	63.9	Low	143 Å²	143	100.2 Å²	100.2	77%	0.765	50%	0.496	S	S	*	.			trans	-98.2	96.3	-166.2	-117	-6.1	0	0	0	113.2
190	R	43.3	Very low	63.9	Low	220 Å²	220	100 Å²	100	83%	0.83	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	132	158.6	-64	154.3	80.1	135.1	-1.6	108.4	G188	G188-R190 PolarHBondContact O-N 2.93Å
191	Q	41.9	Very low	63.9	Low	164 Å²	164	103.3 Å²	103.3	77%	0.766	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	45.1	167.4	-111.8	112.5	1.5	0	0	117.1	V193	Q191-V193 PolarHBondContact O-N 3.43Å; Q191-V193 VanDerWaalsContact O-N 3.13Å
192	E	50.3	Low	64	Low	133 Å²	133	100 Å²	100	62%	0.621	49%	0.492	S	S	*	.			trans	-61.8	120.4	160.4	-84.1	-173.6	165	0	0	109.3	S194	E192-S194 PolarHBondContact O-N 3.23Å
193	V	52.8	Low	64.5	Low	89 Å²	89	100.5 Å²	100.5	54%	0.539	50%	0.495	S	S	.	.			trans	-42.2	93.3	-177.4	-159.8	0	0	0	0	110.3	Q191 R195 P241 A245	Q191-V193 PolarHBondContact O-N 3.43Å; Q191-V193 VanDerWaalsContact O-N 3.13Å; V193-R195 PolarHBondContact O-N 3.07Å; V193-R195 VanDerWaalsContact O-N 3.09Å; V193-P241 HydrophobicContact CB-CB 4.15Å; V193-P241 HydrophobicContact CG1-CB 4.11Å; V193-P241 WeakPolarHBondContact CG1-O 3.13Å; V193-A245 HydrophobicContact CG1-CB 3.59Å
194	S	61.2	Low	65.4	Low	37 Å²	37	102 Å²	102	26%	0.259	50%	0.499	S	S	.	.			trans	-71.2	117.9	-171.3	60.2	0	0	0	0	107.4	E192 K196 A244	E192-S194 PolarHBondContact O-N 3.23Å; S194-K196 CarbonylContact O-C 3.57Å; S194-K196 PolarHBondContact O-N 3.27Å; S194-K196 PolarHBondContact OG-O 3.21Å; S194-A244 VanDerWaalsContact O-CB 3.27Å; S194-A244 WeakPolarHBondContact O-CB 3.29Å
195	R	76.3	Confident	66.7	Low	123 Å²	123	104.6 Å²	104.6	46%	0.464	51%	0.506	S	S	.	.	S	Bend	trans	-49.6	-19.6	165.2	-78	-172.6	-85.7	171.2	-10.2	112.5	V193 T237 F238 D239 P241	V193-R195 PolarHBondContact O-N 3.07Å; V193-R195 VanDerWaalsContact O-N 3.09Å; R195-T237 HydrophobicContact CB-CG2 4.22Å; R195-T237 CarbonylContact O-C 3.49Å; R195-T237 WeakPolarHBondContact O-CA 3.44Å; R195-F238 WeakPolarHBondContact CB-O 3.44Å; R195-F238 WeakPolarHBondContact CD-O 3.37Å; R195-F238 PolarHBondContact O-N 3.42Å; R195-D239 WeakPolarHBondContact CD-O 3.36Å; R195-P241 HydrophobicContact CG-CB 3.86Å
196	K	84.3	Confident	68.4	Low	72 Å²	72	95.1 Å²	95.1	31%	0.313	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	127	174.8	-161.5	164.7	-173.3	158.9	0	111.6	S194 F235 I236 A264	S194-K196 CarbonylContact O-C 3.57Å; S194-K196 PolarHBondContact O-N 3.27Å; S194-K196 PolarHBondContact OG-O 3.21Å; K196-F235 HydrophobicContact CD-CB 4.25Å; K196-F235 HydrophobicContact CD-CD1 4.46Å; K196-F235 HydrophobicContact CG-CB 4.09Å; K196-F235 HydrophobicContact CG-CD1 4.34Å; K196-I236 CarbonylContact C-O 3.5Å; K196-I236 VanDerWaalsContact CA-O 3.23Å; K196-I236 WeakPolarHBondContact CA-O 3.5Å; K196-A264 HydrophobicContact CB-CB 3.91Å; K196-A264 HydrophobicContact CD-CB 4.43Å; K196-A264 HydrophobicContact CG-CB 3.77Å; K196-A264 WeakPolarHBondContact O-CB 3.46Å
197	V	88.1	Confident	70.3	Confident	0 Å²	0	90 Å²	90	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	148.7	169.4	-60.7	0	0	0	0	110.3	I199 F235 I236 F238 A244 L248 V261	V197-I199 HydrophobicContact CG2-CD1 3.77Å; V197-I199 HydrophobicContact CG2-CG1 4.45Å; V197-F235 VanDerWaalsContact O-CA 3.27Å; V197-F235 WeakPolarHBondContact O-CA 3.38Å; V197-I236 HydrophobicContact CG2-CB 3.79Å; V197-I236 PolarHBondContact N-O 3.1Å; V197-I236 PolarHBondContact O-N 3.46Å; V197-F238 HydrophobicContact CG1-CD2 4.41Å; V197-F238 HydrophobicContact CG1-CE2 4.2Å; V197-F238 HydrophobicContact CG2-CD2 4.4Å; V197-F238 HydrophobicContact CG2-CE2 3.74Å; V197-A244 HydrophobicContact CG1-CB 3.72Å; V197-A244 WeakPolarHBondContact CG1-O 3.18Å; V197-L248 HydrophobicContact CG1-CD2 4.24Å; V197-V261 HydrophobicContact CB-CG1 3.96Å; V197-V261 HydrophobicContact CG1-CG1 4.28Å; V197-V261 HydrophobicContact CG2-CG1 4.29Å
198	H	88.6	Confident	72.6	Confident	56 Å²	56	83.7 Å²	83.7	26%	0.259	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.7	171.4	169.2	-90.2	0	0	0	108.9	F233 F235 G262 A264	H198-F233 AromaticContact CD2-CD2 3.95Å; H198-F233 WeakPolarHBondContact NE2-CB 3.44Å; H198-F233 AromaticContact NE2-CD2 3.73Å; H198-F233 AromaticContact NE2-CG 3.62Å; H198-F235 HydrophobicContact CB-CD1 4.14Å; H198-F235 HydrophobicContact CB-CE1 4.05Å; H198-F235 AromaticContact CD2-CE1 3.77Å; H198-G262 PolarHBondContact N-O 2.91Å; H198-G262 PolarHBondContact O-N 3.22Å; H198-A264 HydrophobicContact CB-CB 4.39Å
199	I	89	Confident	75	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	111.3	176.4	-51.9	-55.1	0	0	0	107.8	V197 L211 F215 F233 A234 I236 I259 S260 V261	V197-I199 HydrophobicContact CG2-CD1 3.77Å; V197-I199 HydrophobicContact CG2-CG1 4.45Å; I199-L211 HydrophobicContact CG2-CD2 4.35Å; I199-F215 HydrophobicContact CD1-CE1 4.05Å; I199-F215 HydrophobicContact CD1-CE2 3.95Å; I199-F215 HydrophobicContact CD1-CZ 3.45Å; I199-F215 VanDerWaalsContact CD1-CZ 3.45Å; I199-F215 HydrophobicContact CG1-CE2 4.29Å; I199-F215 HydrophobicContact CG1-CZ 4.27Å; I199-F233 CarbonylContact O-C 3.59Å; I199-F233 WeakPolarHBondContact O-CA 3.44Å; I199-F233 VanDerWaalsContact O-CB 3.24Å; I199-F233 WeakPolarHBondContact O-CB 3.37Å; I199-A234 HydrophobicContact CB-CB 4.28Å; I199-A234 PolarHBondContact N-O 2.8Å; I199-A234 PolarHBondContact O-N 3.19Å; I199-I236 HydrophobicContact CD1-CD1 4.07Å; I199-I236 HydrophobicContact CG1-CD1 3.67Å; I199-I236 HydrophobicContact CG1-CG1 3.86Å; I199-I259 HydrophobicContact CG2-CB 4.05Å; I199-I259 HydrophobicContact CG2-CD1 3.74Å; I199-I259 HydrophobicContact CG2-CG1 4.33Å; I199-S260 CarbonylContact C-O 3.59Å; I199-S260 WeakPolarHBondContact CA-O 3.42Å; I199-V261 HydrophobicContact CD1-CB 4.39Å; I199-V261 HydrophobicContact CD1-CG1 4.04Å; I199-V261 HydrophobicContact CD1-CG2 3.89Å
200	G	88	Confident	77.4	Confident	8 Å²	8	79.7 Å²	79.7	8%	0.082	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	169.7	174.5	0	0	0	0	0	112.6	L202 S232 I259 S260	G200-L202 PolarHBondContact O-N 2.96Å; G200-S232 CarbonylContact C-O 3.56Å; G200-I259 WeakPolarHBondContact O-CA 3.21Å; G200-S260 PolarHBondContact N-O 2.97Å; G200-S260 PolarHBondContact O-N 3.49Å
201	R	85.6	Confident	79.6	Confident	175 Å²	175	69.2 Å²	69.2	66%	0.66	34%	0.344	S	S	*	.	S	Bend	trans	59.2	32.3	-178.1	-58.4	-176	178.3	166	-0	113.6	S232	R201-S232 PolarHBondContact N-O 3.17Å
202	L	86.4	Confident	81.9	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	33%	0.327	C	S	.	.			trans	-73.7	140.7	172.3	-161.1	71	0	0	0	109.5	G200 I206 L211 I226 F230 S232 A234 I259	G200-L202 PolarHBondContact O-N 2.96Å; L202-I206 HydrophobicContact CD1-CB 3.75Å; L202-I206 HydrophobicContact CD1-CD1 3.59Å; L202-I206 HydrophobicContact CD1-CG1 4.27Å; L202-I206 HydrophobicContact CD1-CG2 3.73Å; L202-I206 HydrophobicContact CG-CB 4.16Å; L202-I206 HydrophobicContact CG-CD1 4.33Å; L202-L211 HydrophobicContact CD1-CD1 4.23Å; L202-L211 HydrophobicContact CD1-CD2 3.82Å; L202-L211 HydrophobicContact CD1-CG 4.31Å; L202-L211 HydrophobicContact CD2-CD1 3.95Å; L202-I226 HydrophobicContact CD2-CD1 4.16Å; L202-F230 HydrophobicContact CB-CE2 4.44Å; L202-F230 HydrophobicContact CB-CZ 4.05Å; L202-F230 HydrophobicContact CD2-CE2 3.95Å; L202-F230 HydrophobicContact CD2-CZ 4.35Å; L202-F230 HydrophobicContact CG-CE2 4.3Å; L202-F230 HydrophobicContact CG-CZ 4.21Å; L202-F230 WeakPolarHBondContact O-CE1 3.25Å; L202-F230 WeakPolarHBondContact O-CZ 3.37Å; L202-S232 PolarHBondContact N-O 2.89Å; L202-S232 VanDerWaalsContact O-CA 3.26Å; L202-S232 WeakPolarHBondContact O-CA 3.26Å; L202-S232 VanDerWaalsContact O-CB 3.24Å; L202-S232 WeakPolarHBondContact O-CB 3.45Å; L202-A234 HydrophobicContact CD2-CB 3.88Å; L202-I259 HydrophobicContact CD1-CG2 4.19Å
203	T	85.6	Confident	83.7	Confident	47 Å²	47	67.4 Å²	67.4	29%	0.288	33%	0.33	S	S	.	.			trans	-91.9	155.8	166.1	52	0	0	0	0	110.3	D205 I206 F230 V257	T203-D205 PolarHBondContact O-N 2.81Å; T203-I206 PolarHBondContact O-N 2.81Å; T203-I206 WeakPolarHBondContact OG1-CD1 3.33Å; T203-F230 VanDerWaalsContact O-CZ 3.29Å; T203-F230 WeakPolarHBondContact O-CZ 3.24Å; T203-V257 HydrophobicContact CG2-CG1 3.82Å; T203-V257 HydrophobicContact CG2-CG2 4.06Å
204	E	84.5	Confident	85.4	Confident	153 Å²	153	65 Å²	65	72%	0.715	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.4	-177.9	-171.1	166.6	-167.2	0	0	112.4	I206 F230	E204-I206 PolarHBondContact O-N 3.23Å; E204-F230 HydrophobicContact CB-CD1 3.98Å; E204-F230 HydrophobicContact CB-CE1 3.98Å; E204-F230 HydrophobicContact CB-CG 4.28Å; E204-F230 HydrophobicContact CB-CZ 4.28Å; E204-F230 HydrophobicContact CG-CD1 4.41Å; E204-F230 HydrophobicContact CG-CG 4.28Å; E204-F230 VanDerWaalsContact N-CZ 3.34Å
205	D	84.3	Confident	86.8	Confident	140 Å²	140	63.2 Å²	63.2	75%	0.749	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.8	177.8	-52.1	-46.2	0	0	0	113.2	T203 S207	T203-D205 PolarHBondContact O-N 2.81Å; D205-S207 PolarHBondContact O-N 2.77Å
206	I	83.7	Confident	87.4	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	30%	0.299	C	S	.	.			trans	-84.3	110	-176.1	-60.1	167.2	0	0	0	109.7	L202 T203 E204 A210 L211 I254 V257 I259	L202-I206 HydrophobicContact CD1-CB 3.75Å; L202-I206 HydrophobicContact CD1-CD1 3.59Å; L202-I206 HydrophobicContact CD1-CG1 4.27Å; L202-I206 HydrophobicContact CD1-CG2 3.73Å; L202-I206 HydrophobicContact CG-CB 4.16Å; L202-I206 HydrophobicContact CG-CD1 4.33Å; T203-I206 PolarHBondContact O-N 2.81Å; T203-I206 WeakPolarHBondContact OG1-CD1 3.33Å; E204-I206 PolarHBondContact O-N 3.23Å; I206-A210 HydrophobicContact CG2-CB 4.1Å; I206-L211 HydrophobicContact CG2-CD2 4.19Å; I206-L211 HydrophobicContact CG2-CG 3.93Å; I206-I254 HydrophobicContact CG2-CG2 4.34Å; I206-V257 HydrophobicContact CD1-CB 3.93Å; I206-V257 HydrophobicContact CD1-CG1 4.1Å; I206-V257 HydrophobicContact CD1-CG2 4.18Å; I206-I259 HydrophobicContact CD1-CG2 4.46Å
207	S	86.5	Confident	87.6	Confident	57 Å²	57	62.5 Å²	62.5	40%	0.399	31%	0.311	S	S	.	.			trans	-71	154.3	176.8	77.7	0	0	0	0	112	D205 E209 A210 L211	D205-S207 PolarHBondContact O-N 2.77Å; S207-E209 PolarHBondContact O-N 3.45Å; S207-A210 WeakPolarHBondContact O-CB 3.49Å; S207-A210 PolarHBondContact O-N 2.91Å; S207-A210 VanDerWaalsContact O-N 3.09Å; S207-A210 PolarHBondContact OG-N 2.84Å; S207-A210 VanDerWaalsContact OG-N 3.09Å; S207-L211 PolarHBondContact O-N 3.44Å; S207-L211 VanDerWaalsContact O-N 3.13Å
208	P	87.6	Confident	87.5	Confident	67 Å²	67	66.5 Å²	66.5	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-27.4	173.6	25.3	-33.9	0	0	0	112.2	L211 R212 V224 I226	P208-L211 PolarHBondContact O-N 3.37Å; P208-R212 WeakPolarHBondContact O-CB 3.33Å; P208-R212 PolarHBondContact O-N 2.89Å; P208-V224 HydrophobicContact CB-CB 4.49Å; P208-V224 HydrophobicContact CB-CG1 3.88Å; P208-I226 HydrophobicContact CB-CD1 3.85Å; P208-I226 HydrophobicContact CB-CG1 4.27Å; P208-I226 HydrophobicContact CG-CD1 4.34Å
209	E	87.8	Confident	87.3	Confident	112 Å²	112	64.7 Å²	64.7	52%	0.523	32%	0.322	S	S	.	.	H	α-helix	trans	-70.3	-39.9	175.3	-164.9	58.3	-144.7	0	0	111.5	S207 L211 R212 Q213	S207-E209 PolarHBondContact O-N 3.45Å; E209-L211 VanDerWaalsContact C-N 3.33Å; E209-L211 PolarHBondContact O-N 3.26Å; E209-R212 WeakPolarHBondContact O-CB 3.23Å; E209-R212 PolarHBondContact O-N 3.29Å; E209-Q213 WeakPolarHBondContact O-CB 3.26Å; E209-Q213 PolarHBondContact O-N 3.35Å
210	A	88.8	Confident	87.2	Confident	12 Å²	12	71.8 Å²	71.8	10%	0.099	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-41.3	174.4	0	0	0	0	0	111.5	I206 S207 H214	I206-A210 HydrophobicContact CG2-CB 4.1Å; S207-A210 WeakPolarHBondContact O-CB 3.49Å; S207-A210 PolarHBondContact O-N 2.91Å; S207-A210 VanDerWaalsContact O-N 3.09Å; S207-A210 PolarHBondContact OG-N 2.84Å; S207-A210 VanDerWaalsContact OG-N 3.09Å; A210-H214 WeakPolarHBondContact O-CB 3.24Å; A210-H214 PolarHBondContact O-N 3.28Å
211	L	89.7	Confident	87.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-49.1	171.3	-73.6	172.8	0	0	0	111.2	I199 L202 I206 S207 P208 E209 Q213 H214 F215 V224 I226 A234 I236 I254	I199-L211 HydrophobicContact CG2-CD2 4.35Å; L202-L211 HydrophobicContact CD1-CD1 4.23Å; L202-L211 HydrophobicContact CD1-CD2 3.82Å; L202-L211 HydrophobicContact CD1-CG 4.31Å; L202-L211 HydrophobicContact CD2-CD1 3.95Å; I206-L211 HydrophobicContact CG2-CD2 4.19Å; I206-L211 HydrophobicContact CG2-CG 3.93Å; S207-L211 PolarHBondContact O-N 3.44Å; S207-L211 VanDerWaalsContact O-N 3.13Å; P208-L211 PolarHBondContact O-N 3.37Å; E209-L211 VanDerWaalsContact C-N 3.33Å; E209-L211 PolarHBondContact O-N 3.26Å; L211-Q213 VanDerWaalsContact C-N 3.33Å; L211-Q213 PolarHBondContact O-N 2.89Å; L211-H214 PolarHBondContact O-N 3.43Å; L211-F215 HydrophobicContact CD2-CD2 4.27Å; L211-F215 HydrophobicContact CD2-CE2 3.84Å; L211-F215 WeakPolarHBondContact O-CB 3.23Å; L211-F215 VanDerWaalsContact O-CD2 3.26Å; L211-F215 WeakPolarHBondContact O-CD2 3.45Å; L211-F215 PolarHBondContact O-N 2.99Å; L211-V224 HydrophobicContact CB-CG1 4.05Å; L211-V224 HydrophobicContact CD1-CG1 4.01Å; L211-I226 HydrophobicContact CD1-CD1 3.95Å; L211-I226 HydrophobicContact CD1-CG1 4.26Å; L211-A234 HydrophobicContact CD1-CB 3.71Å; L211-I236 HydrophobicContact CB-CD1 4.15Å; L211-I236 HydrophobicContact CD2-CD1 4.32Å; L211-I254 HydrophobicContact CD2-CD1 3.75Å
212	R	90.1	Very high	87.2	Confident	111 Å²	111	66.6 Å²	66.6	42%	0.419	34%	0.337	S	S	.	.	H	α-helix	trans	-57.5	-47.7	179.9	-171.3	173.2	-170.4	-85.8	-10.5	111.4	P208 E209 S216 V221 V224	P208-R212 WeakPolarHBondContact O-CB 3.33Å; P208-R212 PolarHBondContact O-N 2.89Å; E209-R212 WeakPolarHBondContact O-CB 3.23Å; E209-R212 PolarHBondContact O-N 3.29Å; R212-S216 WeakPolarHBondContact O-CB 3.24Å; R212-S216 PolarHBondContact O-N 3.34Å; R212-V221 HydrophobicContact CG-CB 4.31Å; R212-V221 HydrophobicContact CG-CG1 4.26Å; R212-V224 HydrophobicContact CB-CG2 3.99Å; R212-V224 HydrophobicContact CG-CG2 4.4Å
213	Q	89.3	Confident	87.1	Confident	148 Å²	148	70.2 Å²	70.2	69%	0.692	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-46.3	-179.8	-172.8	176.7	6.2	0	0	111.7	E209 L211 S216	E209-Q213 WeakPolarHBondContact O-CB 3.26Å; E209-Q213 PolarHBondContact O-N 3.35Å; L211-Q213 VanDerWaalsContact C-N 3.33Å; L211-Q213 PolarHBondContact O-N 2.89Å; Q213-S216 PolarHBondContact O-N 3.41Å
214	H	88.9	Confident	87.2	Confident	38 Å²	38	69.3 Å²	69.3	18%	0.176	35%	0.351	C	S	.	.	H	α-helix	trans	-65.3	-46.6	179.5	-173.5	86.7	0	0	0	111.9	A210 L211 S216 Q217 E253 I254	A210-H214 WeakPolarHBondContact O-CB 3.24Å; A210-H214 PolarHBondContact O-N 3.28Å; L211-H214 PolarHBondContact O-N 3.43Å; H214-S216 VanDerWaalsContact C-N 3.32Å; H214-S216 PolarHBondContact O-N 2.8Å; H214-Q217 WeakPolarHBondContact O-CG 3.03Å; H214-Q217 PolarHBondContact O-N 2.95Å; H214-Q217 PolarHBondContact O-NE2 3.46Å; H214-E253 PolarHBondContact CE1-O 2.78Å; H214-E253 VanDerWaalsContact CE1-O 3.25Å; H214-I254 HydrophobicContact CB-CD1 3.69Å; H214-I254 HydrophobicContact CB-CG1 4.12Å; H214-I254 VanDerWaalsContact CD2-CD1 3.45Å; H214-I254 WeakPolarHBondContact CD2-CD1 3.41Å
215	F	89.3	Confident	87.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-76.9	-19.2	-178.1	-76.7	-77.9	0	0	0	113.6	I199 L211 Q217 Y218 V221 I236 F238 L247 Q252 I254 I259 V261	I199-F215 HydrophobicContact CD1-CE1 4.05Å; I199-F215 HydrophobicContact CD1-CE2 3.95Å; I199-F215 HydrophobicContact CD1-CZ 3.45Å; I199-F215 VanDerWaalsContact CD1-CZ 3.45Å; I199-F215 HydrophobicContact CG1-CE2 4.29Å; I199-F215 HydrophobicContact CG1-CZ 4.27Å; L211-F215 HydrophobicContact CD2-CD2 4.27Å; L211-F215 HydrophobicContact CD2-CE2 3.84Å; L211-F215 WeakPolarHBondContact O-CB 3.23Å; L211-F215 VanDerWaalsContact O-CD2 3.26Å; L211-F215 WeakPolarHBondContact O-CD2 3.45Å; L211-F215 PolarHBondContact O-N 2.99Å; F215-Q217 PolarHBondContact O-N 3.11Å; F215-Q217 VanDerWaalsContact O-N 3.12Å; F215-Y218 HydrophobicContact CD1-CD2 4.12Å; F215-Y218 HydrophobicContact CD1-CE2 4.48Å; F215-Y218 PolarHBondContact O-N 3.12Å; F215-Y218 VanDerWaalsContact O-N 3.11Å; F215-V221 HydrophobicContact CB-CG2 3.87Å; F215-I236 HydrophobicContact CB-CD1 4.1Å; F215-I236 HydrophobicContact CB-CG2 4.46Å; F215-I236 HydrophobicContact CD1-CD1 4.29Å; F215-I236 HydrophobicContact CD2-CD1 3Å; F215-I236 HydrophobicContact CE2-CD1 3.33Å; F215-I236 HydrophobicContact CG-CD1 3.53Å; F215-I236 HydrophobicContact CZ-CD1 4.09Å; F215-F238 HydrophobicContact CB-CE1 4.14Å; F215-F238 HydrophobicContact CB-CZ 3.88Å; F215-F238 AromaticContact CD1-CZ 3.81Å; F215-F238 HydrophobicContact CD1-CZ 3.81Å; F215-F238 HydrophobicContact CG-CZ 4.18Å; F215-L247 HydrophobicContact CD1-CD1 3.94Å; F215-L247 HydrophobicContact CE1-CD1 4.21Å; F215-Q252 HydrophobicContact CE1-CG 4.39Å; F215-Q252 HydrophobicContact CZ-CG 4.48Å; F215-I254 HydrophobicContact CD2-CD1 4.3Å; F215-I254 HydrophobicContact CE2-CD1 3.77Å; F215-I259 HydrophobicContact CE2-CD1 3.72Å; F215-I259 HydrophobicContact CZ-CD1 3.59Å; F215-V261 HydrophobicContact CE1-CG2 4.2Å; F215-V261 HydrophobicContact CZ-CG2 4.15Å
216	S	89.1	Confident	87.6	Confident	61 Å²	61	61.8 Å²	61.8	43%	0.427	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.1	173.1	-167.9	0	0	0	0	113.3	R212 Q213 H214 Y218 G219	R212-S216 WeakPolarHBondContact O-CB 3.24Å; R212-S216 PolarHBondContact O-N 3.34Å; Q213-S216 PolarHBondContact O-N 3.41Å; H214-S216 VanDerWaalsContact C-N 3.32Å; H214-S216 PolarHBondContact O-N 2.8Å; S216-Y218 VanDerWaalsContact C-N 3.33Å; S216-G219 WeakPolarHBondContact CA-O 3.49Å
217	Q	88.4	Confident	87.5	Confident	120 Å²	120	62.5 Å²	62.5	56%	0.561	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-24.1	175	81.6	-165.9	-17.8	0	0	113.4	H214 F215	H214-Q217 WeakPolarHBondContact O-CG 3.03Å; H214-Q217 PolarHBondContact O-N 2.95Å; H214-Q217 PolarHBondContact O-NE2 3.46Å; F215-Q217 PolarHBondContact O-N 3.11Å; F215-Q217 VanDerWaalsContact O-N 3.12Å
218	Y	86.6	Confident	87.4	Confident	84 Å²	84	69.3 Å²	69.3	33%	0.329	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-26.5	-179.2	-63.7	-68.8	0	0	0	112.7	F215 S216 V243 L247 Q252	F215-Y218 HydrophobicContact CD1-CD2 4.12Å; F215-Y218 HydrophobicContact CD1-CE2 4.48Å; F215-Y218 PolarHBondContact O-N 3.12Å; F215-Y218 VanDerWaalsContact O-N 3.11Å; S216-Y218 VanDerWaalsContact C-N 3.33Å; Y218-V243 WeakPolarHBondContact O-CG1 3.47Å; Y218-L247 HydrophobicContact CD1-CD2 3.92Å; Y218-L247 HydrophobicContact CD2-CD1 4.21Å; Y218-L247 HydrophobicContact CD2-CD2 3.63Å; Y218-L247 HydrophobicContact CE1-CD2 4.1Å; Y218-L247 HydrophobicContact CE2-CD2 3.78Å; Y218-L247 HydrophobicContact CG-CD1 4.29Å; Y218-L247 HydrophobicContact CG-CD2 3.7Å; Y218-L247 HydrophobicContact CG-CG 4.42Å; Y218-Q252 PolarHBondContact OH-NE2 3.46Å; Y218-Q252 PolarHBondContact OH-OE1 3.33Å
219	G	85	Confident	87.2	Confident	17 Å²	17	70.4 Å²	70.4	18%	0.175	35%	0.346	C	S	.	.	S	Bend	trans	172.1	177	-179.8	0	0	0	0	0	111	S216 V221	S216-G219 WeakPolarHBondContact CA-O 3.49Å; G219-V221 PolarHBondContact O-N 3.45Å
220	R	86.1	Confident	87.1	Confident	149 Å²	149	68.1 Å²	68.1	56%	0.562	33%	0.334	S	S	*	.			trans	-71	119.7	-176.9	-168.4	-176.2	-168.3	-171	7.6	110.8	F238 D239	R220-F238 WeakPolarHBondContact O-CA 3.35Å; R220-D239 HydrophobicContact CB-CB 3.97Å; R220-D239 WeakPolarHBondContact CD-OD2 3.45Å; R220-D239 HydrophobicContact CG-CB 4.47Å; R220-D239 IonicContact NH1-OD2 2.68Å; R220-D239 PolarHBondContact NH1-OD2 3.44Å; R220-D239 PolarHBondContact O-N 3.06Å
221	V	88.7	Confident	86.9	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.024	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.4	175.2	179.9	0	0	0	0	109.8	R212 F215 G219 V224 I236 F238	R212-V221 HydrophobicContact CG-CB 4.31Å; R212-V221 HydrophobicContact CG-CG1 4.26Å; F215-V221 HydrophobicContact CB-CG2 3.87Å; G219-V221 PolarHBondContact O-N 3.45Å; V221-V224 HydrophobicContact CG1-CG2 3.61Å; V221-I236 HydrophobicContact CG1-CG2 3.7Å; V221-I236 HydrophobicContact CG2-CG2 4.17Å; V221-F238 HydrophobicContact CG2-CD1 4.14Å; V221-F238 HydrophobicContact CG2-CE1 3.77Å
222	C	84.6	Confident	86.7	Confident	70 Å²	70	77.6 Å²	77.6	47%	0.473	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-41.4	178.3	-68.3	0	0	0	0	112.5	T237 D239	C222-T237 WeakPolarHBondContact CA-O 3.42Å; C222-T237 WeakPolarHBondContact CB-O 3.47Å; C222-T237 PolarHBondContact N-O 3.44Å; C222-D239 WeakPolarHBondContact SG-CA 3.49Å; C222-D239 VanDerWaalsContact SG-CB 3.6Å; C222-D239 PolarHBondContact SG-N 3.25Å
223	D	84.3	Confident	86.7	Confident	81 Å²	81	73.9 Å²	73.9	43%	0.433	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.7	-176.1	-178.5	37.8	0	0	0	111.7	I236 T237	D223-I236 CarbonylContact O-C 3.5Å; D223-I236 WeakPolarHBondContact O-CA 3.44Å; D223-T237 PolarHBondContact N-O 2.79Å; D223-T237 PolarHBondContact O-N 2.75Å
224	V	88.9	Confident	86.7	Confident	27 Å²	27	66.9 Å²	66.9	16%	0.164	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116.6	174.1	-179.1	0	0	0	0	108.5	P208 L211 R212 V221 F235 I236	P208-V224 HydrophobicContact CB-CB 4.49Å; P208-V224 HydrophobicContact CB-CG1 3.88Å; L211-V224 HydrophobicContact CB-CG1 4.05Å; L211-V224 HydrophobicContact CD1-CG1 4.01Å; R212-V224 HydrophobicContact CB-CG2 3.99Å; R212-V224 HydrophobicContact CG-CG2 4.4Å; V221-V224 HydrophobicContact CG1-CG2 3.61Å; V224-F235 WeakPolarHBondContact CA-O 3.17Å; V224-I236 HydrophobicContact CG1-CG1 4.37Å; V224-I236 HydrophobicContact CG2-CG1 4.35Å; V224-I236 HydrophobicContact CG2-CG2 4.48Å
225	F	87.2	Confident	86.7	Confident	100 Å²	100	66 Å²	66	44%	0.439	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	115.7	-176.8	179.3	-110.8	0	0	0	111.3	P227 A234 F235	F225-P227 HydrophobicContact CD1-CG 4.12Å; F225-P227 HydrophobicContact CE1-CB 4.21Å; F225-P227 HydrophobicContact CE1-CG 3.66Å; F225-P227 HydrophobicContact CZ-CB 4.45Å; F225-P227 HydrophobicContact CZ-CG 4.35Å; F225-A234 CarbonylContact O-C 3.57Å; F225-A234 WeakPolarHBondContact O-CA 3.45Å; F225-F235 AromaticContact CD1-CD2 3.89Å; F225-F235 HydrophobicContact CD1-CD2 3.89Å; F225-F235 PolarHBondContact N-O 3.1Å; F225-F235 PolarHBondContact O-N 3.01Å
226	I	88.2	Confident	86.7	Confident	35 Å²	35	66 Å²	66	18%	0.179	33%	0.326	C	S	.	.			trans	-108.5	109.8	172.6	-50.1	-176.2	0	0	0	108.2	L202 P208 L211 F230 A234	L202-I226 HydrophobicContact CD2-CD1 4.16Å; P208-I226 HydrophobicContact CB-CD1 3.85Å; P208-I226 HydrophobicContact CB-CG1 4.27Å; P208-I226 HydrophobicContact CG-CD1 4.34Å; L211-I226 HydrophobicContact CD1-CD1 3.95Å; L211-I226 HydrophobicContact CD1-CG1 4.26Å; I226-F230 HydrophobicContact CG2-CD2 4.09Å; I226-F230 HydrophobicContact CG2-CE2 4.27Å; I226-A234 HydrophobicContact CG1-CB 3.83Å
227	P	83.4	Confident	86.6	Confident	19 Å²	19	64.6 Å²	64.6	12%	0.123	32%	0.315	C	S	.	.			trans	-61.4	142.3	177.1	-19.6	30.1	0	0	0	112.3	F225 P229 F233 F235	F225-P227 HydrophobicContact CD1-CG 4.12Å; F225-P227 HydrophobicContact CE1-CB 4.21Å; F225-P227 HydrophobicContact CE1-CG 3.66Å; F225-P227 HydrophobicContact CZ-CB 4.45Å; F225-P227 HydrophobicContact CZ-CG 4.35Å; P227-P229 CarbonylContact O-C 3.53Å; P227-F233 HydrophobicContact CB-CE2 4.5Å; P227-F233 WeakPolarHBondContact CD-O 3.49Å; P227-F233 HydrophobicContact CG-CD2 4.17Å; P227-F233 HydrophobicContact CG-CE2 3.54Å; P227-F233 HydrophobicContact CG-CZ 4Å; P227-F235 HydrophobicContact CG-CE2 4.31Å
228	K	83.9	Confident	86.5	Confident	200 Å²	200	59 Å²	59	87%	0.87	29%	0.289	S	S	*	.	S	Bend	trans	-109.9	138.8	169.6	-63.7	-174.8	-179.7	-177	0	109.6
229	P	83.2	Confident	86.3	Confident	91 Å²	91	57.8 Å²	57.8	59%	0.591	29%	0.288	S	S	*	.	S	Bend	cis	-62.6	153.7	-3.5	29.2	-35.9	0	0	0	111.4	P227 R231	P227-P229 CarbonylContact O-C 3.53Å; P229-R231 WeakPolarHBondContact O-CG 3.44Å; P229-R231 PolarHBondContact O-N 3.19Å
230	F	85.5	Confident	85.9	Confident	64 Å²	64	60.9 Å²	60.9	28%	0.281	30%	0.301	S	S	.	.			trans	-57.7	129.3	-178.4	-175.8	-101.5	0	0	0	110.1	L202 T203 E204 I226	L202-F230 HydrophobicContact CB-CE2 4.44Å; L202-F230 HydrophobicContact CB-CZ 4.05Å; L202-F230 HydrophobicContact CD2-CE2 3.95Å; L202-F230 HydrophobicContact CD2-CZ 4.35Å; L202-F230 HydrophobicContact CG-CE2 4.3Å; L202-F230 HydrophobicContact CG-CZ 4.21Å; L202-F230 WeakPolarHBondContact O-CE1 3.25Å; L202-F230 WeakPolarHBondContact O-CZ 3.37Å; T203-F230 VanDerWaalsContact O-CZ 3.29Å; T203-F230 WeakPolarHBondContact O-CZ 3.24Å; E204-F230 HydrophobicContact CB-CD1 3.98Å; E204-F230 HydrophobicContact CB-CE1 3.98Å; E204-F230 HydrophobicContact CB-CG 4.28Å; E204-F230 HydrophobicContact CB-CZ 4.28Å; E204-F230 HydrophobicContact CG-CD1 4.41Å; E204-F230 HydrophobicContact CG-CG 4.28Å; E204-F230 VanDerWaalsContact N-CZ 3.34Å; I226-F230 HydrophobicContact CG2-CD2 4.09Å; I226-F230 HydrophobicContact CG2-CE2 4.27Å
231	R	83.7	Confident	85.6	Confident	152 Å²	152	56.2 Å²	56.2	57%	0.574	29%	0.29	S	S	*	.			trans	-125.6	23.5	-176.9	-72.9	179.7	-174	-162.3	1.6	112.8	P229 F233	P229-R231 WeakPolarHBondContact O-CG 3.44Å; P229-R231 PolarHBondContact O-N 3.19Å; R231-F233 HydrophobicContact CB-CD1 3.57Å; R231-F233 HydrophobicContact CB-CE1 3.25Å; R231-F233 HydrophobicContact CB-CZ 4.19Å; R231-F233 HydrophobicContact CG-CE1 4.15Å; R231-F233 VanDerWaalsContact O-CD1 3.23Å; R231-F233 WeakPolarHBondContact O-CD1 3.3Å; R231-F233 PolarHBondContact O-N 3.1Å
232	S	86.9	Confident	85.2	Confident	59 Å²	59	63.1 Å²	63.1	41%	0.413	32%	0.322	S	S	.	.	S	Bend	trans	58.7	23.7	-176.4	69.3	0	0	0	0	115	G200 R201 L202	G200-S232 CarbonylContact C-O 3.56Å; R201-S232 PolarHBondContact N-O 3.17Å; L202-S232 PolarHBondContact N-O 2.89Å; L202-S232 VanDerWaalsContact O-CA 3.26Å; L202-S232 WeakPolarHBondContact O-CA 3.26Å; L202-S232 VanDerWaalsContact O-CB 3.24Å; L202-S232 WeakPolarHBondContact O-CB 3.45Å
233	F	88.8	Confident	85.2	Confident	33 Å²	33	60.8 Å²	60.8	15%	0.145	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.6	172.8	71.5	-93.4	0	0	0	113	H198 I199 P227 R231 F235	H198-F233 AromaticContact CD2-CD2 3.95Å; H198-F233 WeakPolarHBondContact NE2-CB 3.44Å; H198-F233 AromaticContact NE2-CD2 3.73Å; H198-F233 AromaticContact NE2-CG 3.62Å; I199-F233 CarbonylContact O-C 3.59Å; I199-F233 WeakPolarHBondContact O-CA 3.44Å; I199-F233 VanDerWaalsContact O-CB 3.24Å; I199-F233 WeakPolarHBondContact O-CB 3.37Å; P227-F233 HydrophobicContact CB-CE2 4.5Å; P227-F233 WeakPolarHBondContact CD-O 3.49Å; P227-F233 HydrophobicContact CG-CD2 4.17Å; P227-F233 HydrophobicContact CG-CE2 3.54Å; P227-F233 HydrophobicContact CG-CZ 4Å; R231-F233 HydrophobicContact CB-CD1 3.57Å; R231-F233 HydrophobicContact CB-CE1 3.25Å; R231-F233 HydrophobicContact CB-CZ 4.19Å; R231-F233 HydrophobicContact CG-CE1 4.15Å; R231-F233 VanDerWaalsContact O-CD1 3.23Å; R231-F233 WeakPolarHBondContact O-CD1 3.3Å; R231-F233 PolarHBondContact O-N 3.1Å; F233-F235 HydrophobicContact CD2-CD2 4.47Å; F233-F235 AromaticContact CD2-CE2 3.91Å; F233-F235 HydrophobicContact CD2-CE2 3.91Å; F233-F235 HydrophobicContact CD2-CZ 4.22Å; F233-F235 HydrophobicContact CE2-CD2 4.47Å; F233-F235 AromaticContact CE2-CE2 3.6Å; F233-F235 HydrophobicContact CE2-CE2 3.6Å; F233-F235 AromaticContact CE2-CZ 3.98Å; F233-F235 HydrophobicContact CE2-CZ 3.98Å
234	A	89.4	Confident	85.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	170.7	175.5	0	0	0	0	0	110.1	I199 L202 L211 F225 I226	I199-A234 HydrophobicContact CB-CB 4.28Å; I199-A234 PolarHBondContact N-O 2.8Å; I199-A234 PolarHBondContact O-N 3.19Å; L202-A234 HydrophobicContact CD2-CB 3.88Å; L211-A234 HydrophobicContact CD1-CB 3.71Å; F225-A234 CarbonylContact O-C 3.57Å; F225-A234 WeakPolarHBondContact O-CA 3.45Å; I226-A234 HydrophobicContact CG1-CB 3.83Å
235	F	89.7	Confident	84.9	Confident	20 Å²	20	57.5 Å²	57.5	9%	0.088	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142	169.6	-59.9	-89.5	0	0	0	110.5	K196 V197 H198 V224 F225 P227 F233 A264	K196-F235 HydrophobicContact CD-CB 4.25Å; K196-F235 HydrophobicContact CD-CD1 4.46Å; K196-F235 HydrophobicContact CG-CB 4.09Å; K196-F235 HydrophobicContact CG-CD1 4.34Å; V197-F235 VanDerWaalsContact O-CA 3.27Å; V197-F235 WeakPolarHBondContact O-CA 3.38Å; H198-F235 HydrophobicContact CB-CD1 4.14Å; H198-F235 HydrophobicContact CB-CE1 4.05Å; H198-F235 AromaticContact CD2-CE1 3.77Å; V224-F235 WeakPolarHBondContact CA-O 3.17Å; F225-F235 AromaticContact CD1-CD2 3.89Å; F225-F235 HydrophobicContact CD1-CD2 3.89Å; F225-F235 PolarHBondContact N-O 3.1Å; F225-F235 PolarHBondContact O-N 3.01Å; P227-F235 HydrophobicContact CG-CE2 4.31Å; F233-F235 HydrophobicContact CD2-CD2 4.47Å; F233-F235 AromaticContact CD2-CE2 3.91Å; F233-F235 HydrophobicContact CD2-CE2 3.91Å; F233-F235 HydrophobicContact CD2-CZ 4.22Å; F233-F235 HydrophobicContact CE2-CD2 4.47Å; F233-F235 AromaticContact CE2-CE2 3.6Å; F233-F235 HydrophobicContact CE2-CE2 3.6Å; F233-F235 AromaticContact CE2-CZ 3.98Å; F233-F235 HydrophobicContact CE2-CZ 3.98Å; F235-A264 HydrophobicContact CD1-CB 3.88Å; F235-A264 HydrophobicContact CE1-CB 4.09Å
236	I	89.6	Confident	84.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.7	178.4	-59.8	-179.9	0	0	0	107.8	K196 V197 I199 L211 F215 V221 D223 V224 F238	K196-I236 CarbonylContact C-O 3.5Å; K196-I236 VanDerWaalsContact CA-O 3.23Å; K196-I236 WeakPolarHBondContact CA-O 3.5Å; V197-I236 HydrophobicContact CG2-CB 3.79Å; V197-I236 PolarHBondContact N-O 3.1Å; V197-I236 PolarHBondContact O-N 3.46Å; I199-I236 HydrophobicContact CD1-CD1 4.07Å; I199-I236 HydrophobicContact CG1-CD1 3.67Å; I199-I236 HydrophobicContact CG1-CG1 3.86Å; L211-I236 HydrophobicContact CB-CD1 4.15Å; L211-I236 HydrophobicContact CD2-CD1 4.32Å; F215-I236 HydrophobicContact CB-CD1 4.1Å; F215-I236 HydrophobicContact CB-CG2 4.46Å; F215-I236 HydrophobicContact CD1-CD1 4.29Å; F215-I236 HydrophobicContact CD2-CD1 3Å; F215-I236 HydrophobicContact CE2-CD1 3.33Å; F215-I236 HydrophobicContact CG-CD1 3.53Å; F215-I236 HydrophobicContact CZ-CD1 4.09Å; V221-I236 HydrophobicContact CG1-CG2 3.7Å; V221-I236 HydrophobicContact CG2-CG2 4.17Å; D223-I236 CarbonylContact O-C 3.5Å; D223-I236 WeakPolarHBondContact O-CA 3.44Å; V224-I236 HydrophobicContact CG1-CG1 4.37Å; V224-I236 HydrophobicContact CG2-CG1 4.35Å; V224-I236 HydrophobicContact CG2-CG2 4.48Å; I236-F238 HydrophobicContact CG2-CD2 4.37Å; I236-F238 HydrophobicContact CG2-CE1 4.48Å; I236-F238 HydrophobicContact CG2-CE2 3.9Å; I236-F238 HydrophobicContact CG2-CZ 3.96Å
237	T	85.8	Confident	84.6	Confident	32 Å²	32	53.7 Å²	53.7	20%	0.196	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.8	176.3	-47.9	0	0	0	0	108.7	R195 C222 D223	R195-T237 HydrophobicContact CB-CG2 4.22Å; R195-T237 CarbonylContact O-C 3.49Å; R195-T237 WeakPolarHBondContact O-CA 3.44Å; C222-T237 WeakPolarHBondContact CA-O 3.42Å; C222-T237 WeakPolarHBondContact CB-O 3.47Å; C222-T237 PolarHBondContact N-O 3.44Å; D223-T237 PolarHBondContact N-O 2.79Å; D223-T237 PolarHBondContact O-N 2.75Å
238	F	87.7	Confident	84.6	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	156.6	173.4	-68.6	-81.7	0	0	0	111.5	R195 V197 F215 R220 V221 I236 D240 V243 A244 L247	R195-F238 WeakPolarHBondContact CB-O 3.44Å; R195-F238 WeakPolarHBondContact CD-O 3.37Å; R195-F238 PolarHBondContact O-N 3.42Å; V197-F238 HydrophobicContact CG1-CD2 4.41Å; V197-F238 HydrophobicContact CG1-CE2 4.2Å; V197-F238 HydrophobicContact CG2-CD2 4.4Å; V197-F238 HydrophobicContact CG2-CE2 3.74Å; F215-F238 HydrophobicContact CB-CE1 4.14Å; F215-F238 HydrophobicContact CB-CZ 3.88Å; F215-F238 AromaticContact CD1-CZ 3.81Å; F215-F238 HydrophobicContact CD1-CZ 3.81Å; F215-F238 HydrophobicContact CG-CZ 4.18Å; R220-F238 WeakPolarHBondContact O-CA 3.35Å; V221-F238 HydrophobicContact CG2-CD1 4.14Å; V221-F238 HydrophobicContact CG2-CE1 3.77Å; I236-F238 HydrophobicContact CG2-CD2 4.37Å; I236-F238 HydrophobicContact CG2-CE1 4.48Å; I236-F238 HydrophobicContact CG2-CE2 3.9Å; I236-F238 HydrophobicContact CG2-CZ 3.96Å; F238-D240 WeakPolarHBondContact CB-O 3.08Å; F238-V243 HydrophobicContact CD1-CB 4.37Å; F238-V243 HydrophobicContact CD1-CG1 3.63Å; F238-V243 HydrophobicContact CE1-CG1 3.79Å; F238-V243 HydrophobicContact CG-CB 4.42Å; F238-V243 HydrophobicContact CG-CG1 4.03Å; F238-V243 HydrophobicContact CZ-CG1 4.31Å; F238-A244 HydrophobicContact CD2-CB 3.88Å; F238-L247 HydrophobicContact CE1-CD1 4.13Å; F238-L247 HydrophobicContact CE2-CD1 3.53Å; F238-L247 HydrophobicContact CZ-CD1 3.28Å
239	D	81.6	Confident	84.2	Confident	59 Å²	59	50.1 Å²	50.1	32%	0.316	29%	0.287	S	S	.	.	S	Bend	trans	-67.3	-43.7	169.3	-152.2	11.1	0	0	0	110	R195 R220 C222	R195-D239 WeakPolarHBondContact CD-O 3.36Å; R220-D239 HydrophobicContact CB-CB 3.97Å; R220-D239 WeakPolarHBondContact CD-OD2 3.45Å; R220-D239 HydrophobicContact CG-CB 4.47Å; R220-D239 IonicContact NH1-OD2 2.68Å; R220-D239 PolarHBondContact NH1-OD2 3.44Å; R220-D239 PolarHBondContact O-N 3.06Å; C222-D239 WeakPolarHBondContact SG-CA 3.49Å; C222-D239 VanDerWaalsContact SG-CB 3.6Å; C222-D239 PolarHBondContact SG-N 3.25Å
240	D	77.7	Confident	84	Confident	83 Å²	83	50.7 Å²	50.7	44%	0.444	28%	0.28	S	S	.	.			trans	-97.9	126.9	-177.9	-62	-47.2	0	0	0	112.6	F238 E242 V243 A244	F238-D240 WeakPolarHBondContact CB-O 3.08Å; D240-E242 VanDerWaalsContact C-N 3.29Å; D240-E242 PolarHBondContact O-N 2.87Å; D240-V243 HydrophobicContact CB-CB 4.29Å; D240-V243 HydrophobicContact CB-CG2 3.78Å; D240-V243 PolarHBondContact O-N 3.48Å; D240-A244 PolarHBondContact O-N 3.26Å
241	P	79.9	Confident	83.7	Confident	51 Å²	51	53.7 Å²	53.7	33%	0.331	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-29	177.6	26.7	-32.8	0	0	0	112.7	V193 R195 A244 A245	V193-P241 HydrophobicContact CB-CB 4.15Å; V193-P241 HydrophobicContact CG1-CB 4.11Å; V193-P241 WeakPolarHBondContact CG1-O 3.13Å; R195-P241 HydrophobicContact CG-CB 3.86Å; P241-A244 WeakPolarHBondContact O-CB 3.34Å; P241-A244 PolarHBondContact O-N 3.42Å; P241-A245 PolarHBondContact O-N 3.06Å
242	E	80.1	Confident	83.6	Confident	149 Å²	149	47.4 Å²	47.4	70%	0.696	28%	0.276	S	S	*	.	H	α-helix	trans	-68	-37.6	179.2	-63	-172	177.9	0	0	111.8	D240 A245 S246	D240-E242 VanDerWaalsContact C-N 3.29Å; D240-E242 PolarHBondContact O-N 2.87Å; E242-A245 PolarHBondContact O-N 2.91Å; E242-S246 WeakPolarHBondContact O-CB 3.49Å; E242-S246 PolarHBondContact O-N 3.08Å
243	V	85	Confident	83.6	Confident	20 Å²	20	49.7 Å²	49.7	12%	0.121	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-47.8	174.3	176.4	0	0	0	0	109.8	Y218 F238 D240 A245 S246 L247	Y218-V243 WeakPolarHBondContact O-CG1 3.47Å; F238-V243 HydrophobicContact CD1-CB 4.37Å; F238-V243 HydrophobicContact CD1-CG1 3.63Å; F238-V243 HydrophobicContact CE1-CG1 3.79Å; F238-V243 HydrophobicContact CG-CB 4.42Å; F238-V243 HydrophobicContact CG-CG1 4.03Å; F238-V243 HydrophobicContact CZ-CG1 4.31Å; D240-V243 HydrophobicContact CB-CB 4.29Å; D240-V243 HydrophobicContact CB-CG2 3.78Å; D240-V243 PolarHBondContact O-N 3.48Å; V243-A245 VanDerWaalsContact C-N 3.34Å; V243-A245 PolarHBondContact O-N 2.76Å; V243-S246 PolarHBondContact O-N 3.44Å; V243-S246 PolarHBondContact O-OG 3.01Å; V243-L247 HydrophobicContact CG1-CD1 4.19Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 3.25Å
244	A	84	Confident	83.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.8	-45.5	176.5	0	0	0	0	0	111.9	S194 V197 F238 D240 P241 L247 L248	S194-A244 VanDerWaalsContact O-CB 3.27Å; S194-A244 WeakPolarHBondContact O-CB 3.29Å; V197-A244 HydrophobicContact CG1-CB 3.72Å; V197-A244 WeakPolarHBondContact CG1-O 3.18Å; F238-A244 HydrophobicContact CD2-CB 3.88Å; D240-A244 PolarHBondContact O-N 3.26Å; P241-A244 WeakPolarHBondContact O-CB 3.34Å; P241-A244 PolarHBondContact O-N 3.42Å; A244-L247 PolarHBondContact O-N 2.96Å; A244-L248 WeakPolarHBondContact O-CG 3.15Å; A244-L248 PolarHBondContact O-N 2.68Å
245	A	81.5	Confident	82.8	Confident	40 Å²	40	55.1 Å²	55.1	33%	0.331	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-43	177.4	0	0	0	0	0	112.6	V193 P241 E242 V243 L247 L248	V193-A245 HydrophobicContact CG1-CB 3.59Å; P241-A245 PolarHBondContact O-N 3.06Å; E242-A245 PolarHBondContact O-N 2.91Å; V243-A245 VanDerWaalsContact C-N 3.34Å; V243-A245 PolarHBondContact O-N 2.76Å; A245-L247 PolarHBondContact O-N 3.12Å; A245-L248 WeakPolarHBondContact O-CB 3.31Å; A245-L248 PolarHBondContact O-N 3.36Å; A245-L248 VanDerWaalsContact O-N 3.11Å
246	S	84.7	Confident	82.4	Confident	55 Å²	55	57 Å²	57	39%	0.385	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-19.9	-178.5	81.2	0	0	0	0	113.3	E242 V243 K250	E242-S246 WeakPolarHBondContact O-CB 3.49Å; E242-S246 PolarHBondContact O-N 3.08Å; V243-S246 PolarHBondContact O-N 3.44Å; V243-S246 PolarHBondContact O-OG 3.01Å; S246-K250 WeakPolarHBondContact O-CD 3.27Å; S246-K250 WeakPolarHBondContact O-CE 3.27Å; S246-K250 PolarHBondContact O-NZ 3.01Å
247	L	85.3	Confident	82.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-90.6	-16.1	177.8	-68.7	169.6	0	0	0	112.7	F215 Y218 F238 V243 A244 A245 G249 K250 V261	F215-L247 HydrophobicContact CD1-CD1 3.94Å; F215-L247 HydrophobicContact CE1-CD1 4.21Å; Y218-L247 HydrophobicContact CD1-CD2 3.92Å; Y218-L247 HydrophobicContact CD2-CD1 4.21Å; Y218-L247 HydrophobicContact CD2-CD2 3.63Å; Y218-L247 HydrophobicContact CE1-CD2 4.1Å; Y218-L247 HydrophobicContact CE2-CD2 3.78Å; Y218-L247 HydrophobicContact CG-CD1 4.29Å; Y218-L247 HydrophobicContact CG-CD2 3.7Å; Y218-L247 HydrophobicContact CG-CG 4.42Å; F238-L247 HydrophobicContact CE1-CD1 4.13Å; F238-L247 HydrophobicContact CE2-CD1 3.53Å; F238-L247 HydrophobicContact CZ-CD1 3.28Å; V243-L247 HydrophobicContact CG1-CD1 4.19Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 3.25Å; A244-L247 PolarHBondContact O-N 2.96Å; A245-L247 PolarHBondContact O-N 3.12Å; L247-G249 PolarHBondContact O-N 3.25Å; L247-K250 PolarHBondContact O-N 3.04Å; L247-V261 HydrophobicContact CB-CG1 4.01Å; L247-V261 VanDerWaalsContact O-CB 3.31Å; L247-V261 WeakPolarHBondContact O-CB 3.28Å; L247-V261 WeakPolarHBondContact O-CG1 3.32Å
248	L	82.3	Confident	82.2	Confident	72 Å²	72	65.9 Å²	65.9	38%	0.377	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	125.2	178.6	-60.3	179.3	0	0	0	110.3	V197 A244 A245 K250 G262	V197-L248 HydrophobicContact CG1-CD2 4.24Å; A244-L248 WeakPolarHBondContact O-CG 3.15Å; A244-L248 PolarHBondContact O-N 2.68Å; A245-L248 WeakPolarHBondContact O-CB 3.31Å; A245-L248 PolarHBondContact O-N 3.36Å; A245-L248 VanDerWaalsContact O-N 3.11Å; L248-K250 VanDerWaalsContact C-N 3.27Å; L248-K250 PolarHBondContact O-N 3.4Å; L248-G262 VanDerWaalsContact CD2-C 3.43Å; L248-G262 WeakPolarHBondContact CD2-O 3.44Å
249	G	75.7	Confident	82.3	Confident	72 Å²	72	65.9 Å²	65.9	74%	0.742	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	1.3	179.2	0	0	0	0	0	115	L247 V261	L247-G249 PolarHBondContact O-N 3.25Å; G249-V261 PolarHBondContact N-O 3.46Å; G249-V261 VanDerWaalsContact N-O 3.1Å
250	K	78.5	Confident	82.5	Confident	103 Å²	103	65.2 Å²	65.2	45%	0.448	37%	0.365	S	S	.	.			trans	-86.7	127.6	169	-68.9	-177	-179.9	157.5	0	109.8	S246 L247 L248	S246-K250 WeakPolarHBondContact O-CD 3.27Å; S246-K250 WeakPolarHBondContact O-CE 3.27Å; S246-K250 PolarHBondContact O-NZ 3.01Å; L247-K250 PolarHBondContact O-N 3.04Å; L248-K250 VanDerWaalsContact C-N 3.27Å; L248-K250 PolarHBondContact O-N 3.4Å
251	D	79.1	Confident	83	Confident	127 Å²	127	61.5 Å²	61.5	68%	0.679	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	133.3	166.9	-72.8	-38.6	0	0	0	108.9
252	Q	83.5	Confident	83.1	Confident	19 Å²	19	60.1 Å²	60.1	9%	0.089	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	149	179	-64.5	-65.8	-15.4	0	0	109	F215 Y218 R258 I259 V261	F215-Q252 HydrophobicContact CE1-CG 4.39Å; F215-Q252 HydrophobicContact CZ-CG 4.48Å; Y218-Q252 PolarHBondContact OH-NE2 3.46Å; Y218-Q252 PolarHBondContact OH-OE1 3.33Å; Q252-R258 CarbonylContact O-C 3.55Å; Q252-R258 WeakPolarHBondContact O-CA 3.36Å; Q252-I259 HydrophobicContact CB-CD1 3.81Å; Q252-I259 HydrophobicContact CB-CG1 3.55Å; Q252-I259 PolarHBondContact N-O 3.13Å; Q252-I259 WeakPolarHBondContact O-CG1 3.49Å; Q252-I259 PolarHBondContact O-N 3.23Å; Q252-V261 HydrophobicContact CB-CG2 4.45Å; Q252-V261 HydrophobicContact CG-CG2 3.8Å
253	E	84.9	Confident	83	Confident	107 Å²	107	55.7 Å²	55.7	50%	0.5	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.9	177	-166.1	175.2	128.8	0	0	109.7	H214 V257 R258	H214-E253 PolarHBondContact CE1-O 2.78Å; H214-E253 VanDerWaalsContact CE1-O 3.25Å; E253-V257 WeakPolarHBondContact CA-O 3.5Å; E253-R258 HydrophobicContact CG-CG 4.47Å
254	I	83.3	Confident	82.4	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.7	179.4	-56.5	-171.8	0	0	0	107.7	I206 L211 H214 F215 G256 V257 I259	I206-I254 HydrophobicContact CG2-CG2 4.34Å; L211-I254 HydrophobicContact CD2-CD1 3.75Å; H214-I254 HydrophobicContact CB-CD1 3.69Å; H214-I254 HydrophobicContact CB-CG1 4.12Å; H214-I254 VanDerWaalsContact CD2-CD1 3.45Å; H214-I254 WeakPolarHBondContact CD2-CD1 3.41Å; F215-I254 HydrophobicContact CD2-CD1 4.3Å; F215-I254 HydrophobicContact CE2-CD1 3.77Å; I254-G256 PolarHBondContact O-N 3.33Å; I254-V257 PolarHBondContact N-O 3.03Å; I254-V257 WeakPolarHBondContact O-CB 3.39Å; I254-V257 PolarHBondContact O-N 3.11Å; I254-I259 HydrophobicContact CD1-CD1 3.38Å; I254-I259 HydrophobicContact CG1-CD1 3.73Å; I254-I259 HydrophobicContact CG1-CG1 4.44Å
255	Q	79.4	Confident	81.7	Confident	142 Å²	142	60.6 Å²	60.6	66%	0.664	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	36.2	178.9	-62.4	177.2	-27.8	0	0	113.5	V257	Q255-V257 VanDerWaalsContact C-N 3.28Å; Q255-V257 PolarHBondContact O-N 3.39Å
256	G	81.3	Confident	80.7	Confident	58 Å²	58	64 Å²	64	60%	0.598	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	1.5	-177.7	0	0	0	0	0	114.9	I254	I254-G256 PolarHBondContact O-N 3.33Å
257	V	84.8	Confident	79.3	Confident	34 Å²	34	68.9 Å²	68.9	21%	0.206	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.5	178.4	-178.1	0	0	0	0	109.8	T203 I206 E253 I254 Q255 I259	T203-V257 HydrophobicContact CG2-CG1 3.82Å; T203-V257 HydrophobicContact CG2-CG2 4.06Å; I206-V257 HydrophobicContact CD1-CB 3.93Å; I206-V257 HydrophobicContact CD1-CG1 4.1Å; I206-V257 HydrophobicContact CD1-CG2 4.18Å; E253-V257 WeakPolarHBondContact CA-O 3.5Å; I254-V257 PolarHBondContact N-O 3.03Å; I254-V257 WeakPolarHBondContact O-CB 3.39Å; I254-V257 PolarHBondContact O-N 3.11Å; Q255-V257 VanDerWaalsContact C-N 3.28Å; Q255-V257 PolarHBondContact O-N 3.39Å; V257-I259 HydrophobicContact CG1-CG2 4.31Å; V257-I259 PolarHBondContact O-N 3.23Å
258	R	86.4	Confident	77.5	Confident	185 Å²	185	76.1 Å²	76.1	70%	0.698	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.5	174.2	-67	-175.5	179.5	178.9	1	110.8	Q252 E253	Q252-R258 CarbonylContact O-C 3.55Å; Q252-R258 WeakPolarHBondContact O-CA 3.36Å; E253-R258 HydrophobicContact CG-CG 4.47Å
259	I	89.8	Confident	75.8	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151	176.7	67.4	171.9	0	0	0	110.4	I199 G200 L202 I206 F215 Q252 I254 V257	I199-I259 HydrophobicContact CG2-CB 4.05Å; I199-I259 HydrophobicContact CG2-CD1 3.74Å; I199-I259 HydrophobicContact CG2-CG1 4.33Å; G200-I259 WeakPolarHBondContact O-CA 3.21Å; L202-I259 HydrophobicContact CD1-CG2 4.19Å; I206-I259 HydrophobicContact CD1-CG2 4.46Å; F215-I259 HydrophobicContact CE2-CD1 3.72Å; F215-I259 HydrophobicContact CZ-CD1 3.59Å; Q252-I259 HydrophobicContact CB-CD1 3.81Å; Q252-I259 HydrophobicContact CB-CG1 3.55Å; Q252-I259 PolarHBondContact N-O 3.13Å; Q252-I259 WeakPolarHBondContact O-CG1 3.49Å; Q252-I259 PolarHBondContact O-N 3.23Å; I254-I259 HydrophobicContact CD1-CD1 3.38Å; I254-I259 HydrophobicContact CG1-CD1 3.73Å; I254-I259 HydrophobicContact CG1-CG1 4.44Å; V257-I259 HydrophobicContact CG1-CG2 4.31Å; V257-I259 PolarHBondContact O-N 3.23Å
260	S	84.8	Confident	74.2	Confident	45 Å²	45	80.5 Å²	80.5	32%	0.315	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.5	178.9	179.5	0	0	0	0	110.3	I199 G200	I199-S260 CarbonylContact C-O 3.59Å; I199-S260 WeakPolarHBondContact CA-O 3.42Å; G200-S260 PolarHBondContact N-O 2.97Å; G200-S260 PolarHBondContact O-N 3.49Å
261	V	88.6	Confident	72.5	Confident	5 Å²	5	80.6 Å²	80.6	3%	0.03	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	115.6	176.9	-171.3	0	0	0	0	110.4	V197 I199 F215 L247 G249 Q252	V197-V261 HydrophobicContact CB-CG1 3.96Å; V197-V261 HydrophobicContact CG1-CG1 4.28Å; V197-V261 HydrophobicContact CG2-CG1 4.29Å; I199-V261 HydrophobicContact CD1-CB 4.39Å; I199-V261 HydrophobicContact CD1-CG1 4.04Å; I199-V261 HydrophobicContact CD1-CG2 3.89Å; F215-V261 HydrophobicContact CE1-CG2 4.2Å; F215-V261 HydrophobicContact CZ-CG2 4.15Å; L247-V261 HydrophobicContact CB-CG1 4.01Å; L247-V261 VanDerWaalsContact O-CB 3.31Å; L247-V261 WeakPolarHBondContact O-CB 3.28Å; L247-V261 WeakPolarHBondContact O-CG1 3.32Å; G249-V261 PolarHBondContact N-O 3.46Å; G249-V261 VanDerWaalsContact N-O 3.1Å; Q252-V261 HydrophobicContact CB-CG2 4.45Å; Q252-V261 HydrophobicContact CG-CG2 3.8Å
262	G	82.2	Confident	70.8	Confident	23 Å²	23	79.2 Å²	79.2	24%	0.237	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	169.8	-179.9	0	0	0	0	0	113	H198 L248 A264	H198-G262 PolarHBondContact N-O 2.91Å; H198-G262 PolarHBondContact O-N 3.22Å; L248-G262 VanDerWaalsContact CD2-C 3.43Å; L248-G262 WeakPolarHBondContact CD2-O 3.44Å; G262-A264 PolarHBondContact O-N 3.18Å
263	S	79	Confident	68.8	Low	56 Å²	56	90.6 Å²	90.6	39%	0.392	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	129.9	176.6	-177.6	0	0	0	0	110.1	V265	S263-V265 PolarHBondContact O-N 2.9Å
264	A	71.7	Confident	66.7	Low	7 Å²	7	93.9 Å²	93.9	6%	0.058	52%	0.524	C	S	.	.			trans	-77.2	111.6	176.9	0	0	0	0	0	110.1	K196 H198 F235 G262 P266	K196-A264 HydrophobicContact CB-CB 3.91Å; K196-A264 HydrophobicContact CD-CB 4.43Å; K196-A264 HydrophobicContact CG-CB 3.77Å; K196-A264 WeakPolarHBondContact O-CB 3.46Å; H198-A264 HydrophobicContact CB-CB 4.39Å; F235-A264 HydrophobicContact CD1-CB 3.88Å; F235-A264 HydrophobicContact CE1-CB 4.09Å; G262-A264 PolarHBondContact O-N 3.18Å; A264-P266 WeakPolarHBondContact O-CD 3.42Å
265	V	69.1	Low	64.5	Low	115 Å²	115	98.4 Å²	98.4	70%	0.697	56%	0.556	S	S	*	*			trans	-79.7	118.6	172	-175.9	0	0	0	0	108.6	S263 K267	S263-V265 PolarHBondContact O-N 2.9Å; V265-K267 PolarHBondContact O-N 3.34Å
266	P	60	Low	62.6	Low	111 Å²	111	98.8 Å²	98.8	72%	0.721	56%	0.563	S	S	*	*			trans	-62.5	122	176.3	23.2	-30.2	0	0	0	109.4	A264 L268	A264-P266 WeakPolarHBondContact O-CD 3.42Å; P266-L268 PolarHBondContact O-N 3.4Å
267	K	55.2	Low	60.8	Low	158 Å²	158	102.1 Å²	102.1	69%	0.687	57%	0.572	S	S	*	*			trans	-71.1	103.2	169.4	-68.5	-177.7	-178.2	177.4	0	107.5	V265	V265-K267 PolarHBondContact O-N 3.34Å
268	L	48.1	Very low	58.7	Low	153 Å²	153	107 Å²	107	80%	0.801	60%	0.597	S	S	*	*			trans	-58.6	136.9	163.8	-72.9	159.8	0	0	0	108	P266	P266-L268 PolarHBondContact O-N 3.4Å
269	P	45.9	Very low	56.8	Low	102 Å²	102	104.6 Å²	104.6	66%	0.662	60%	0.598	S	S	*	*			trans	-55.9	136.6	176	21.7	-31	0	0	0	109.5	S271	P269-S271 PolarHBondContact O-N 3.31Å
270	P	42.7	Very low	54.4	Low	134 Å²	134	112.4 Å²	112.4	87%	0.87	63%	0.634	S	S	*	*	S	Bend	trans	-72.7	82.8	175.4	29.9	-31.3	0	0	0	108.2
271	S	42.3	Very low	52.3	Low	105 Å²	105	122 Å²	122	73%	0.734	66%	0.664	S	S	*	*			trans	-149.4	124.7	170.9	-77	0	0	0	0	109.1	P269	P269-S271 PolarHBondContact O-N 3.31Å
272	A	43	Very low	50.3	Low	98 Å²	98	128.3 Å²	128.3	81%	0.81	70%	0.696	S	S	*	*			trans	74.8	47.3	-178.6	0	0	0	0	0	117.4	Q274	A272-Q274 PolarHBondContact O-N 2.83Å
273	R	41.4	Very low	48.3	Very low	258 Å²	258	133.1 Å²	133.1	97%	0.974	72%	0.723	S	S	*	*			trans	-81.7	80.2	137.6	-93.8	-172	175.8	171.6	-0.2	107.3	S275	R273-S275 PolarHBondContact O-N 3.41Å
274	Q	42.8	Very low	46.7	Very low	176 Å²	176	136.2 Å²	136.2	82%	0.822	74%	0.739	S	S	*	*			trans	-56.8	122.5	162.7	-157	162.2	20	0	0	106.6	A272 N276	A272-Q274 PolarHBondContact O-N 2.83Å; Q274-N276 VanDerWaalsContact C-N 3.35Å; Q274-N276 PolarHBondContact O-N 3.24Å
275	S	35.8	Very low	45.5	Very low	100 Å²	100	142.1 Å²	142.1	70%	0.699	78%	0.775	S	S	*	*			trans	-56.1	97.5	170.5	52.5	0	0	0	0	108.6	R273	R273-S275 PolarHBondContact O-N 3.41Å
276	N	39.1	Very low	44.3	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	78%	0.781	S	S	*	*			trans	-102.7	73.7	162	-149	15.6	0	0	0	107.7	Q274 N278	Q274-N276 VanDerWaalsContact C-N 3.35Å; Q274-N276 PolarHBondContact O-N 3.24Å; N276-N278 PolarHBondContact O-N 2.95Å; N276-N278 VanDerWaalsContact O-N 3.13Å
277	T	44.9	Very low	43.2	Very low	128 Å²	128	145.9 Å²	145.9	79%	0.785	79%	0.79	S	S	*	*			trans	-74.7	81.1	162.7	46.4	0	0	0	0	107.8
278	N	41.2	Very low	42.3	Very low	135 Å²	135	147 Å²	147	72%	0.722	80%	0.798	S	S	*	*			trans	-166.4	90.2	160.2	-127.6	-1.5	0	0	0	110.6	N276	N276-N278 PolarHBondContact O-N 2.95Å; N276-N278 VanDerWaalsContact O-N 3.13Å
279	N	44.4	Very low	41.9	Very low	135 Å²	135	144.5 Å²	144.5	72%	0.722	80%	0.799	S	S	*	*				-177.5	107.7	129.7	-110.1	-8.9	0	0	0	110.8
280	Q	41	Very low	41.5	Very low	165 Å²	165	144.3 Å²	144.3	77%	0.771	81%	0.806	S	S	*	*			trans	42.5	87.1	130.5	-56.6	-174.2	6.1	0	0	116
281	R	39.7	Very low	41.3	Very low	248 Å²	248	145.8 Å²	145.8	94%	0.936	81%	0.806	S	S	*	*			trans	-102.4	107.8	147.6	-86.5	-170.8	165.4	-165.4	-4.2	108.5	P283	R281-P283 WeakPolarHBondContact O-CD 3.21Å
282	I	46.2	Very low	41.2	Very low	137 Å²	137	149.6 Å²	149.6	70%	0.703	81%	0.812	S	S	*	*			trans	-68	119.6	170.3	-53.4	166.4	0	0	0	107.2	V284	I282-V284 HydrophobicContact CG2-CG1 4.37Å; I282-V284 PolarHBondContact O-N 2.84Å
283	P	41.8	Very low	41.1	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	81%	0.807	S	S	*	*			trans	-85.4	105.8	165.6	31.1	-25.5	0	0	0	108.3	R281	R281-P283 WeakPolarHBondContact O-CD 3.21Å
284	V	44.3	Very low	41.3	Very low	120 Å²	120	142.6 Å²	142.6	73%	0.727	79%	0.792	S	S	*	*			trans	-77.9	154.7	159.9	-68.1	0	0	0	0	108.5	I282	I282-V284 HydrophobicContact CG2-CG1 4.37Å; I282-V284 PolarHBondContact O-N 2.84Å
285	T	46.6	Very low	41.2	Very low	132 Å²	132	141.4 Å²	141.4	81%	0.81	79%	0.789	S	S	*	*			trans	94.7	76.2	174.7	-17.6	0	0	0	0	116.1
286	S	43.7	Very low	41.4	Very low	120 Å²	120	145.9 Å²	145.9	84%	0.839	80%	0.801	S	S	*	*				-179.5	113.6	109.4	39	0	0	0	0	108.9	Q288	S286-Q288 PolarHBondContact O-N 2.68Å
287	M	37.3	Very low	41.4	Very low	184 Å²	184	141.6 Å²	141.6	91%	0.906	79%	0.792	S	S	*	*			trans	-71.5	107.9	171.1	179.1	-179.3	-150.8	0	0	107.6
288	Q	35.7	Very low	41.3	Very low	183 Å²	183	141.8 Å²	141.8	86%	0.855	79%	0.793	S	S	*	*			trans	-175.2	134.8	148.5	-148.3	94.4	-2	0	0	110	S286	S286-Q288 PolarHBondContact O-N 2.68Å
289	A	39.9	Very low	41.2	Very low	99 Å²	99	143 Å²	143	82%	0.818	80%	0.795	S	S	*	*			trans	90.4	126.3	158.7	0	0	0	0	0	119.1
290	A	38.4	Very low	40.9	Very low	99 Å²	99	143.7 Å²	143.7	82%	0.818	79%	0.794	S	S	*	*			trans	82.5	68.4	162.5	0	0	0	0	0	117.9
291	L	37.5	Very low	40.4	Very low	165 Å²	165	147 Å²	147	86%	0.864	80%	0.799	S	S	*	*			trans	-53	125.7	130.9	-89.4	91.9	0	0	0	108.4
292	Q	40.8	Very low	40.2	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.864	79%	0.791	S	S	*	*				175.4	131.1	127.9	-95.8	165.1	18.1	0	0	111.8
293	S	40.1	Very low	39.9	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	79%	0.79	S	S	*	*			trans	73.9	102.5	156.1	-69.1	0	0	0	0	119.7
294	T	45.5	Very low	39.7	Very low	108 Å²	108	141.9 Å²	141.9	66%	0.663	80%	0.796	S	S	*	*				90.6	137.5	71.2	-49.7	0	0	0	0	111.6
295	M	40.4	Very low	39.9	Very low	151 Å²	151	141.5 Å²	141.5	74%	0.744	80%	0.796	S	S	*	*			trans	80.3	113	144.4	43.3	-148.5	159	0	0	122.3
296	M	41.1	Very low	40	Very low	195 Å²	195	141.4 Å²	141.4	96%	0.961	80%	0.797	S	S	*	*			trans	68.9	141	137.7	-53.5	-85.8	-136.7	0	0	116.4
297	G	39	Very low	39.8	Very low	61 Å²	61	139.7 Å²	139.7	63%	0.629	79%	0.791	S	S	*	*			cis	170	141.5	5.5	0	0	0	0	0	107.8
298	T	43.3	Very low	39.8	Very low	131 Å²	131	142.3 Å²	142.3	80%	0.804	79%	0.792	S	S	*	*			trans	39.5	119	141	158.8	0	0	0	0	122.7
299	Q	39.3	Very low	39.9	Very low	162 Å²	162	137.3 Å²	137.3	76%	0.757	79%	0.79	S	S	*	*				83.4	130.9	129.7	-62.2	-84.8	7.2	0	0	122.5
300	Q	36.4	Very low	39.9	Very low	149 Å²	149	136.8 Å²	136.8	70%	0.696	79%	0.793	S	S	*	*				99.8	106.5	122.3	170.8	139.8	51.4	0	0	123.3
301	W	30.6	Very low	39.7	Very low	235 Å²	235	141 Å²	141	89%	0.89	80%	0.799	S	S	*	*			trans	73.4	138.4	135.5	-68.1	68.3	0	0	0	125.7
302	G	37.2	Very low	39.8	Very low	74 Å²	74	140.1 Å²	140.1	76%	0.763	80%	0.8	S	S	*	*			trans	102	150.4	153.7	0	0	0	0	0	116
303	A	39.3	Very low	39.8	Very low	82 Å²	82	138.6 Å²	138.6	68%	0.678	79%	0.793	S	S	*	*			cis	170.7	123.1	-12	0	0	0	0	0	107.7
304	W	37.6	Very low	39.6	Very low	245 Å²	245	139.7 Å²	139.7	93%	0.928	79%	0.791	S	S	*	*			trans	57.3	171.8	154.5	-55.1	98.2	0	0	0	121.5
305	P	47.4	Very low	39.4	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	79%	0.794	S	S	*	*				-135.6	-172.8	-52.4	40.2	-22.4	0	0	0	113.9
306	P	48.9	Very low	39.1	Very low	130 Å²	130	143.8 Å²	143.8	84%	0.844	80%	0.796	S	S	*	*			trans	-107.5	169.9	-165.4	40.2	-31	0	0	0	116.4
307	A	39.1	Very low	38.9	Very low	85 Å²	85	144.5 Å²	144.5	70%	0.702	79%	0.789	S	S	*	*			trans	-164.6	157	163.9	0	0	0	0	0	114.7
308	Y	38.7	Very low	38.8	Very low	239 Å²	239	145.1 Å²	145.1	94%	0.937	80%	0.796	S	S	*	*			trans	76.6	132	168	-77.5	-95.8	0	0	0	118.2
309	G	37.4	Very low	38.3	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	80%	0.796	S	S	*	*			cis	133	135	11.3	0	0	0	0	0	110
310	G	39.4	Very low	38.2	Very low	87 Å²	87	142.3 Å²	142.3	90%	0.897	80%	0.795	S	S	*	*			trans	141	116.2	160.8	0	0	0	0	0	118.6
311	M	34.9	Very low	38.2	Very low	189 Å²	189	142.6 Å²	142.6	93%	0.931	80%	0.796	S	S	*	*			trans	-95	152.2	174.9	-60.6	170.5	173.2	0	0	112.6
312	V	39.7	Very low	38.3	Very low	146 Å²	146	136.1 Å²	136.1	89%	0.885	79%	0.786	S	S	*	*			trans	-168.5	160	149.5	-176.4	0	0	0	0	107.6
313	Q	39.9	Very low	38	Very low	153 Å²	153	138 Å²	138	72%	0.715	79%	0.788	S	S	*	*				-177.9	139.4	-60.6	176.1	163.8	-0.5	0	0	106.4
314	N	36.2	Very low	37.6	Very low	122 Å²	122	137.7 Å²	137.7	65%	0.652	79%	0.792	S	S	*	*			trans	51.8	128.9	155.2	-74.7	-12	0	0	0	124.6
315	N	40.5	Very low	37.4	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	79%	0.793	S	S	*	*				-179.8	119.7	109	-99.5	9.3	0	0	0	107.9
316	R	34.9	Very low	36.5	Very low	206 Å²	206	134.8 Å²	134.8	78%	0.777	80%	0.797	S	S	*	*				77.5	141.4	55.8	-147.4	-173.1	-125.1	-176.4	3.9	113.7
317	Y	37.8	Very low	35.7	Very low	210 Å²	210	132.3 Å²	132.3	82%	0.824	80%	0.795	S	S	*	*			trans	94.3	122.9	177.5	-60.5	-81	0	0	0	115.5
318	G	35.2	Very low	35.4	Very low	75 Å²	75	132 Å²	132	77%	0.773	79%	0.787	S	S	*	*			cis	148.9	120.2	1	0	0	0	0	0	110.8
319	G	33.7	Very low	35.1	Very low	77 Å²	77	126.7 Å²	126.7	79%	0.794	77%	0.766	S	S	*	*			trans	58.6	162.6	150.2	0	0	0	0	0	121.5
320	Q	36.5	Very low	35	Very low	157 Å²	157	128.3 Å²	128.3	73%	0.734	76%	0.756	S	S	*	*			cis	177.2	158.9	-12.5	-162.3	171.4	11.5	0	0	107.1
321	H	36.5	Very low	34.6	Very low	155 Å²	155	127 Å²	127	72%	0.718	74%	0.743	S	S	*	*			trans	75.1	149.2	162.8	-42.2	-76.5	0	0	0	117.6
322	S	33	Very low	34.5	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	74%	0.743	S	S	*	*			cis	-178	142	-15.5	174.1	0	0	0	0	108
323	S	31.7	Very low	33.9	Very low	115 Å²	115	126.5 Å²	126.5	80%	0.804	75%	0.745	S	S	*	*			trans	67.9	132.3	140.4	61	0	0	0	0	125.1
324	G	31.4	Very low	33.7	Very low	75 Å²	75	123 Å²	123	77%	0.773	75%	0.751	S	S	*	*			trans	119.3	97.1	134.7	0	0	0	0	0	114.9
325	K	32.8	Very low	33.5	Very low	217 Å²	217	121.1 Å²	121.1	94%	0.943	76%	0.76	S	S	*	*				87.4	115.6	77.5	-145.4	-179.8	-169.1	-176.9	0	114.3
326	G	29	Very low	33.5	Very low	78 Å²	78	122.2 Å²	122.2	80%	0.804	76%	0.763	S	S	*	*				110.9	119.6	128.2	0	0	0	0	0	121.4
327	G	30.9	Very low	34.1	Very low	78 Å²	78	118.5 Å²	118.5	80%	0.804	76%	0.758	S	S	*	*			trans	82.2	110.5	136.3	0	0	0	0	0	118.3
328	S	32.9	Very low	34.4	Very low	77 Å²	77	113.5 Å²	113.5	54%	0.538	75%	0.752	S	S	.	*				91.2	132	55.1	-162.8	0	0	0	0	113.4	M410 G412	S328-M410 PolarHBondContact OG-O 2.89Å; S328-G412 PolarHBondContact OG-N 2.98Å
329	R	33.2	Very low	34.6	Very low	129 Å²	129	113.6 Å²	113.6	49%	0.487	75%	0.745	S	S	.	*			trans	112.6	101.4	150.8	-66.3	-177.7	167.3	-157.6	-3.2	121.1	L411 G412	R329-L411 HydrophobicContact CB-CD2 3.87Å; R329-L411 HydrophobicContact CB-CG 4.43Å; R329-L411 HydrophobicContact CG-CB 3.98Å; R329-L411 HydrophobicContact CG-CD2 3.39Å; R329-L411 HydrophobicContact CG-CG 3.73Å; R329-L411 VanDerWaalsContact CZ-C 3.41Å; R329-L411 VanDerWaalsContact NE-CB 3.25Å; R329-L411 PolarHBondContact NH2-O 3.32Å; R329-G412 VanDerWaalsContact NE-C 3.28Å; R329-G412 PolarHBondContact NE-O 2.8Å; R329-G412 PolarHBondContact NH2-O 2.75Å
330	N	35.1	Very low	35.1	Very low	111 Å²	111	112.4 Å²	112.4	59%	0.594	73%	0.728	S	S	*	*				96.8	129.7	108.5	-154.6	33.6	0	0	0	121.8	L411	N330-L411 HydrophobicContact CB-CD1 4.39Å; N330-L411 HydrophobicContact CB-CD2 3.69Å; N330-L411 HydrophobicContact CB-CG 4.05Å
331	G	30.7	Very low	35.4	Very low	61 Å²	61	108 Å²	108	63%	0.629	72%	0.718	S	S	*	*			trans	114.4	105.2	133	0	0	0	0	0	118.5
332	S	33.1	Very low	35.8	Very low	131 Å²	131	103.2 Å²	103.2	92%	0.916	71%	0.705	S	S	*	*				151	131.8	110.5	-158.7	0	0	0	0	113.8
333	M	27	Very low	36.4	Very low	192 Å²	192	101.6 Å²	101.6	95%	0.946	70%	0.698	S	S	*	*			trans	-71	154.2	179.8	-72.3	-179.4	171.4	0	0	113.5
334	G	34.8	Very low	37.3	Very low	81 Å²	81	98.3 Å²	98.3	84%	0.835	68%	0.678	S	S	*	*			trans	-166.5	102.8	162.8	0	0	0	0	0	114.7
335	G	33.3	Very low	38.2	Very low	82 Å²	82	97.7 Å²	97.7	85%	0.845	67%	0.665	S	S	*	*			trans	81.6	100.4	141.4	0	0	0	0	0	119.4
336	M	40.4	Very low	39.2	Very low	162 Å²	162	92.1 Å²	92.1	80%	0.798	65%	0.649	S	S	*	*			trans	-123.1	134.8	160.1	-141.5	87	110.4	0	0	110.4
337	N	46.2	Very low	40.4	Very low	127 Å²	127	92.3 Å²	92.3	68%	0.679	63%	0.632	S	S	*	*			trans	-55.6	139.6	-172.6	-104	-35.1	0	0	0	113.9	A339 A340 A341	N337-A339 PolarHBondContact O-N 3.39Å; N337-A339 VanDerWaalsContact O-N 3.1Å; N337-A340 PolarHBondContact O-N 3.13Å; N337-A341 PolarHBondContact O-N 3.18Å
338	P	44.5	Very low	41.3	Very low	106 Å²	106	91.3 Å²	91.3	69%	0.688	62%	0.615	S	S	*	*	H	α-helix	trans	-60.8	-23.9	-178.3	23.2	-32.8	0	0	0	113.9	A342	P338-A342 PolarHBondContact O-N 3.1Å; P338-A342 VanDerWaalsContact O-N 3.14Å
339	A	39.8	Very low	42.1	Very low	76 Å²	76	90.2 Å²	90.2	63%	0.628	61%	0.611	S	S	*	*	H	α-helix	trans	-70.3	-32.6	175.3	0	0	0	0	0	113.5	N337 A343	N337-A339 PolarHBondContact O-N 3.39Å; N337-A339 VanDerWaalsContact O-N 3.1Å; A339-A343 PolarHBondContact O-N 3.37Å
340	A	43.8	Very low	42.9	Very low	52 Å²	52	89 Å²	89	43%	0.43	61%	0.611	S	S	.	*	H	α-helix	trans	-75.9	-34.1	177.1	0	0	0	0	0	111.6	N337 A344	N337-A340 PolarHBondContact O-N 3.13Å; A340-A344 WeakPolarHBondContact O-CB 3.48Å; A340-A344 PolarHBondContact O-N 3.45Å
341	A	43.1	Very low	43.3	Very low	64 Å²	64	91.3 Å²	91.3	53%	0.529	61%	0.612	S	S	.	*	H	α-helix	trans	-66.4	-38.5	173.3	0	0	0	0	0	112.1	N337 A345	N337-A341 PolarHBondContact O-N 3.18Å; A341-A345 WeakPolarHBondContact O-CB 3.29Å; A341-A345 PolarHBondContact O-N 2.93Å
342	A	45	Very low	44.3	Very low	55 Å²	55	92.4 Å²	92.4	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-67	-42	175.8	0	0	0	0	0	112.3	P338 A345 V346	P338-A342 PolarHBondContact O-N 3.1Å; P338-A342 VanDerWaalsContact O-N 3.14Å; A342-A345 PolarHBondContact O-N 3.2Å; A342-V346 WeakPolarHBondContact O-CG2 3.43Å; A342-V346 PolarHBondContact O-N 3.5Å; A342-V346 VanDerWaalsContact O-N 3.1Å
343	A	46.5	Very low	44.8	Very low	64 Å²	64	95 Å²	95	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-65.7	-40.1	176.5	0	0	0	0	0	112.3	A339 V346 L347	A339-A343 PolarHBondContact O-N 3.37Å; A343-V346 PolarHBondContact O-N 3.11Å; A343-L347 WeakPolarHBondContact O-CB 3.4Å; A343-L347 PolarHBondContact O-N 2.73Å
344	A	49	Very low	45.8	Very low	47 Å²	47	90.3 Å²	90.3	39%	0.388	58%	0.579	S	S	.	*	H	α-helix	trans	-65.6	-37	174.9	0	0	0	0	0	112.6	A340 L347 A348	A340-A344 WeakPolarHBondContact O-CB 3.48Å; A340-A344 PolarHBondContact O-N 3.45Å; A344-L347 PolarHBondContact O-N 2.88Å; A344-A348 WeakPolarHBondContact O-CB 3.44Å; A344-A348 PolarHBondContact O-N 2.96Å
345	A	50.6	Low	46.4	Very low	61 Å²	61	91.7 Å²	91.7	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-67.4	-39.2	176.7	0	0	0	0	0	112.7	A341 A342 A349	A341-A345 WeakPolarHBondContact O-CB 3.29Å; A341-A345 PolarHBondContact O-N 2.93Å; A342-A345 PolarHBondContact O-N 3.2Å; A345-A349 WeakPolarHBondContact O-CB 3.41Å; A345-A349 PolarHBondContact O-N 3Å; A345-A349 VanDerWaalsContact O-N 3.09Å
346	V	54	Low	46.9	Very low	100 Å²	100	95.6 Å²	95.6	61%	0.606	56%	0.559	S	S	*	*	H	α-helix	trans	-67.3	-40.2	174.8	175	0	0	0	0	110.8	A342 A343 A349 E350	A342-V346 WeakPolarHBondContact O-CG2 3.43Å; A342-V346 PolarHBondContact O-N 3.5Å; A342-V346 VanDerWaalsContact O-N 3.1Å; A343-V346 PolarHBondContact O-N 3.11Å; V346-A349 PolarHBondContact O-N 3.1Å; V346-E350 PolarHBondContact O-N 3.35Å; V346-E350 VanDerWaalsContact O-N 3.1Å
347	L	54.3	Low	46.8	Very low	83 Å²	83	93.4 Å²	93.4	44%	0.435	56%	0.555	S	S	.	*	H	α-helix	trans	-66.2	-39.7	177.6	-145	95.9	0	0	0	112.6	A343 A344 E350 Y351 I398	A343-L347 WeakPolarHBondContact O-CB 3.4Å; A343-L347 PolarHBondContact O-N 2.73Å; A344-L347 PolarHBondContact O-N 2.88Å; L347-E350 PolarHBondContact O-N 2.84Å; L347-Y351 WeakPolarHBondContact O-CB 3.47Å; L347-Y351 PolarHBondContact O-N 3.04Å; L347-I398 HydrophobicContact CD2-CG2 4.44Å
348	A	50.3	Low	46.3	Very low	56 Å²	56	98.3 Å²	98.3	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-68.1	-35.7	176.8	0	0	0	0	0	112.5	A344 T352	A344-A348 WeakPolarHBondContact O-CB 3.44Å; A344-A348 PolarHBondContact O-N 2.96Å; A348-T352 WeakPolarHBondContact O-CB 3.12Å; A348-T352 PolarHBondContact O-N 3.14Å; A348-T352 VanDerWaalsContact O-N 3.13Å; A348-T352 PolarHBondContact O-OG1 3.42Å
349	A	50	Low	45.7	Very low	55 Å²	55	100.8 Å²	100.8	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-65.6	-40	173.9	0	0	0	0	0	111.8	A345 V346 R353	A345-A349 WeakPolarHBondContact O-CB 3.41Å; A345-A349 PolarHBondContact O-N 3Å; A345-A349 VanDerWaalsContact O-N 3.09Å; V346-A349 PolarHBondContact O-N 3.1Å; A349-R353 PolarHBondContact O-N 3.09Å; A349-R353 VanDerWaalsContact O-N 3.11Å
350	E	50.1	Low	45.5	Very low	102 Å²	102	102.8 Å²	102.8	48%	0.477	58%	0.581	S	S	.	*	H	α-helix	trans	-72	-41.3	179.2	-143.5	64.5	-159.6	0	0	111.9	V346 L347 T352 R353 V354	V346-E350 PolarHBondContact O-N 3.35Å; V346-E350 VanDerWaalsContact O-N 3.1Å; L347-E350 PolarHBondContact O-N 2.84Å; E350-T352 VanDerWaalsContact C-N 3.29Å; E350-T352 PolarHBondContact O-N 3.44Å; E350-R353 PolarHBondContact O-N 3.01Å; E350-V354 VanDerWaalsContact O-CG2 3.3Å; E350-V354 WeakPolarHBondContact O-CG2 3.36Å; E350-V354 PolarHBondContact O-N 3Å
351	Y	43.6	Very low	45	Very low	160 Å²	160	103.8 Å²	103.8	63%	0.627	60%	0.596	S	S	*	*	H	α-helix	trans	-61.6	-38	175.5	-159.7	-92.1	0	0	0	112	L347 H355	L347-Y351 WeakPolarHBondContact O-CB 3.47Å; L347-Y351 PolarHBondContact O-N 3.04Å; Y351-H355 AromaticContact CD1-CD2 3.72Å; Y351-H355 AromaticContact CE1-CD2 3.53Å; Y351-H355 AromaticContact CE1-NE2 3.78Å; Y351-H355 AromaticContact CE2-CD2 3.94Å; Y351-H355 AromaticContact CE2-NE2 3.65Å; Y351-H355 AromaticContact CZ-CD2 3.64Å; Y351-H355 AromaticContact CZ-NE2 3.39Å; Y351-H355 WeakPolarHBondContact O-CB 3.27Å; Y351-H355 PolarHBondContact O-CD2 2.68Å; Y351-H355 PolarHBondContact O-N 3.39Å; Y351-H355 VanDerWaalsContact O-N 3.11Å
352	T	50.4	Low	44.8	Very low	85 Å²	85	107.4 Å²	107.4	52%	0.521	61%	0.612	S	S	.	*	H	α-helix	trans	-69.2	-37.6	176.6	-49.4	0	0	0	0	111.5	A348 E350 H356	A348-T352 WeakPolarHBondContact O-CB 3.12Å; A348-T352 PolarHBondContact O-N 3.14Å; A348-T352 VanDerWaalsContact O-N 3.13Å; A348-T352 PolarHBondContact O-OG1 3.42Å; E350-T352 VanDerWaalsContact C-N 3.29Å; E350-T352 PolarHBondContact O-N 3.44Å; T352-H356 WeakPolarHBondContact O-CB 3.29Å; T352-H356 PolarHBondContact O-N 3.29Å; T352-H356 VanDerWaalsContact O-N 3.17Å
353	R	43.9	Very low	44.4	Very low	184 Å²	184	110.8 Å²	110.8	69%	0.694	63%	0.63	S	S	*	*	H	α-helix	trans	-64.7	-40	175.4	-105.2	-176	178.9	179.3	-0.1	113.2	A349 E350	A349-R353 PolarHBondContact O-N 3.09Å; A349-R353 VanDerWaalsContact O-N 3.11Å; E350-R353 PolarHBondContact O-N 3.01Å
354	V	48.6	Very low	43.7	Very low	94 Å²	94	112.3 Å²	112.3	57%	0.57	64%	0.642	S	S	*	*	H	α-helix	trans	-80	-26.6	-176.4	-177.7	0	0	0	0	112	E350 T357	E350-V354 VanDerWaalsContact O-CG2 3.3Å; E350-V354 WeakPolarHBondContact O-CG2 3.36Å; E350-V354 PolarHBondContact O-N 3Å; V354-T357 PolarHBondContact O-OG1 3.46Å
355	H	46.5	Very low	42.9	Very low	110 Å²	110	118.4 Å²	118.4	51%	0.509	67%	0.668	S	S	.	*	H	α-helix	trans	-95.6	-12.9	-179.5	-78.1	-87.4	0	0	0	115.5	Y351	Y351-H355 AromaticContact CD1-CD2 3.72Å; Y351-H355 AromaticContact CE1-CD2 3.53Å; Y351-H355 AromaticContact CE1-NE2 3.78Å; Y351-H355 AromaticContact CE2-CD2 3.94Å; Y351-H355 AromaticContact CE2-NE2 3.65Å; Y351-H355 AromaticContact CZ-CD2 3.64Å; Y351-H355 AromaticContact CZ-NE2 3.39Å; Y351-H355 WeakPolarHBondContact O-CB 3.27Å; Y351-H355 PolarHBondContact O-CD2 2.68Å; Y351-H355 PolarHBondContact O-N 3.39Å; Y351-H355 VanDerWaalsContact O-N 3.11Å
356	H	43.4	Very low	42	Very low	165 Å²	165	119.1 Å²	119.1	76%	0.764	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-4.4	175.6	-118.8	70.6	0	0	0	115.1	T352 R358	T352-H356 WeakPolarHBondContact O-CB 3.29Å; T352-H356 PolarHBondContact O-N 3.29Å; T352-H356 VanDerWaalsContact O-N 3.17Å; H356-R358 VanDerWaalsContact C-N 3.32Å
357	T	40	Very low	40.9	Very low	116 Å²	116	123.4 Å²	123.4	71%	0.712	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	6.8	178.9	54.5	0	0	0	0	113.7	V354	V354-T357 PolarHBondContact O-OG1 3.46Å
358	R	35.6	Very low	40.2	Very low	230 Å²	230	124.3 Å²	124.3	87%	0.868	71%	0.706	S	S	*	*	S	Bend	trans	-113.5	41.2	-176.5	-146.2	171.4	179.3	169.9	-2	112.2	H356	H356-R358 VanDerWaalsContact C-N 3.32Å
359	N	31.1	Very low	39.3	Very low	158 Å²	158	131.1 Å²	131.1	85%	0.845	73%	0.728	S	S	*	*			trans	-161.2	70.7	168.5	-149.7	20.1	0	0	0	113.1
360	S	36.1	Very low	38.3	Very low	117 Å²	117	139 Å²	139	82%	0.818	75%	0.747	S	S	*	*			trans	-158.4	141.9	159.3	54.9	0	0	0	0	110.6
361	G	32.9	Very low	37.5	Very low	73 Å²	73	142.1 Å²	142.1	75%	0.753	77%	0.767	S	S	*	*			trans	-69.8	159.3	-158.2	0	0	0	0	0	117.7
362	T	38.9	Very low	36.8	Very low	141 Å²	141	137.4 Å²	137.4	87%	0.865	77%	0.767	S	S	*	*			trans	6.7	146.3	155.7	44.2	0	0	0	0	121.9
363	P	35.7	Very low	35.9	Very low	126 Å²	126	139.6 Å²	139.6	82%	0.818	78%	0.78	S	S	*	*			trans	-97.5	155.7	-160.1	39.1	-32.8	0	0	0	114.4
364	A	32	Very low	35.2	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	79%	0.785	S	S	*	*			trans	-153.5	118.8	157.6	0	0	0	0	0	111.5
365	N	32.6	Very low	34.6	Very low	174 Å²	174	137.6 Å²	137.6	93%	0.93	79%	0.794	S	S	*	*			trans	60.8	129.1	154.8	-81	-18.5	0	0	0	121.8
366	G	32	Very low	33.7	Very low	76 Å²	76	139 Å²	139	78%	0.784	81%	0.805	S	S	*	*			trans	113.3	94.5	139.9	0	0	0	0	0	116.7
367	Q	31.5	Very low	33.1	Very low	190 Å²	190	137.5 Å²	137.5	89%	0.888	81%	0.813	S	S	*	*			trans	20.3	157.1	141.3	-80.2	-116.9	-64.9	0	0	123.2
368	P	38.9	Very low	33	Very low	102 Å²	102	135.8 Å²	135.8	66%	0.662	81%	0.805	S	S	*	*			trans	-101.2	155.3	-136	38.9	-34.1	0	0	0	114.6
369	E	31.8	Very low	33.3	Very low	200 Å²	200	130.7 Å²	130.7	94%	0.935	80%	0.796	S	S	*	*			trans	-136.2	129.3	158.3	-85.2	-164.2	145.4	0	0	112.6
370	Y	28.8	Very low	33.9	Very low	220 Å²	220	128 Å²	128	86%	0.863	79%	0.789	S	S	*	*			trans	-77.6	129.6	172	-151.9	-96.9	0	0	0	107.9
371	N	33	Very low	34.1	Very low	167 Å²	167	125.5 Å²	125.5	89%	0.893	78%	0.775	S	S	*	*			trans	-152	121.8	152.2	-120.4	-12.1	0	0	0	111.2
372	G	28.7	Very low	34.5	Very low	61 Å²	61	124.6 Å²	124.6	63%	0.629	76%	0.761	S	S	*	*			trans	-74.5	157.4	-172.6	0	0	0	0	0	113.5
373	V	31.9	Very low	34.6	Very low	131 Å²	131	123.2 Å²	123.2	79%	0.794	75%	0.748	S	S	*	*			trans	-129.6	105.9	153.9	-175.8	0	0	0	0	106.8	V375	V373-V375 HydrophobicContact CG1-CG2 3.8Å
374	S	30.1	Very low	35	Very low	114 Å²	114	119.2 Å²	119.2	80%	0.797	73%	0.725	S	S	*	*			trans	-62.8	127.7	161.4	48.6	0	0	0	0	109.2
375	V	35.2	Very low	35.9	Very low	123 Å²	123	117.5 Å²	117.5	75%	0.745	71%	0.705	S	S	*	*			trans	-138.6	108	163.6	-146.1	0	0	0	0	110.3	V373	V373-V375 HydrophobicContact CG1-CG2 3.8Å
376	D	26.5	Very low	36.6	Very low	140 Å²	140	115.6 Å²	115.6	75%	0.749	69%	0.692	S	S	*	*			trans	-57.6	150.8	170.8	-82.8	-51.1	0	0	0	113.7	S378	D376-S378 PolarHBondContact O-N 3.13Å; D376-S378 PolarHBondContact O-OG 2.99Å; D376-S378 VanDerWaalsContact O-OG 3.12Å
377	S	31.8	Very low	37.5	Very low	132 Å²	132	117.6 Å²	117.6	92%	0.923	69%	0.685	S	S	*	*	S	Bend	trans	58	11.6	145.2	-123.5	0	0	0	0	121.8
378	S	37.2	Very low	38.5	Very low	80 Å²	80	112.6 Å²	112.6	56%	0.559	66%	0.663	S	S	*	*			trans	-103.8	5.4	-172.7	-52.9	0	0	0	0	116.1	D376 S380 A381	D376-S378 PolarHBondContact O-N 3.13Å; D376-S378 PolarHBondContact O-OG 2.99Å; D376-S378 VanDerWaalsContact O-OG 3.12Å; S378-S380 PolarHBondContact O-N 3.13Å; S378-A381 PolarHBondContact O-N 3.31Å
379	N	43.1	Very low	39.1	Very low	124 Å²	124	111.4 Å²	111.4	66%	0.663	65%	0.651	S	S	*	*	H	α-helix	trans	-68.1	-10.3	-169.6	-78.5	-20.1	0	0	0	116	L383	N379-L383 VanDerWaalsContact O-CB 3.25Å; N379-L383 WeakPolarHBondContact O-CB 3.49Å; N379-L383 WeakPolarHBondContact O-CD1 3.39Å; N379-L383 WeakPolarHBondContact O-CG 3.39Å; N379-L383 PolarHBondContact O-N 3.19Å; N379-L383 VanDerWaalsContact O-N 3.1Å
380	S	43.7	Very low	40	Very low	101 Å²	101	105 Å²	105	71%	0.706	63%	0.628	S	S	*	*	H	α-helix	trans	-68.1	-40.2	173.9	-179.2	0	0	0	0	111.9	S378 A384	S378-S380 PolarHBondContact O-N 3.13Å; S380-A384 WeakPolarHBondContact O-CB 3.15Å; S380-A384 PolarHBondContact O-N 3.35Å
381	A	39.3	Very low	41	Very low	64 Å²	64	96.9 Å²	96.9	53%	0.529	60%	0.6	S	S	.	*	H	α-helix	trans	-73.8	-40.4	-178.8	0	0	0	0	0	111.8	S378 A384 T385	S378-A381 PolarHBondContact O-N 3.31Å; A381-A384 PolarHBondContact O-N 3.38Å; A381-T385 WeakPolarHBondContact O-CB 3.47Å; A381-T385 PolarHBondContact O-N 3.19Å; A381-T385 PolarHBondContact O-OG1 3.42Å
382	A	41.2	Very low	42.1	Very low	54 Å²	54	90.7 Å²	90.7	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-42	177.2	0	0	0	0	0	112	T385 M386	A382-T385 PolarHBondContact O-N 3.1Å; A382-M386 WeakPolarHBondContact O-CB 3.47Å; A382-M386 WeakPolarHBondContact O-CG 3.4Å; A382-M386 PolarHBondContact O-N 2.87Å
383	L	42.7	Very low	43.5	Very low	113 Å²	113	93.5 Å²	93.5	59%	0.592	57%	0.569	S	S	*	*	H	α-helix	trans	-68.4	-38.1	173.8	-78	165.3	0	0	0	112.4	N379 T385 M386 N387	N379-L383 VanDerWaalsContact O-CB 3.25Å; N379-L383 WeakPolarHBondContact O-CB 3.49Å; N379-L383 WeakPolarHBondContact O-CD1 3.39Å; N379-L383 WeakPolarHBondContact O-CG 3.39Å; N379-L383 PolarHBondContact O-N 3.19Å; N379-L383 VanDerWaalsContact O-N 3.1Å; L383-T385 VanDerWaalsContact C-N 3.32Å; L383-M386 PolarHBondContact O-N 2.88Å; L383-N387 WeakPolarHBondContact O-CB 3.28Å; L383-N387 PolarHBondContact O-N 3.42Å
384	A	44.1	Very low	44.8	Very low	42 Å²	42	89.6 Å²	89.6	35%	0.347	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-40.7	173	0	0	0	0	0	111.3	S380 A381 N387 I388	S380-A384 WeakPolarHBondContact O-CB 3.15Å; S380-A384 PolarHBondContact O-N 3.35Å; A381-A384 PolarHBondContact O-N 3.38Å; A384-N387 PolarHBondContact O-N 3.32Å; A384-I388 WeakPolarHBondContact O-CB 3.29Å; A384-I388 WeakPolarHBondContact O-CD1 3.37Å; A384-I388 WeakPolarHBondContact O-CG1 3.4Å; A384-I388 PolarHBondContact O-N 2.8Å
385	T	49.9	Very low	46.1	Very low	60 Å²	60	85.2 Å²	85.2	37%	0.368	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-41.3	176.7	-49.9	0	0	0	0	111.1	A381 A382 L383 I388 L389	A381-T385 WeakPolarHBondContact O-CB 3.47Å; A381-T385 PolarHBondContact O-N 3.19Å; A381-T385 PolarHBondContact O-OG1 3.42Å; A382-T385 PolarHBondContact O-N 3.1Å; L383-T385 VanDerWaalsContact C-N 3.32Å; T385-I388 PolarHBondContact O-N 3.31Å; T385-L389 HydrophobicContact CG2-CD1 4.17Å; T385-L389 WeakPolarHBondContact O-CB 3.3Å; T385-L389 WeakPolarHBondContact O-CG 3.4Å; T385-L389 PolarHBondContact O-N 2.93Å
386	M	48.4	Very low	47	Very low	134 Å²	134	80.2 Å²	80.2	66%	0.66	49%	0.486	S	S	*	.	H	α-helix	trans	-66.2	-36.4	175.3	-70.5	-76.6	-91.5	0	0	112.5	A382 L383 L389 S390	A382-M386 WeakPolarHBondContact O-CB 3.47Å; A382-M386 WeakPolarHBondContact O-CG 3.4Å; A382-M386 PolarHBondContact O-N 2.87Å; L383-M386 PolarHBondContact O-N 2.88Å; M386-L389 PolarHBondContact O-N 2.85Å; M386-S390 PolarHBondContact O-N 3.4Å; M386-S390 VanDerWaalsContact O-N 3.14Å
387	N	49.1	Very low	48.5	Very low	118 Å²	118	76.4 Å²	76.4	63%	0.631	47%	0.474	S	S	*	.	H	α-helix	trans	-68.9	-38	173.3	-92.7	-16.3	0	0	0	112.7	L383 A384 L389 S390	L383-N387 WeakPolarHBondContact O-CB 3.28Å; L383-N387 PolarHBondContact O-N 3.42Å; A384-N387 PolarHBondContact O-N 3.32Å; N387-L389 VanDerWaalsContact C-N 3.32Å; N387-S390 WeakPolarHBondContact O-CB 3.35Å; N387-S390 PolarHBondContact O-N 2.9Å; N387-S390 PolarHBondContact O-OG 3.44Å
388	I	52.8	Low	49.7	Very low	84 Å²	84	73 Å²	73	43%	0.431	44%	0.444	S	S	.	.	H	α-helix	trans	-64.4	-39.1	174.7	-71.1	165.7	0	0	0	110.5	A384 T385 S390 V394 I398	A384-I388 WeakPolarHBondContact O-CB 3.29Å; A384-I388 WeakPolarHBondContact O-CD1 3.37Å; A384-I388 WeakPolarHBondContact O-CG1 3.4Å; A384-I388 PolarHBondContact O-N 2.8Å; T385-I388 PolarHBondContact O-N 3.31Å; I388-S390 VanDerWaalsContact C-N 3.29Å; I388-S390 PolarHBondContact O-N 3.5Å; I388-V394 HydrophobicContact CG2-CG1 3.46Å; I388-V394 VanDerWaalsContact CG2-CG1 3.46Å; I388-V394 WeakPolarHBondContact O-CB 3.36Å; I388-V394 WeakPolarHBondContact O-CG1 3.47Å; I388-I398 HydrophobicContact CG2-CD1 3.79Å
389	L	51.8	Low	50.7	Low	77 Å²	77	72.2 Å²	72.2	40%	0.403	44%	0.436	S	S	.	.	H	α-helix	trans	-75.7	-12.6	177.9	-67.6	169.2	0	0	0	114.2	T385 M386 N387 N391 V395	T385-L389 HydrophobicContact CG2-CD1 4.17Å; T385-L389 WeakPolarHBondContact O-CB 3.3Å; T385-L389 WeakPolarHBondContact O-CG 3.4Å; T385-L389 PolarHBondContact O-N 2.93Å; M386-L389 PolarHBondContact O-N 2.85Å; N387-L389 VanDerWaalsContact C-N 3.32Å; L389-N391 VanDerWaalsContact C-N 3.29Å; L389-N391 PolarHBondContact O-N 3.35Å; L389-V395 HydrophobicContact CB-CG2 4.43Å; L389-V395 HydrophobicContact CD2-CG2 4.09Å; L389-V395 WeakPolarHBondContact O-CG2 3.45Å
390	S	51.4	Low	51.2	Low	66 Å²	66	69.5 Å²	69.5	46%	0.462	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-15	178	75	0	0	0	0	113.8	M386 N387 I388 P392	M386-S390 PolarHBondContact O-N 3.4Å; M386-S390 VanDerWaalsContact O-N 3.14Å; N387-S390 WeakPolarHBondContact O-CB 3.35Å; N387-S390 PolarHBondContact O-N 2.9Å; N387-S390 PolarHBondContact O-OG 3.44Å; I388-S390 VanDerWaalsContact C-N 3.29Å; I388-S390 PolarHBondContact O-N 3.5Å; S390-P392 WeakPolarHBondContact O-CD 3.39Å
391	N	49.8	Very low	51.8	Low	49 Å²	49	67.8 Å²	67.8	26%	0.262	42%	0.419	S	S	.	.			trans	-98.9	110.9	178.1	-172.7	-23.2	0	0	0	109.7	L389 N393 V394 V395	L389-N391 VanDerWaalsContact C-N 3.29Å; L389-N391 PolarHBondContact O-N 3.35Å; N391-N393 PolarHBondContact O-N 3.34Å; N391-N393 VanDerWaalsContact O-N 3.09Å; N391-N393 WeakPolarHBondContact OD1-CB 3.04Å; N391-N393 PolarHBondContact OD1-N 2.8Å; N391-V394 HydrophobicContact CB-CB 3.98Å; N391-V394 HydrophobicContact CB-CG2 3.68Å; N391-V394 WeakPolarHBondContact O-CA 3.43Å; N391-V394 WeakPolarHBondContact O-CB 3.5Å; N391-V394 PolarHBondContact O-N 2.76Å; N391-V395 PolarHBondContact O-N 3.45Å
392	P	56	Low	52.3	Low	38 Å²	38	68.1 Å²	68.1	25%	0.247	42%	0.422	C	S	.	.	H	α-helix	trans	-59	-27.3	-177.6	22.9	-32.7	0	0	0	112.7	V163 S390 A396	V163-P392 HydrophobicContact CG1-CB 4.12Å; S390-P392 WeakPolarHBondContact O-CD 3.39Å; P392-A396 VanDerWaalsContact O-CB 3.25Å; P392-A396 WeakPolarHBondContact O-CB 3.44Å; P392-A396 PolarHBondContact O-N 3.17Å
393	N	57.5	Low	52.7	Low	119 Å²	119	70 Å²	70	64%	0.636	43%	0.427	S	S	*	.	H	α-helix	trans	-72.3	-31.7	175.5	-60	-43.2	0	0	0	112.5	N391 A397	N391-N393 PolarHBondContact O-N 3.34Å; N391-N393 VanDerWaalsContact O-N 3.09Å; N391-N393 WeakPolarHBondContact OD1-CB 3.04Å; N391-N393 PolarHBondContact OD1-N 2.8Å; N393-A397 WeakPolarHBondContact O-CB 3.3Å; N393-A397 PolarHBondContact O-N 2.95Å
394	V	59.1	Low	52.6	Low	49 Å²	49	67.6 Å²	67.6	30%	0.297	43%	0.43	S	S	.	.	H	α-helix	trans	-77.6	-39.6	178	178.7	0	0	0	0	109.9	I388 N391 A396 A397 I398	I388-V394 HydrophobicContact CG2-CG1 3.46Å; I388-V394 VanDerWaalsContact CG2-CG1 3.46Å; I388-V394 WeakPolarHBondContact O-CB 3.36Å; I388-V394 WeakPolarHBondContact O-CG1 3.47Å; N391-V394 HydrophobicContact CB-CB 3.98Å; N391-V394 HydrophobicContact CB-CG2 3.68Å; N391-V394 WeakPolarHBondContact O-CA 3.43Å; N391-V394 WeakPolarHBondContact O-CB 3.5Å; N391-V394 PolarHBondContact O-N 2.76Å; V394-A396 VanDerWaalsContact C-N 3.35Å; V394-A397 PolarHBondContact O-N 3.32Å; V394-I398 HydrophobicContact CG1-CD1 3.79Å; V394-I398 HydrophobicContact CG1-CG1 4.44Å; V394-I398 WeakPolarHBondContact O-CB 3.46Å; V394-I398 WeakPolarHBondContact O-CD1 3.19Å; V394-I398 WeakPolarHBondContact O-CG1 3.19Å; V394-I398 PolarHBondContact O-N 3.33Å
395	V	58.4	Low	52.5	Low	23 Å²	23	69 Å²	69	14%	0.139	44%	0.442	C	S	.	.	H	α-helix	trans	-59.9	-45.8	170.1	179.4	0	0	0	0	110.5	L389 N391 A397 I398 V399	L389-V395 HydrophobicContact CB-CG2 4.43Å; L389-V395 HydrophobicContact CD2-CG2 4.09Å; L389-V395 WeakPolarHBondContact O-CG2 3.45Å; N391-V395 PolarHBondContact O-N 3.45Å; V395-A397 PolarHBondContact O-N 2.99Å; V395-I398 PolarHBondContact O-N 3.45Å; V395-V399 HydrophobicContact CG1-CG2 4.23Å; V395-V399 WeakPolarHBondContact O-CB 3.43Å; V395-V399 VanDerWaalsContact O-CG2 3.24Å; V395-V399 WeakPolarHBondContact O-CG2 3.5Å; V395-V399 PolarHBondContact O-N 2.91Å
396	A	53.8	Low	51.9	Low	18 Å²	18	69 Å²	69	15%	0.149	45%	0.453	C	S	.	.	H	α-helix	trans	-60	-42.6	175.6	0	0	0	0	0	112.7	A167 P392 V394 S400	A167-A396 HydrophobicContact CB-CB 3.47Å; A167-A396 VanDerWaalsContact CB-CB 3.47Å; P392-A396 VanDerWaalsContact O-CB 3.25Å; P392-A396 WeakPolarHBondContact O-CB 3.44Å; P392-A396 PolarHBondContact O-N 3.17Å; V394-A396 VanDerWaalsContact C-N 3.35Å; A396-S400 WeakPolarHBondContact O-CB 3.46Å; A396-S400 PolarHBondContact O-N 3.21Å
397	A	57.7	Low	51.3	Low	60 Å²	60	70.5 Å²	70.5	50%	0.496	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-39.8	176.9	0	0	0	0	0	112.4	N393 V394 V395 A401	N393-A397 WeakPolarHBondContact O-CB 3.3Å; N393-A397 PolarHBondContact O-N 2.95Å; V394-A397 PolarHBondContact O-N 3.32Å; V395-A397 PolarHBondContact O-N 2.99Å; A397-A401 VanDerWaalsContact O-CB 3.29Å; A397-A401 WeakPolarHBondContact O-CB 3.44Å; A397-A401 PolarHBondContact O-N 3.03Å
398	I	57.6	Low	50.5	Low	59 Å²	59	71.5 Å²	71.5	30%	0.303	48%	0.475	S	S	.	.	H	α-helix	trans	-68.5	-44.8	177.3	-68	164	0	0	0	110.7	L347 I388 V394 V395 A401 A402	L347-I398 HydrophobicContact CD2-CG2 4.44Å; I388-I398 HydrophobicContact CG2-CD1 3.79Å; V394-I398 HydrophobicContact CG1-CD1 3.79Å; V394-I398 HydrophobicContact CG1-CG1 4.44Å; V394-I398 WeakPolarHBondContact O-CB 3.46Å; V394-I398 WeakPolarHBondContact O-CD1 3.19Å; V394-I398 WeakPolarHBondContact O-CG1 3.19Å; V394-I398 PolarHBondContact O-N 3.33Å; V395-I398 PolarHBondContact O-N 3.45Å; I398-A401 PolarHBondContact O-N 3.45Å; I398-A402 VanDerWaalsContact O-CB 3.27Å; I398-A402 WeakPolarHBondContact O-CB 3.4Å; I398-A402 PolarHBondContact O-N 3.25Å
399	V	57.9	Low	49.6	Very low	64 Å²	64	71 Å²	71	39%	0.388	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-41.6	176.7	172	0	0	0	0	110.6	V395 A401 A402 T403	V395-V399 HydrophobicContact CG1-CG2 4.23Å; V395-V399 WeakPolarHBondContact O-CB 3.43Å; V395-V399 VanDerWaalsContact O-CG2 3.24Å; V395-V399 WeakPolarHBondContact O-CG2 3.5Å; V395-V399 PolarHBondContact O-N 2.91Å; V399-A401 VanDerWaalsContact C-N 3.29Å; V399-A401 PolarHBondContact O-N 3.29Å; V399-A402 PolarHBondContact O-N 2.92Å; V399-T403 HydrophobicContact CG1-CG2 4.13Å; V399-T403 WeakPolarHBondContact O-CB 3.46Å; V399-T403 VanDerWaalsContact O-CG2 3.3Å; V399-T403 WeakPolarHBondContact O-CG2 3.25Å; V399-T403 PolarHBondContact O-N 3.09Å; V399-T403 PolarHBondContact O-OG1 3.09Å
400	S	53.7	Low	48.9	Very low	67 Å²	67	75.4 Å²	75.4	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-32.2	174.3	-176.4	0	0	0	0	112.7	A396	A396-S400 WeakPolarHBondContact O-CB 3.46Å; A396-S400 PolarHBondContact O-N 3.21Å
401	A	56.6	Low	48	Very low	65 Å²	65	76.4 Å²	76.4	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-77.6	-35	174.9	0	0	0	0	0	112.7	A397 I398 V399	A397-A401 VanDerWaalsContact O-CB 3.29Å; A397-A401 WeakPolarHBondContact O-CB 3.44Å; A397-A401 PolarHBondContact O-N 3.03Å; I398-A401 PolarHBondContact O-N 3.45Å; V399-A401 VanDerWaalsContact C-N 3.29Å; V399-A401 PolarHBondContact O-N 3.29Å
402	A	49.6	Very low	47.2	Very low	72 Å²	72	76.1 Å²	76.1	60%	0.595	51%	0.508	S	S	*	.	H	α-helix	trans	-78.7	-30.8	-179.6	0	0	0	0	0	113.3	I398 V399 G404	I398-A402 VanDerWaalsContact O-CB 3.27Å; I398-A402 WeakPolarHBondContact O-CB 3.4Å; I398-A402 PolarHBondContact O-N 3.25Å; V399-A402 PolarHBondContact O-N 2.92Å; A402-G404 VanDerWaalsContact C-N 3.27Å; A402-G404 PolarHBondContact O-N 2.89Å
403	T	48.3	Very low	46.1	Very low	92 Å²	92	81 Å²	81	56%	0.564	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-2	178.8	51.8	0	0	0	0	113.5	V399 A405	V399-T403 HydrophobicContact CG1-CG2 4.13Å; V399-T403 WeakPolarHBondContact O-CB 3.46Å; V399-T403 VanDerWaalsContact O-CG2 3.3Å; V399-T403 WeakPolarHBondContact O-CG2 3.25Å; V399-T403 PolarHBondContact O-N 3.09Å; V399-T403 PolarHBondContact O-OG1 3.09Å; T403-A405 PolarHBondContact O-N 3.15Å
404	G	42	Very low	45.1	Very low	63 Å²	63	80.9 Å²	80.9	65%	0.649	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	15.3	-180	0	0	0	0	0	113.9	A402 G406	A402-G404 VanDerWaalsContact C-N 3.27Å; A402-G404 PolarHBondContact O-N 2.89Å; G404-G406 PolarHBondContact O-N 3.33Å
405	A	40.9	Very low	44	Very low	73 Å²	73	82.2 Å²	82.2	60%	0.603	56%	0.564	S	S	*	*			trans	-82.2	53.2	-176.2	0	0	0	0	0	111.7	T403	T403-A405 PolarHBondContact O-N 3.15Å
406	G	37.6	Very low	42.9	Very low	58 Å²	58	85.9 Å²	85.9	60%	0.598	60%	0.597	S	S	*	*	S	Bend	trans	-98.2	105.7	163.3	0	0	0	0	0	109.5	G404 T408	G404-G406 PolarHBondContact O-N 3.33Å; G406-T408 PolarHBondContact O-N 3.11Å
407	N	36.2	Very low	42.1	Very low	167 Å²	167	97.3 Å²	97.3	89%	0.893	65%	0.654	S	S	*	*			trans	38.2	78.9	158.3	-81.7	-3.6	0	0	0	117.3	S409	N407-S409 PolarHBondContact O-N 3.22Å
408	T	31.9	Very low	41.3	Very low	138 Å²	138	99.2 Å²	99.2	85%	0.847	66%	0.662	S	S	*	*			trans	-88.3	82.3	155	46	0	0	0	0	109.2	G406 M410	G406-T408 PolarHBondContact O-N 3.11Å; T408-M410 PolarHBondContact O-N 3.47Å; T408-M410 VanDerWaalsContact O-N 3.11Å
409	S	34.3	Very low	40.5	Very low	74 Å²	74	101.3 Å²	101.3	52%	0.517	68%	0.681	S	S	.	*			trans	-64.7	112.3	163.2	61.6	0	0	0	0	108.1	N407 L411	N407-S409 PolarHBondContact O-N 3.22Å; S409-L411 PolarHBondContact O-N 2.87Å; S409-L411 VanDerWaalsContact O-N 3.15Å
410	M	36.1	Very low	39.5	Very low	170 Å²	170	103.3 Å²	103.3	84%	0.837	70%	0.697	S	S	*	*			trans	-48.2	118.2	175.7	-71.1	-150.6	179.9	0	0	111.7	S328 T408 G412	S328-M410 PolarHBondContact OG-O 2.89Å; T408-M410 PolarHBondContact O-N 3.47Å; T408-M410 VanDerWaalsContact O-N 3.11Å; M410-G412 PolarHBondContact O-N 3.27Å
411	L	32.3	Very low	38.7	Very low	86 Å²	86	105.5 Å²	105.5	45%	0.45	71%	0.71	S	S	.	*			trans	-74.1	100.3	161.4	-85.5	135.9	0	0	0	108.1	R329 N330 S409	R329-L411 HydrophobicContact CB-CD2 3.87Å; R329-L411 HydrophobicContact CB-CG 4.43Å; R329-L411 HydrophobicContact CG-CB 3.98Å; R329-L411 HydrophobicContact CG-CD2 3.39Å; R329-L411 HydrophobicContact CG-CG 3.73Å; R329-L411 VanDerWaalsContact CZ-C 3.41Å; R329-L411 VanDerWaalsContact NE-CB 3.25Å; R329-L411 PolarHBondContact NH2-O 3.32Å; N330-L411 HydrophobicContact CB-CD1 4.39Å; N330-L411 HydrophobicContact CB-CD2 3.69Å; N330-L411 HydrophobicContact CB-CG 4.05Å; S409-L411 PolarHBondContact O-N 2.87Å; S409-L411 VanDerWaalsContact O-N 3.15Å
412	G	34.5	Very low	37.5	Very low	44 Å²	44	108 Å²	108	45%	0.454	72%	0.721	S	S	.	*			trans	-88.6	127.2	169.6	0	0	0	0	0	114.2	S328 R329 M410	S328-G412 PolarHBondContact OG-N 2.98Å; R329-G412 VanDerWaalsContact NE-C 3.28Å; R329-G412 PolarHBondContact NE-O 2.8Å; R329-G412 PolarHBondContact NH2-O 2.75Å; M410-G412 PolarHBondContact O-N 3.27Å
413	N	31.5	Very low	36.7	Very low	139 Å²	139	110.4 Å²	110.4	74%	0.743	73%	0.73	S	S	*	*			trans	-63.4	141.3	178.6	-176.1	32.4	0	0	0	112.6
414	S	37.7	Very low	35.9	Very low	118 Å²	118	111.7 Å²	111.7	83%	0.825	74%	0.742	S	S	*	*			trans	-165.9	121.7	156.4	-74	0	0	0	0	109.6
415	G	35.3	Very low	35.5	Very low	76 Å²	76	115.5 Å²	115.5	78%	0.784	75%	0.749	S	S	*	*			trans	-84.9	164.9	176.5	0	0	0	0	0	113.9
416	A	36.1	Very low	35	Very low	101 Å²	101	119 Å²	119	84%	0.835	76%	0.761	S	S	*	*			trans	-166.4	127.8	154.5	0	0	0	0	0	108.8
417	L	36.7	Very low	34.8	Very low	257 Å²	257	124.5 Å²	124.5	100%	1.346	78%	0.776	S	S	*	*			trans	82.7	0	-172.5	-59.3	176.4	0	0	0	116.6

Retrieved 417 of 417 residues in 66.6 ms (Link to these results)

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