A0A077Z1Y0_TRITR Loading...

Inositol-pentakisphosphate 2-kinase

Phosphorylates Ins(1,3,4,5,6)P5 at position 2 to form Ins(1,2,3,4,5,6)P6 (InsP6 or phytate).

AlphaFold DB , UniProt , Accession A0A077Z1Y0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 408 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	51.4	Low	58.8	Low	116 Å²	116	92.1 Å²	92.1	57%	0.571	52%	0.519	S	S	*	.				0	144.1	0	-83.3	179.4	176.5	0	0	107.9	T57 F61	M1-T57 HydrophobicContact CE-CG2 3.97Å; M1-T57 HydrophobicContact SD-CG2 3.51Å; M1-T57 VanDerWaalsContact SD-CG2 3.51Å; M1-F61 HydrophobicContact CE-CB 3.99Å; M1-F61 HydrophobicContact CE-CG 4.38Å
2	N	64.2	Low	60	Low	158 Å²	158	97 Å²	97	85%	0.845	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-75.7	127.3	171.2	-70.5	-13.5	0	0	0	108.6	A4	N2-A4 PolarHBondContact O-N 3.17Å
3	V	62.7	Low	62	Low	54 Å²	54	90.1 Å²	90.1	33%	0.327	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-73.2	120.1	167	-179.2	0	0	0	0	106.6	Y50 L77 Y108	V3-Y50 HydrophobicContact CG2-CE2 3.79Å; V3-L77 HydrophobicContact CG2-CD2 4.13Å; V3-L77 HydrophobicContact CG2-CG 4.45Å; V3-Y108 HydrophobicContact CG1-CE1 4.23Å; V3-Y108 HydrophobicContact CG2-CE1 4.47Å
4	A	68.9	Low	63.9	Low	30 Å²	30	88.7 Å²	88.7	25%	0.248	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.3	170.9	0	0	0	0	0	109.1	N2 Q76 L77 I78 S79	N2-A4 PolarHBondContact O-N 3.17Å; A4-Q76 VanDerWaalsContact CB-NE2 3.32Å; A4-L77 PolarHBondContact N-O 3.24Å; A4-I78 HydrophobicContact CB-CG2 4.35Å; A4-I78 WeakPolarHBondContact O-CA 3.45Å; A4-S79 PolarHBondContact O-N 3.29Å
5	V	62.2	Low	65.6	Low	127 Å²	127	86.9 Å²	86.9	77%	0.77	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.8	164.2	-178.9	0	0	0	0	106.6	D7	V5-D7 PolarHBondContact O-N 3.44Å
6	S	59.6	Low	67	Low	23 Å²	23	84.3 Å²	84.3	16%	0.161	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-67.1	126.1	174.6	-177.8	0	0	0	0	109.4	S79	S6-S79 PolarHBondContact N-O 3.02Å
7	D	56.8	Low	68.2	Low	129 Å²	129	80.4 Å²	80.4	69%	0.69	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-59.5	141.3	157	-70.9	-35.2	0	0	0	108.2	V5	V5-D7 PolarHBondContact O-N 3.44Å
8	R	54	Low	69.1	Low	218 Å²	218	79 Å²	79	82%	0.823	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-54.5	126.6	174.3	-78.3	-174.9	-179.5	-176	-0.1	108.4	A10	R8-A10 PolarHBondContact O-N 3.42Å
9	P	55.9	Low	69.8	Low	18 Å²	18	76.5 Å²	76.5	12%	0.117	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-60.2	142.5	177.5	26.5	-34.9	0	0	0	109.8	A11 F27 W36 L84	P9-A11 PolarHBondContact O-N 3.23Å; P9-F27 HydrophobicContact CB-CB 4.33Å; P9-F27 HydrophobicContact CB-CD2 3.81Å; P9-F27 HydrophobicContact CB-CG 4.39Å; P9-W36 HydrophobicContact CG-CH2 3.9Å; P9-L84 HydrophobicContact CG-CD1 4.22Å; P9-L84 HydrophobicContact CG-CD2 4.2Å
10	A	51.1	Low	70.4	Confident	98 Å²	98	80.5 Å²	80.5	81%	0.81	44%	0.443	S	S	*	.	S	Bend	trans	-68.1	-15	176.9	0	0	0	0	0	112.9	R8	R8-A10 PolarHBondContact O-N 3.42Å
11	A	60.3	Low	71.1	Confident	42 Å²	42	79.7 Å²	79.7	35%	0.347	44%	0.443	S	S	.	.	S	Bend	trans	-125.2	159.2	-176.7	0	0	0	0	0	112.3	P9 A13 E28	P9-A11 PolarHBondContact O-N 3.23Å; A11-A13 PolarHBondContact O-N 3.42Å; A11-E28 HydrophobicContact CB-CB 4.16Å
12	I	73	Confident	72.9	Confident	151 Å²	151	74.8 Å²	74.8	77%	0.774	42%	0.419	S	S	*	.			trans	-62.6	123.9	177.8	-59.1	171.4	0	0	0	109.5
13	A	86.1	Confident	74.1	Confident	7 Å²	7	67.3 Å²	67.3	6%	0.058	38%	0.378	C	S	.	.			trans	-65.3	140.2	171.9	0	0	0	0	0	110.4	A11 I25 G26 W36 V88	A11-A13 PolarHBondContact O-N 3.42Å; A13-I25 HydrophobicContact CB-CG2 3.77Å; A13-G26 CarbonylContact C-O 3.6Å; A13-G26 WeakPolarHBondContact CA-O 3.38Å; A13-W36 HydrophobicContact CB-CZ3 4.4Å; A13-V88 HydrophobicContact CB-CG2 3.98Å
14	Y	88.3	Confident	75.6	Confident	71 Å²	71	66.3 Å²	66.3	28%	0.278	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.5	-176.8	57.6	-93.3	0	0	0	112	R16 I25 G26	Y14-R16 PolarHBondContact O-N 3.44Å; Y14-I25 CarbonylContact O-C 3.45Å; Y14-I25 WeakPolarHBondContact O-CA 3.4Å; Y14-G26 VanDerWaalsContact CD1-O 3.3Å; Y14-G26 WeakPolarHBondContact CD1-O 3.42Å; Y14-G26 VanDerWaalsContact CE1-C 3.5Å; Y14-G26 PolarHBondContact N-O 3.36Å; Y14-G26 PolarHBondContact O-N 2.77Å
15	F	89.6	Confident	76.7	Confident	62 Å²	62	64.9 Å²	64.9	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.6	175.1	176.5	-103.9	0	0	0	110.9	G17 E18 I23 V88 H90	F15-G17 VanDerWaalsContact CE2-O 3.22Å; F15-G17 WeakPolarHBondContact CE2-O 3.17Å; F15-G17 VanDerWaalsContact CZ-C 3.41Å; F15-G17 VanDerWaalsContact CZ-CA 3.44Å; F15-E18 HydrophobicContact CE2-CB 4.21Å; F15-E18 HydrophobicContact CZ-CB 4.06Å; F15-I23 HydrophobicContact CD2-CG2 4.14Å; F15-I23 HydrophobicContact CE2-CG2 4.07Å; F15-V88 HydrophobicContact CB-CG1 4.08Å; F15-H90 HydrophobicContact CB-CB 3.88Å; F15-H90 HydrophobicContact CD1-CB 4.41Å; F15-H90 AromaticContact CD1-CD2 3.17Å; F15-H90 WeakPolarHBondContact CD1-CD2 3.4Å; F15-H90 AromaticContact CD1-CG 3.74Å; F15-H90 AromaticContact CD1-NE2 3.54Å; F15-H90 HydrophobicContact CD2-CB 3.26Å; F15-H90 AromaticContact CD2-CD2 3.54Å; F15-H90 AromaticContact CD2-CG 3.52Å; F15-H90 AromaticContact CE1-CD2 3.33Å; F15-H90 WeakPolarHBondContact CE1-CD2 3.3Å; F15-H90 AromaticContact CE1-NE2 3.81Å; F15-H90 HydrophobicContact CE2-CB 3.79Å; F15-H90 AromaticContact CE2-CD2 3.67Å; F15-H90 HydrophobicContact CG-CB 3.6Å; F15-H90 AromaticContact CG-CD2 3.26Å; F15-H90 WeakPolarHBondContact CG-CD2 3.41Å; F15-H90 AromaticContact CG-CG 3.33Å; F15-H90 AromaticContact CG-ND1 3.96Å; F15-H90 AromaticContact CG-NE2 3.96Å; F15-H90 AromaticContact CZ-CD2 3.56Å
16	R	89	Confident	78.2	Confident	44 Å²	44	58.8 Å²	58.8	17%	0.166	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-35.9	179.3	-170.4	59	162.1	176.7	-4.3	112.9	Y14 V24 V35 D114 C116 G207	Y14-R16 PolarHBondContact O-N 3.44Å; R16-V24 WeakPolarHBondContact CA-O 2.83Å; R16-V24 HydrophobicContact CB-CB 4.12Å; R16-V24 HydrophobicContact CB-CG1 3.88Å; R16-V24 VanDerWaalsContact CB-O 3.31Å; R16-V24 WeakPolarHBondContact CB-O 3.33Å; R16-V24 HydrophobicContact CG-CG1 4.04Å; R16-V24 PolarHBondContact N-O 2.9Å; R16-V35 HydrophobicContact CG-CG1 4.13Å; R16-D114 IonicContact CZ-OD1 3.63Å; R16-D114 IonicContact CZ-OD2 3.76Å; R16-D114 IonicContact NE-OD1 3.93Å; R16-D114 IonicContact NE-OD2 2.82Å; R16-D114 PolarHBondContact NE-OD2 3.18Å; R16-D114 IonicContact NH2-OD1 3.62Å; R16-D114 PolarHBondContact NH2-OD1 3.48Å; R16-D114 IonicContact NH2-OD2 3.2Å; R16-D114 PolarHBondContact NH2-OD2 3.34Å; R16-C116 VanDerWaalsContact NH2-CB 3.27Å; R16-G207 VanDerWaalsContact CZ-CA 3.41Å; R16-G207 VanDerWaalsContact NH1-CA 3.27Å; R16-G207 PolarHBondContact NH1-O 3.42Å
17	G	86.6	Confident	79.7	Confident	19 Å²	19	57.8 Å²	57.8	20%	0.196	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166	-178.9	-177	0	0	0	0	0	112	F15 V24	F15-G17 VanDerWaalsContact CE2-O 3.22Å; F15-G17 WeakPolarHBondContact CE2-O 3.17Å; F15-G17 VanDerWaalsContact CZ-C 3.41Å; F15-G17 VanDerWaalsContact CZ-CA 3.44Å; G17-V24 PolarHBondContact N-O 2.72Å; G17-V24 WeakPolarHBondContact O-CA 3.27Å; G17-V24 PolarHBondContact O-N 3.05Å
18	E	85	Confident	81.3	Confident	55 Å²	55	54.8 Å²	54.8	26%	0.257	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	131.5	-175.4	-165.9	-177	148	0	0	109.1	F15 K40 R93 H94	F15-E18 HydrophobicContact CE2-CB 4.21Å; F15-E18 HydrophobicContact CZ-CB 4.06Å; E18-K40 WeakPolarHBondContact OE1-CE 3.45Å; E18-K40 IonicContact OE1-NZ 2.99Å; E18-K40 PolarHBondContact OE1-NZ 2.71Å; E18-R93 IonicContact OE2-NH1 4Å; E18-R93 PolarHBondContact OE2-NH1 3.18Å; E18-H94 IonicContact OE1-CE1 3.3Å; E18-H94 IonicContact OE1-NE2 3.09Å; E18-H94 PolarHBondContact OE1-NE2 3.16Å
19	G	81.7	Confident	82.9	Confident	31 Å²	31	47 Å²	47	32%	0.32	27%	0.269	S	S	.	.			trans	-101.7	-166.8	172.4	0	0	0	0	0	111.1	H22 K40	G19-H22 PolarHBondContact N-O 3.22Å; G19-K40 WeakPolarHBondContact O-CE 3.34Å; G19-K40 PolarHBondContact O-NZ 2.8Å
20	N	81.4	Confident	84.3	Confident	156 Å²	156	53.7 Å²	53.7	83%	0.834	30%	0.304	S	S	*	.	S	Bend	trans	-67.8	-43.8	177.8	-71.6	-4.4	0	0	0	112.4	K40	N20-K40 WeakPolarHBondContact O-CD 3.35Å; N20-K40 PolarHBondContact O-NZ 3.1Å
21	C	84.8	Confident	85.8	Confident	64 Å²	64	52.7 Å²	52.7	43%	0.432	30%	0.303	S	S	.	.	S	Bend	trans	-108.9	-14.9	-173.6	-55.5	0	0	0	0	113.6	R39 K40	C21-R39 WeakPolarHBondContact O-CA 3.38Å; C21-K40 PolarHBondContact O-N 2.87Å
22	H	89.6	Confident	87.1	Confident	14 Å²	14	52 Å²	52	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.9	-169.8	-56.4	97.3	0	0	0	112.2	G19 R37 V38 M53	G19-H22 PolarHBondContact N-O 3.22Å; H22-R37 HydrophobicContact CB-CB 4.47Å; H22-R37 PolarHBondContact CE1-NH2 3.13Å; H22-R37 PolarHBondContact ND1-NH2 3.32Å; H22-V38 CarbonylContact C-O 3.58Å; H22-V38 WeakPolarHBondContact CA-O 3.39Å; H22-V38 WeakPolarHBondContact CB-O 3.35Å; H22-M53 VanDerWaalsContact NE2-CE 3.3Å; H22-M53 WeakPolarHBondContact NE2-CE 3.45Å
23	I	90.5	Very high	88	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	140.3	161.2	-53.7	170.4	0	0	0	106.9	F15 I25 V38 K40 F91 H94	F15-I23 HydrophobicContact CD2-CG2 4.14Å; F15-I23 HydrophobicContact CE2-CG2 4.07Å; I23-I25 HydrophobicContact CG2-CG1 4.14Å; I23-V38 PolarHBondContact N-O 3.14Å; I23-V38 PolarHBondContact O-N 2.86Å; I23-K40 HydrophobicContact CD1-CG 4.42Å; I23-K40 HydrophobicContact CG1-CG 3.79Å; I23-F91 HydrophobicContact CD1-CD2 3.7Å; I23-F91 HydrophobicContact CD1-CE2 4.22Å; I23-H94 HydrophobicContact CD1-CB 3.86Å; I23-H94 WeakPolarHBondContact CD1-CD2 3.38Å
24	V	92.6	Very high	88.4	Confident	33 Å²	33	50.4 Å²	50.4	20%	0.2	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.5	176.7	-168.4	0	0	0	0	108.4	R16 G17 V35 W36 R37	R16-V24 WeakPolarHBondContact CA-O 2.83Å; R16-V24 HydrophobicContact CB-CB 4.12Å; R16-V24 HydrophobicContact CB-CG1 3.88Å; R16-V24 VanDerWaalsContact CB-O 3.31Å; R16-V24 WeakPolarHBondContact CB-O 3.33Å; R16-V24 HydrophobicContact CG-CG1 4.04Å; R16-V24 PolarHBondContact N-O 2.9Å; G17-V24 PolarHBondContact N-O 2.72Å; G17-V24 WeakPolarHBondContact O-CA 3.27Å; G17-V24 PolarHBondContact O-N 3.05Å; V24-V35 HydrophobicContact CG1-CB 3.79Å; V24-V35 HydrophobicContact CG1-CG1 4.07Å; V24-V35 HydrophobicContact CG1-CG2 4.34Å; V24-W36 VanDerWaalsContact CA-O 3.3Å; V24-W36 WeakPolarHBondContact CA-O 3.29Å; V24-R37 HydrophobicContact CG2-CG 4.39Å
25	I	92.9	Very high	88.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.6	-178.8	-63.9	168.3	0	0	0	107.7	A13 Y14 I23 V35 W36 V38 L85 V88 F91	A13-I25 HydrophobicContact CB-CG2 3.77Å; Y14-I25 CarbonylContact O-C 3.45Å; Y14-I25 WeakPolarHBondContact O-CA 3.4Å; I23-I25 HydrophobicContact CG2-CG1 4.14Å; I25-V35 CarbonylContact O-C 3.57Å; I25-V35 VanDerWaalsContact O-CA 3.22Å; I25-V35 WeakPolarHBondContact O-CA 3.2Å; I25-W36 HydrophobicContact CG2-CE3 4.14Å; I25-W36 PolarHBondContact N-O 3.36Å; I25-W36 PolarHBondContact O-N 3.29Å; I25-V38 HydrophobicContact CD1-CG2 4.26Å; I25-L85 HydrophobicContact CD1-CD2 3.53Å; I25-V88 HydrophobicContact CG2-CG2 4.18Å; I25-F91 HydrophobicContact CD1-CD2 4.14Å
26	G	92.8	Very high	89	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	151.3	177.1	0	0	0	0	0	111.8	A13 Y14 Y34	A13-G26 CarbonylContact C-O 3.6Å; A13-G26 WeakPolarHBondContact CA-O 3.38Å; Y14-G26 VanDerWaalsContact CD1-O 3.3Å; Y14-G26 WeakPolarHBondContact CD1-O 3.42Å; Y14-G26 VanDerWaalsContact CE1-C 3.5Å; Y14-G26 PolarHBondContact N-O 3.36Å; Y14-G26 PolarHBondContact O-N 2.77Å; G26-Y34 WeakPolarHBondContact CA-O 3.49Å
27	F	91.9	Very high	89.2	Confident	1 Å²	1	44 Å²	44	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	166.6	174.5	68.2	-77.8	0	0	0	110.6	P9 R29 Y34 W36 E111	P9-F27 HydrophobicContact CB-CB 4.33Å; P9-F27 HydrophobicContact CB-CD2 3.81Å; P9-F27 HydrophobicContact CB-CG 4.39Å; F27-R29 HydrophobicContact CD2-CB 4.39Å; F27-R29 HydrophobicContact CE2-CB 4.09Å; F27-Y34 HydrophobicContact CE1-CG 4.38Å; F27-Y34 HydrophobicContact CE2-CD2 4.08Å; F27-Y34 HydrophobicContact CE2-CG 4.16Å; F27-Y34 HydrophobicContact CZ-CD2 4.24Å; F27-Y34 AromaticContact CZ-CG 3.84Å; F27-Y34 HydrophobicContact CZ-CG 3.84Å; F27-Y34 PolarHBondContact N-O 2.86Å; F27-Y34 PolarHBondContact O-N 3.21Å; F27-W36 AromaticContact CD1-CD2 3.82Å; F27-W36 HydrophobicContact CD1-CD2 3.82Å; F27-W36 AromaticContact CD1-CE2 3.63Å; F27-W36 HydrophobicContact CD1-CE3 4.21Å; F27-W36 HydrophobicContact CD1-CG 4.29Å; F27-W36 HydrophobicContact CD1-CH2 4.22Å; F27-W36 AromaticContact CD1-CZ2 3.86Å; F27-W36 HydrophobicContact CD1-CZ2 3.86Å; F27-W36 HydrophobicContact CD1-CZ3 4.4Å; F27-W36 AromaticContact CD1-NE1 3.98Å; F27-W36 HydrophobicContact CD2-CZ2 4.19Å; F27-W36 AromaticContact CE1-CD1 3.48Å; F27-W36 VanDerWaalsContact CE1-CD1 3.48Å; F27-W36 AromaticContact CE1-CD2 3.64Å; F27-W36 HydrophobicContact CE1-CD2 3.64Å; F27-W36 AromaticContact CE1-CE2 3.16Å; F27-W36 HydrophobicContact CE1-CE3 4.46Å; F27-W36 AromaticContact CE1-CG 3.83Å; F27-W36 HydrophobicContact CE1-CG 3.83Å; F27-W36 HydrophobicContact CE1-CH2 4.45Å; F27-W36 AromaticContact CE1-CZ2 3.65Å; F27-W36 HydrophobicContact CE1-CZ2 3.65Å; F27-W36 AromaticContact CE1-NE1 3.05Å; F27-W36 AromaticContact CE2-CZ2 3.96Å; F27-W36 HydrophobicContact CE2-CZ2 3.96Å; F27-W36 HydrophobicContact CG-CH2 4.29Å; F27-W36 HydrophobicContact CG-CZ2 4.13Å; F27-W36 HydrophobicContact CZ-CD2 4.42Å; F27-W36 AromaticContact CZ-CE2 3.51Å; F27-W36 AromaticContact CZ-CZ2 3.68Å; F27-W36 HydrophobicContact CZ-CZ2 3.68Å; F27-W36 AromaticContact CZ-NE1 3.26Å; F27-W36 VanDerWaalsContact CZ-NE1 3.26Å; F27-E111 HydrophobicContact CE1-CG 4.46Å; F27-E111 HydrophobicContact CZ-CG 4.17Å; F27-E111 WeakPolarHBondContact CZ-OE2 3.45Å
28	E	89.6	Confident	89.3	Confident	67 Å²	67	43.1 Å²	43.1	31%	0.313	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.3	176.1	-71.5	-175.1	-175.9	0	0	111	A11 A32 R33	A11-E28 HydrophobicContact CB-CB 4.16Å; E28-A32 WeakPolarHBondContact CA-O 3.27Å; E28-R33 HydrophobicContact CG-CG 3.66Å; E28-R33 IonicContact OE1-CZ 3.15Å; E28-R33 IonicContact OE1-NE 3.4Å; E28-R33 PolarHBondContact OE1-NE 3.05Å; E28-R33 IonicContact OE1-NH2 2.77Å; E28-R33 PolarHBondContact OE1-NH2 3.48Å
29	R	87.6	Confident	89.4	Confident	54 Å²	54	42 Å²	42	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	122.1	176.4	-175.3	173.3	65.3	-155.4	-4.4	108.9	F27 G31 A32 Y34 E111	F27-R29 HydrophobicContact CD2-CB 4.39Å; F27-R29 HydrophobicContact CE2-CB 4.09Å; R29-G31 VanDerWaalsContact C-N 3.3Å; R29-G31 PolarHBondContact O-N 3.37Å; R29-A32 PolarHBondContact N-O 3.47Å; R29-A32 PolarHBondContact O-N 3.27Å; R29-Y34 HydrophobicContact CB-CD2 4.1Å; R29-Y34 HydrophobicContact CB-CE2 3.97Å; R29-E111 IonicContact CZ-OE1 2.94Å; R29-E111 IonicContact CZ-OE2 3.96Å; R29-E111 IonicContact NH1-OE1 2.73Å; R29-E111 PolarHBondContact NH1-OE1 3.12Å; R29-E111 IonicContact NH1-OE2 3.27Å; R29-E111 PolarHBondContact NH1-OE2 3.49Å; R29-E111 IonicContact NH2-OE1 3.8Å; R29-E111 PolarHBondContact NH2-OE1 3.06Å; R29-E111 IonicContact NH2-OE2 3.33Å
30	N	86.6	Confident	89.6	Confident	159 Å²	159	42.4 Å²	42.4	85%	0.85	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	43.2	179.3	-57.1	-26.8	0	0	0	113.6	A32	N30-A32 PolarHBondContact O-N 3.26Å
31	G	82.9	Confident	89.6	Confident	76 Å²	76	39 Å²	39	78%	0.784	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	-0.8	-179.7	0	0	0	0	0	115.5	R29	R29-G31 VanDerWaalsContact C-N 3.3Å; R29-G31 PolarHBondContact O-N 3.37Å
32	A	87.6	Confident	89	Confident	27 Å²	27	37.2 Å²	37.2	22%	0.223	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150	174.9	0	0	0	0	0	111.6	E28 R29 N30 Y34	E28-A32 WeakPolarHBondContact CA-O 3.27Å; R29-A32 PolarHBondContact N-O 3.47Å; R29-A32 PolarHBondContact O-N 3.27Å; N30-A32 PolarHBondContact O-N 3.26Å; A32-Y34 HydrophobicContact CB-CD2 4.49Å; A32-Y34 HydrophobicContact CB-CE2 3.63Å
33	R	91.8	Very high	88	Confident	69 Å²	69	37.8 Å²	37.8	26%	0.26	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.3	179	-73.8	176.7	-176.3	98.5	14	111.2	E28 D114 Y117	E28-R33 HydrophobicContact CG-CG 3.66Å; E28-R33 IonicContact OE1-CZ 3.15Å; E28-R33 IonicContact OE1-NE 3.4Å; E28-R33 PolarHBondContact OE1-NE 3.05Å; E28-R33 IonicContact OE1-NH2 2.77Å; E28-R33 PolarHBondContact OE1-NH2 3.48Å; R33-D114 HydrophobicContact CB-CB 3.69Å; R33-D114 PolarHBondContact O-N 2.78Å; R33-Y117 HydrophobicContact CB-CD2 4.26Å; R33-Y117 VanDerWaalsContact CD-CD2 3.44Å; R33-Y117 HydrophobicContact CG-CD2 4.46Å
34	Y	94.1	Very high	86.8	Confident	57 Å²	57	44 Å²	44	22%	0.224	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.7	-178.4	-64.4	-91.2	0	0	0	110.3	G26 F27 R29 A32 E111 L112	G26-Y34 WeakPolarHBondContact CA-O 3.49Å; F27-Y34 HydrophobicContact CE1-CG 4.38Å; F27-Y34 HydrophobicContact CE2-CD2 4.08Å; F27-Y34 HydrophobicContact CE2-CG 4.16Å; F27-Y34 HydrophobicContact CZ-CD2 4.24Å; F27-Y34 AromaticContact CZ-CG 3.84Å; F27-Y34 HydrophobicContact CZ-CG 3.84Å; F27-Y34 PolarHBondContact N-O 2.86Å; F27-Y34 PolarHBondContact O-N 3.21Å; R29-Y34 HydrophobicContact CB-CD2 4.1Å; R29-Y34 HydrophobicContact CB-CE2 3.97Å; A32-Y34 HydrophobicContact CB-CD2 4.49Å; A32-Y34 HydrophobicContact CB-CE2 3.63Å; Y34-E111 HydrophobicContact CD1-CG 4.38Å; Y34-L112 CarbonylContact C-O 3.56Å; Y34-L112 WeakPolarHBondContact CA-O 3.35Å
35	V	94.9	Very high	85.7	Confident	16 Å²	16	46.3 Å²	46.3	10%	0.097	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.3	172.2	-63.4	0	0	0	0	110.8	R16 V24 I25 E111 L112 D114	R16-V35 HydrophobicContact CG-CG1 4.13Å; V24-V35 HydrophobicContact CG1-CB 3.79Å; V24-V35 HydrophobicContact CG1-CG1 4.07Å; V24-V35 HydrophobicContact CG1-CG2 4.34Å; I25-V35 CarbonylContact O-C 3.57Å; I25-V35 VanDerWaalsContact O-CA 3.22Å; I25-V35 WeakPolarHBondContact O-CA 3.2Å; V35-E111 WeakPolarHBondContact O-CA 3.38Å; V35-L112 HydrophobicContact CG2-CB 4Å; V35-L112 PolarHBondContact N-O 3.18Å; V35-L112 PolarHBondContact O-N 3.48Å; V35-D114 HydrophobicContact CG1-CB 4.09Å
36	W	94.1	Very high	84.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.6	164.7	-61.8	-37.3	0	0	0	109.8	P9 A13 V24 I25 F27 V38 I78 L80 L84 L85 A109 M110 E111	P9-W36 HydrophobicContact CG-CH2 3.9Å; A13-W36 HydrophobicContact CB-CZ3 4.4Å; V24-W36 VanDerWaalsContact CA-O 3.3Å; V24-W36 WeakPolarHBondContact CA-O 3.29Å; I25-W36 HydrophobicContact CG2-CE3 4.14Å; I25-W36 PolarHBondContact N-O 3.36Å; I25-W36 PolarHBondContact O-N 3.29Å; F27-W36 AromaticContact CD1-CD2 3.82Å; F27-W36 HydrophobicContact CD1-CD2 3.82Å; F27-W36 AromaticContact CD1-CE2 3.63Å; F27-W36 HydrophobicContact CD1-CE3 4.21Å; F27-W36 HydrophobicContact CD1-CG 4.29Å; F27-W36 HydrophobicContact CD1-CH2 4.22Å; F27-W36 AromaticContact CD1-CZ2 3.86Å; F27-W36 HydrophobicContact CD1-CZ2 3.86Å; F27-W36 HydrophobicContact CD1-CZ3 4.4Å; F27-W36 AromaticContact CD1-NE1 3.98Å; F27-W36 HydrophobicContact CD2-CZ2 4.19Å; F27-W36 AromaticContact CE1-CD1 3.48Å; F27-W36 VanDerWaalsContact CE1-CD1 3.48Å; F27-W36 AromaticContact CE1-CD2 3.64Å; F27-W36 HydrophobicContact CE1-CD2 3.64Å; F27-W36 AromaticContact CE1-CE2 3.16Å; F27-W36 HydrophobicContact CE1-CE3 4.46Å; F27-W36 AromaticContact CE1-CG 3.83Å; F27-W36 HydrophobicContact CE1-CG 3.83Å; F27-W36 HydrophobicContact CE1-CH2 4.45Å; F27-W36 AromaticContact CE1-CZ2 3.65Å; F27-W36 HydrophobicContact CE1-CZ2 3.65Å; F27-W36 AromaticContact CE1-NE1 3.05Å; F27-W36 AromaticContact CE2-CZ2 3.96Å; F27-W36 HydrophobicContact CE2-CZ2 3.96Å; F27-W36 HydrophobicContact CG-CH2 4.29Å; F27-W36 HydrophobicContact CG-CZ2 4.13Å; F27-W36 HydrophobicContact CZ-CD2 4.42Å; F27-W36 AromaticContact CZ-CE2 3.51Å; F27-W36 AromaticContact CZ-CZ2 3.68Å; F27-W36 HydrophobicContact CZ-CZ2 3.68Å; F27-W36 AromaticContact CZ-NE1 3.26Å; F27-W36 VanDerWaalsContact CZ-NE1 3.26Å; W36-V38 HydrophobicContact CB-CG2 4.2Å; W36-I78 VanDerWaalsContact CD1-CD1 3.41Å; W36-I78 HydrophobicContact CD2-CD1 4.49Å; W36-I78 HydrophobicContact CG-CD1 4.22Å; W36-L80 HydrophobicContact CB-CD1 4.11Å; W36-L80 HydrophobicContact CD2-CD1 3.57Å; W36-L80 HydrophobicContact CD2-CD2 3.96Å; W36-L80 HydrophobicContact CD2-CG 4.42Å; W36-L80 HydrophobicContact CE3-CD1 3.65Å; W36-L80 HydrophobicContact CE3-CD2 4.14Å; W36-L80 HydrophobicContact CG-CD1 3.78Å; W36-L80 HydrophobicContact CH2-CD2 3.84Å; W36-L80 HydrophobicContact CZ2-CD2 3.62Å; W36-L80 HydrophobicContact CZ3-CD1 4.29Å; W36-L80 HydrophobicContact CZ3-CD2 4.08Å; W36-L84 HydrophobicContact CH2-CD2 3.5Å; W36-L84 VanDerWaalsContact CH2-CD2 3.5Å; W36-L84 HydrophobicContact CH2-CG 4.47Å; W36-L84 HydrophobicContact CZ3-CD2 3.68Å; W36-L84 HydrophobicContact CZ3-CG 4.25Å; W36-L85 HydrophobicContact CE3-CD2 4.37Å; W36-A109 HydrophobicContact CB-CB 4.39Å; W36-M110 WeakPolarHBondContact CA-O 2.96Å; W36-E111 PolarHBondContact NE1-OE2 3.1Å
37	R	93.2	Very high	83.6	Confident	27 Å²	27	54.6 Å²	54.6	10%	0.102	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.7	164	-68.6	177.3	58.5	-173.4	-9.6	108.1	H22 V24 A109 M110 L112 D371 D373	H22-R37 HydrophobicContact CB-CB 4.47Å; H22-R37 PolarHBondContact CE1-NH2 3.13Å; H22-R37 PolarHBondContact ND1-NH2 3.32Å; V24-R37 HydrophobicContact CG2-CG 4.39Å; R37-A109 WeakPolarHBondContact O-CA 3.28Å; R37-M110 HydrophobicContact CB-CB 4.29Å; R37-M110 HydrophobicContact CB-CE 4.32Å; R37-M110 PolarHBondContact N-O 3.19Å; R37-M110 PolarHBondContact O-N 3.3Å; R37-M110 VanDerWaalsContact O-N 3.11Å; R37-L112 HydrophobicContact CG-CD1 4.24Å; R37-D371 IonicContact CZ-OD1 2.79Å; R37-D371 IonicContact NH1-OD1 3.29Å; R37-D371 PolarHBondContact NH1-OD1 3.03Å; R37-D373 IonicContact NH1-OD1 3.66Å; R37-D373 IonicContact NH2-OD1 3.78Å; R37-D373 IonicContact NH2-OD2 3.43Å; R37-D373 PolarHBondContact NH2-OD2 3.49Å
38	V	90.4	Very high	82.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.3	178.4	-169	0	0	0	0	108.8	H22 I23 I25 W36 F42 L80 L85 F91 V107 A109	H22-V38 CarbonylContact C-O 3.58Å; H22-V38 WeakPolarHBondContact CA-O 3.39Å; H22-V38 WeakPolarHBondContact CB-O 3.35Å; I23-V38 PolarHBondContact N-O 3.14Å; I23-V38 PolarHBondContact O-N 2.86Å; I25-V38 HydrophobicContact CD1-CG2 4.26Å; W36-V38 HydrophobicContact CB-CG2 4.2Å; V38-F42 HydrophobicContact CG1-CE1 4.27Å; V38-F42 HydrophobicContact CG1-CZ 4.22Å; V38-L80 HydrophobicContact CG2-CD1 4.24Å; V38-L85 HydrophobicContact CG1-CD1 4.13Å; V38-L85 HydrophobicContact CG2-CD1 4.42Å; V38-L85 HydrophobicContact CG2-CD2 4.29Å; V38-F91 HydrophobicContact CB-CE2 4.41Å; V38-F91 HydrophobicContact CG1-CE2 3.87Å; V38-F91 HydrophobicContact CG1-CZ 4.49Å; V38-V107 HydrophobicContact CG1-CG2 4.16Å; V38-A109 HydrophobicContact CG2-CB 3.99Å
39	R	86.9	Confident	82.3	Confident	32 Å²	32	56.6 Å²	56.6	12%	0.121	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	151.3	174.9	-74.4	-169.5	80.7	155.7	5.2	111.8	C21 F42 N49 E52 M53	C21-R39 WeakPolarHBondContact O-CA 3.38Å; R39-F42 WeakPolarHBondContact O-CZ 3.36Å; R39-N49 WeakPolarHBondContact CD-OD1 3.3Å; R39-E52 IonicContact CZ-OE2 2.78Å; R39-E52 IonicContact NE-OE2 2.87Å; R39-E52 IonicContact NH1-OE2 2.78Å; R39-E52 PolarHBondContact NH1-OE2 2.67Å; R39-E52 IonicContact NH2-OE2 3.26Å; R39-E52 PolarHBondContact NH2-OE2 3.36Å; R39-M53 HydrophobicContact CG-CE 3.67Å
40	K	85.6	Confident	82.1	Confident	38 Å²	38	56.9 Å²	56.9	17%	0.165	31%	0.312	C	S	.	.	S	Bend	trans	-81.1	-28.7	169.7	-69.1	177.4	-179.4	-167.9	0	113.6	E18 G19 N20 C21 I23	E18-K40 WeakPolarHBondContact OE1-CE 3.45Å; E18-K40 IonicContact OE1-NZ 2.99Å; E18-K40 PolarHBondContact OE1-NZ 2.71Å; G19-K40 WeakPolarHBondContact O-CE 3.34Å; G19-K40 PolarHBondContact O-NZ 2.8Å; N20-K40 WeakPolarHBondContact O-CD 3.35Å; N20-K40 PolarHBondContact O-NZ 3.1Å; C21-K40 PolarHBondContact O-N 2.87Å; I23-K40 HydrophobicContact CD1-CG 4.42Å; I23-K40 HydrophobicContact CG1-CG 3.79Å
41	T	80.6	Confident	82	Confident	85 Å²	85	55.6 Å²	55.6	52%	0.521	30%	0.297	S	S	.	.			trans	-115	123.7	-175.7	55	0	0	0	0	108.3
42	F	73.1	Confident	82.1	Confident	27 Å²	27	54.3 Å²	54.3	12%	0.118	27%	0.27	C	S	.	.			trans	-102.2	106.6	178.7	-61.7	-73.9	0	0	0	106.4	V38 R39 F91 V96 V107	V38-F42 HydrophobicContact CG1-CE1 4.27Å; V38-F42 HydrophobicContact CG1-CZ 4.22Å; R39-F42 WeakPolarHBondContact O-CZ 3.36Å; F42-F91 HydrophobicContact CE1-CZ 4.47Å; F42-F91 HydrophobicContact CE2-CE2 4.43Å; F42-F91 HydrophobicContact CE2-CZ 4.01Å; F42-F91 AromaticContact CZ-CE2 3.83Å; F42-F91 HydrophobicContact CZ-CE2 3.83Å; F42-F91 AromaticContact CZ-CZ 3.51Å; F42-F91 HydrophobicContact CZ-CZ 3.51Å; F42-V96 HydrophobicContact CD1-CG2 4.47Å; F42-V96 HydrophobicContact CD2-CB 4.42Å; F42-V96 HydrophobicContact CD2-CG2 3.91Å; F42-V96 HydrophobicContact CE1-CG2 4.37Å; F42-V96 HydrophobicContact CE2-CG2 3.79Å; F42-V96 HydrophobicContact CG-CG2 4.27Å; F42-V96 HydrophobicContact CZ-CG2 4.04Å; F42-V107 HydrophobicContact CD1-CG1 4Å; F42-V107 HydrophobicContact CE1-CB 4.25Å; F42-V107 HydrophobicContact CE1-CG1 3.74Å
43	S	68.1	Low	82.1	Confident	25 Å²	25	53 Å²	53	18%	0.175	26%	0.259	C	S	.	.			trans	-56.1	159	167.1	49.3	0	0	0	0	109.2	D45 E48 R100	S43-D45 PolarHBondContact OG-O 2.94Å; S43-E48 WeakPolarHBondContact CB-OE2 3.35Å; S43-R100 PolarHBondContact O-NH1 3.21Å; S43-R100 PolarHBondContact O-NH2 2.95Å
44	T	65.4	Low	82	Confident	131 Å²	131	50.5 Å²	50.5	80%	0.804	25%	0.252	S	S	*	.	S	Bend	trans	-74.4	-17.9	167.2	48.6	0	0	0	0	112.2
45	D	69.2	Low	81.9	Confident	81 Å²	81	51 Å²	51	43%	0.433	26%	0.259	S	S	.	.			trans	-91.9	111.4	178	-171.8	-7.6	0	0	0	110.3	S43 D47 E48 R100	S43-D45 PolarHBondContact OG-O 2.94Å; D45-D47 PolarHBondContact O-N 3.11Å; D45-D47 VanDerWaalsContact OD1-CB 3.27Å; D45-D47 WeakPolarHBondContact OD1-CB 3.35Å; D45-D47 PolarHBondContact OD1-N 2.8Å; D45-E48 HydrophobicContact CB-CB 4.36Å; D45-R100 PolarHBondContact O-NH2 3.48Å
46	D	67.7	Low	81.7	Confident	84 Å²	84	50.5 Å²	50.5	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-61.8	-30.9	176.2	-75.4	-16.1	0	0	0	111.8	N49 Y50 R100	D46-N49 PolarHBondContact O-N 2.67Å; D46-Y50 WeakPolarHBondContact O-CB 3.42Å; D46-Y50 PolarHBondContact O-N 3.29Å; D46-R100 IonicContact OD1-CZ 3.6Å; D46-R100 IonicContact OD1-NE 3.4Å; D46-R100 PolarHBondContact OD1-NE 3.1Å; D46-R100 IonicContact OD1-NH2 2.92Å; D46-R100 PolarHBondContact OD1-NH2 2.89Å
47	D	74.3	Confident	81.7	Confident	90 Å²	90	50.5 Å²	50.5	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-68.2	-42.7	-175.7	-70.2	-21	0	0	0	110.7	D45 N49 Y50 Y51	D45-D47 PolarHBondContact O-N 3.11Å; D45-D47 VanDerWaalsContact OD1-CB 3.27Å; D45-D47 WeakPolarHBondContact OD1-CB 3.35Å; D45-D47 PolarHBondContact OD1-N 2.8Å; D47-N49 VanDerWaalsContact C-N 3.31Å; D47-N49 PolarHBondContact O-N 2.79Å; D47-Y50 PolarHBondContact O-N 3.31Å; D47-Y51 VanDerWaalsContact C-CD2 3.47Å; D47-Y51 HydrophobicContact CB-CD2 4.08Å; D47-Y51 HydrophobicContact CB-CE2 3.67Å; D47-Y51 WeakPolarHBondContact O-CB 3.39Å; D47-Y51 WeakPolarHBondContact O-CD2 3.29Å; D47-Y51 VanDerWaalsContact O-CG 3.32Å; D47-Y51 PolarHBondContact O-N 3.25Å
48	E	75.3	Confident	81.7	Confident	107 Å²	107	52 Å²	52	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-43	178.4	-170.4	-173.4	179.5	0	0	112	S43 D45 Y51 E52	S43-E48 WeakPolarHBondContact CB-OE2 3.35Å; D45-E48 HydrophobicContact CB-CB 4.36Å; E48-Y51 PolarHBondContact O-N 2.8Å; E48-E52 PolarHBondContact O-N 2.83Å; E48-E52 VanDerWaalsContact O-N 3.12Å
49	N	77.9	Confident	81.8	Confident	4 Å²	4	53 Å²	53	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-70.6	-41	-179.2	-165.4	16.5	0	0	0	111.4	R39 D46 D47 M53	R39-N49 WeakPolarHBondContact CD-OD1 3.3Å; D46-N49 PolarHBondContact O-N 2.67Å; D47-N49 VanDerWaalsContact C-N 3.31Å; D47-N49 PolarHBondContact O-N 2.79Å; N49-M53 WeakPolarHBondContact O-CG 3.5Å; N49-M53 PolarHBondContact O-N 2.94Å
50	Y	84.9	Confident	82.2	Confident	59 Å²	59	51.7 Å²	51.7	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-58.5	-50.9	172.5	174.8	-101.8	0	0	0	111.6	V3 D46 D47 E52 M53 S54 L77 Y108	V3-Y50 HydrophobicContact CG2-CE2 3.79Å; D46-Y50 WeakPolarHBondContact O-CB 3.42Å; D46-Y50 PolarHBondContact O-N 3.29Å; D47-Y50 PolarHBondContact O-N 3.31Å; Y50-E52 PolarHBondContact O-N 2.83Å; Y50-M53 PolarHBondContact O-N 2.69Å; Y50-S54 WeakPolarHBondContact O-CB 3.46Å; Y50-S54 PolarHBondContact O-N 2.84Å; Y50-L77 HydrophobicContact CD2-CD2 4.18Å; Y50-L77 HydrophobicContact CE2-CD2 3.69Å; Y50-Y108 AromaticContact CD2-CD1 4Å; Y50-Y108 HydrophobicContact CD2-CD1 4Å; Y50-Y108 HydrophobicContact CD2-CD2 4.25Å; Y50-Y108 AromaticContact CD2-CE1 3.64Å; Y50-Y108 HydrophobicContact CD2-CE1 3.64Å; Y50-Y108 AromaticContact CD2-CE2 3.94Å; Y50-Y108 HydrophobicContact CD2-CE2 3.94Å; Y50-Y108 HydrophobicContact CD2-CG 4.28Å; Y50-Y108 AromaticContact CD2-CZ 3.61Å; Y50-Y108 HydrophobicContact CE2-CE1 4.24Å; Y50-Y108 HydrophobicContact CG-CE2 4.23Å
51	Y	84.4	Confident	82.6	Confident	133 Å²	133	54.1 Å²	54.1	52%	0.522	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-44	-177.2	-71.8	-54.5	0	0	0	112	D47 E48 S54 D55	D47-Y51 VanDerWaalsContact C-CD2 3.47Å; D47-Y51 HydrophobicContact CB-CD2 4.08Å; D47-Y51 HydrophobicContact CB-CE2 3.67Å; D47-Y51 WeakPolarHBondContact O-CB 3.39Å; D47-Y51 WeakPolarHBondContact O-CD2 3.29Å; D47-Y51 VanDerWaalsContact O-CG 3.32Å; D47-Y51 PolarHBondContact O-N 3.25Å; E48-Y51 PolarHBondContact O-N 2.8Å; Y51-S54 PolarHBondContact O-N 2.78Å; Y51-D55 VanDerWaalsContact O-CB 3.23Å; Y51-D55 WeakPolarHBondContact O-CB 3.38Å; Y51-D55 VanDerWaalsContact O-CG 3.25Å; Y51-D55 PolarHBondContact O-N 3.4Å
52	E	84	Confident	83.2	Confident	48 Å²	48	53.2 Å²	53.2	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-46.3	177.5	-179	175.2	165	0	0	112.4	R39 E48 Y50 S54 D55 N56	R39-E52 IonicContact CZ-OE2 2.78Å; R39-E52 IonicContact NE-OE2 2.87Å; R39-E52 IonicContact NH1-OE2 2.78Å; R39-E52 PolarHBondContact NH1-OE2 2.67Å; R39-E52 IonicContact NH2-OE2 3.26Å; R39-E52 PolarHBondContact NH2-OE2 3.36Å; E48-E52 PolarHBondContact O-N 2.83Å; E48-E52 VanDerWaalsContact O-N 3.12Å; Y50-E52 PolarHBondContact O-N 2.83Å; E52-S54 VanDerWaalsContact C-N 3.34Å; E52-D55 PolarHBondContact O-N 3.21Å; E52-N56 WeakPolarHBondContact O-CB 3.46Å; E52-N56 VanDerWaalsContact O-CG 3.26Å; E52-N56 PolarHBondContact O-N 3.01Å; E52-N56 PolarHBondContact O-ND2 3.04Å; E52-N56 VanDerWaalsContact O-ND2 3.12Å
53	M	88.3	Confident	84.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-40.3	178.9	-66.1	-63.3	111.6	0	0	111.3	H22 R39 N49 Y50 N56 T57 L77 M110	H22-M53 VanDerWaalsContact NE2-CE 3.3Å; H22-M53 WeakPolarHBondContact NE2-CE 3.45Å; R39-M53 HydrophobicContact CG-CE 3.67Å; N49-M53 WeakPolarHBondContact O-CG 3.5Å; N49-M53 PolarHBondContact O-N 2.94Å; Y50-M53 PolarHBondContact O-N 2.69Å; M53-N56 PolarHBondContact O-N 2.91Å; M53-T57 WeakPolarHBondContact O-CB 3.25Å; M53-T57 PolarHBondContact O-N 2.86Å; M53-T57 PolarHBondContact O-OG1 2.98Å; M53-L77 HydrophobicContact CB-CD1 3.6Å; M53-M110 HydrophobicContact CE-CE 4.42Å; M53-M110 HydrophobicContact SD-CE 3.9Å; M53-M110 HydrophobicContact SD-CG 4Å; M53-M110 HydrophobicContact SD-SD 4.39Å
54	S	90.6	Very high	85.5	Confident	16 Å²	16	51.5 Å²	51.5	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-44.2	177.2	-173.2	0	0	0	0	112	Y50 Y51 E52 T57 T58	Y50-S54 WeakPolarHBondContact O-CB 3.46Å; Y50-S54 PolarHBondContact O-N 2.84Å; Y51-S54 PolarHBondContact O-N 2.78Å; E52-S54 VanDerWaalsContact C-N 3.34Å; S54-T57 PolarHBondContact O-N 3.24Å; S54-T58 VanDerWaalsContact O-CB 3.25Å; S54-T58 WeakPolarHBondContact O-CB 3.4Å; S54-T58 PolarHBondContact O-N 3.23Å; S54-T58 PolarHBondContact O-OG1 2.81Å
55	D	90.5	Very high	86.7	Confident	69 Å²	69	54.1 Å²	54.1	37%	0.369	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-46.2	175.7	-81.7	-8.3	0	0	0	111	Y51 E52 T57 T58 F59 Y374	Y51-D55 VanDerWaalsContact O-CB 3.23Å; Y51-D55 WeakPolarHBondContact O-CB 3.38Å; Y51-D55 VanDerWaalsContact O-CG 3.25Å; Y51-D55 PolarHBondContact O-N 3.4Å; E52-D55 PolarHBondContact O-N 3.21Å; D55-T57 PolarHBondContact O-N 3.24Å; D55-T58 PolarHBondContact O-N 2.66Å; D55-F59 WeakPolarHBondContact O-CB 3.48Å; D55-F59 PolarHBondContact O-N 3.44Å; D55-Y374 HydrophobicContact CB-CD1 4.37Å
56	N	92.3	Very high	87.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-41.8	177.6	-72.6	-32.3	0	0	0	111.8	E52 M53 C60 M110 D373 Y374	E52-N56 WeakPolarHBondContact O-CB 3.46Å; E52-N56 VanDerWaalsContact O-CG 3.26Å; E52-N56 PolarHBondContact O-N 3.01Å; E52-N56 PolarHBondContact O-ND2 3.04Å; E52-N56 VanDerWaalsContact O-ND2 3.12Å; M53-N56 PolarHBondContact O-N 2.91Å; N56-C60 WeakPolarHBondContact O-CB 3.41Å; N56-C60 PolarHBondContact O-N 3.29Å; N56-C60 PolarHBondContact O-SG 3.31Å; N56-M110 HydrophobicContact CB-SD 3.94Å; N56-D373 WeakPolarHBondContact OD1-CB 3.5Å; N56-Y374 PolarHBondContact OD1-N 3.47Å
57	T	93	Very high	89	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-47	178.2	-56.8	0	0	0	0	111	M1 M53 S54 D55 C60 F61 P75 L77	M1-T57 HydrophobicContact CE-CG2 3.97Å; M1-T57 HydrophobicContact SD-CG2 3.51Å; M1-T57 VanDerWaalsContact SD-CG2 3.51Å; M53-T57 WeakPolarHBondContact O-CB 3.25Å; M53-T57 PolarHBondContact O-N 2.86Å; M53-T57 PolarHBondContact O-OG1 2.98Å; S54-T57 PolarHBondContact O-N 3.24Å; D55-T57 PolarHBondContact O-N 3.24Å; T57-C60 PolarHBondContact O-N 2.68Å; T57-F61 PolarHBondContact O-N 3.06Å; T57-P75 HydrophobicContact CG2-CG 4.26Å; T57-P75 VanDerWaalsContact CG2-O 3.29Å; T57-P75 WeakPolarHBondContact CG2-O 3.18Å; T57-L77 HydrophobicContact CG2-CB 4.36Å
58	T	93.2	Very high	89.5	Confident	58 Å²	58	46.1 Å²	46.1	36%	0.356	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-44	177.7	-60.8	0	0	0	0	111.2	S54 D55 F61 V62	S54-T58 VanDerWaalsContact O-CB 3.25Å; S54-T58 WeakPolarHBondContact O-CB 3.4Å; S54-T58 PolarHBondContact O-N 3.23Å; S54-T58 PolarHBondContact O-OG1 2.81Å; D55-T58 PolarHBondContact O-N 2.66Å; T58-F61 WeakPolarHBondContact O-CB 3.16Å; T58-F61 PolarHBondContact O-N 2.88Å; T58-V62 WeakPolarHBondContact O-CG2 3.19Å; T58-V62 PolarHBondContact O-N 2.8Å
59	F	93.7	Very high	89.6	Confident	20 Å²	20	50.9 Å²	50.9	9%	0.088	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-39.5	179.1	-165.5	-94.7	0	0	0	111.7	D55 F61 V62 M63 I327 L372 Y374	D55-F59 WeakPolarHBondContact O-CB 3.48Å; D55-F59 PolarHBondContact O-N 3.44Å; F59-F61 VanDerWaalsContact C-N 3.28Å; F59-F61 PolarHBondContact O-N 3.43Å; F59-V62 PolarHBondContact O-N 3.25Å; F59-M63 HydrophobicContact CD1-CG 3.73Å; F59-M63 HydrophobicContact CE1-CG 3.52Å; F59-M63 HydrophobicContact CE1-SD 3.79Å; F59-M63 HydrophobicContact CZ-CG 4.23Å; F59-M63 HydrophobicContact CZ-SD 4.05Å; F59-M63 WeakPolarHBondContact O-CB 3.07Å; F59-M63 VanDerWaalsContact O-CG 3.24Å; F59-M63 WeakPolarHBondContact O-CG 3.31Å; F59-M63 PolarHBondContact O-N 2.92Å; F59-I327 HydrophobicContact CZ-CG1 4.43Å; F59-L372 WeakPolarHBondContact CD1-O 3.45Å; F59-Y374 AromaticContact CD2-CD2 3.87Å; F59-Y374 HydrophobicContact CD2-CD2 3.87Å; F59-Y374 HydrophobicContact CE2-CD2 4.16Å; F59-Y374 HydrophobicContact CG-CD2 4.31Å
60	C	95.2	Very high	89.9	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.034	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-41.6	170.7	-75.8	0	0	0	0	111.8	N56 T57 M63 S64 V74 P75 L372	N56-C60 WeakPolarHBondContact O-CB 3.41Å; N56-C60 PolarHBondContact O-N 3.29Å; N56-C60 PolarHBondContact O-SG 3.31Å; T57-C60 PolarHBondContact O-N 2.68Å; C60-M63 PolarHBondContact O-N 3.22Å; C60-S64 PolarHBondContact O-N 3.48Å; C60-V74 HydrophobicContact CB-CG1 4.5Å; C60-P75 HydrophobicContact CB-CG 4.32Å; C60-L372 PolarHBondContact SG-O 3.17Å
61	F	94	Very high	90.3	Very high	90 Å²	90	52.1 Å²	52.1	40%	0.395	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-44.7	175.3	178.1	-99.2	0	0	0	112.1	M1 T57 T58 F59 M63 S64 R65 V74	M1-F61 HydrophobicContact CE-CB 3.99Å; M1-F61 HydrophobicContact CE-CG 4.38Å; T57-F61 PolarHBondContact O-N 3.06Å; T58-F61 WeakPolarHBondContact O-CB 3.16Å; T58-F61 PolarHBondContact O-N 2.88Å; F59-F61 VanDerWaalsContact C-N 3.28Å; F59-F61 PolarHBondContact O-N 3.43Å; F61-M63 VanDerWaalsContact C-N 3.34Å; F61-M63 PolarHBondContact O-N 3.05Å; F61-S64 WeakPolarHBondContact O-CB 3.3Å; F61-S64 PolarHBondContact O-N 2.87Å; F61-S64 PolarHBondContact O-OG 2.84Å; F61-R65 PolarHBondContact O-N 2.85Å; F61-V74 HydrophobicContact CB-CG1 4.14Å
62	V	92.9	Very high	90.8	Very high	66 Å²	66	46.2 Å²	46.2	40%	0.4	21%	0.213	S	C	.	.	H	α-helix	trans	-59.5	-46.6	173.7	172	0	0	0	0	110.8	T58 F59 S64 R65	T58-V62 WeakPolarHBondContact O-CG2 3.19Å; T58-V62 PolarHBondContact O-N 2.8Å; F59-V62 PolarHBondContact O-N 3.25Å; V62-S64 VanDerWaalsContact C-N 3.28Å; V62-S64 PolarHBondContact O-N 2.68Å; V62-R65 WeakPolarHBondContact O-CB 3.26Å; V62-R65 PolarHBondContact O-N 3.06Å
63	M	94.7	Very high	91.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-38.8	177.5	-70.7	-64	-73.2	0	0	111.4	F59 C60 F61 R65 L66 F67 I327 L331 L372	F59-M63 HydrophobicContact CD1-CG 3.73Å; F59-M63 HydrophobicContact CE1-CG 3.52Å; F59-M63 HydrophobicContact CE1-SD 3.79Å; F59-M63 HydrophobicContact CZ-CG 4.23Å; F59-M63 HydrophobicContact CZ-SD 4.05Å; F59-M63 WeakPolarHBondContact O-CB 3.07Å; F59-M63 VanDerWaalsContact O-CG 3.24Å; F59-M63 WeakPolarHBondContact O-CG 3.31Å; F59-M63 PolarHBondContact O-N 2.92Å; C60-M63 PolarHBondContact O-N 3.22Å; F61-M63 VanDerWaalsContact C-N 3.34Å; F61-M63 PolarHBondContact O-N 3.05Å; M63-R65 PolarHBondContact O-N 2.82Å; M63-L66 VanDerWaalsContact O-CB 3.32Å; M63-L66 WeakPolarHBondContact O-CB 3.2Å; M63-L66 PolarHBondContact O-N 3.05Å; M63-L66 HydrophobicContact SD-CD1 3.89Å; M63-F67 HydrophobicContact CE-CE2 4.32Å; M63-F67 VanDerWaalsContact O-CD2 3.27Å; M63-F67 WeakPolarHBondContact O-CD2 3.37Å; M63-I327 HydrophobicContact CE-CG2 4.07Å; M63-I327 HydrophobicContact SD-CB 4.37Å; M63-I327 HydrophobicContact SD-CG1 3.97Å; M63-I327 HydrophobicContact SD-CG2 4.1Å; M63-L331 HydrophobicContact CE-CD1 4.42Å; M63-L331 HydrophobicContact CE-CD2 3.74Å; M63-L331 HydrophobicContact CE-CG 3.8Å; M63-L372 HydrophobicContact CB-CB 4.34Å; M63-L372 HydrophobicContact CB-CD1 4.15Å; M63-L372 HydrophobicContact CE-CD2 3.81Å; M63-L372 HydrophobicContact CG-CB 4.34Å
64	S	93.4	Very high	91.5	Very high	15 Å²	15	47.1 Å²	47.1	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-31.3	178.2	79.9	0	0	0	0	113.4	C60 F61 V62 L66 F67	C60-S64 PolarHBondContact O-N 3.48Å; F61-S64 WeakPolarHBondContact O-CB 3.3Å; F61-S64 PolarHBondContact O-N 2.87Å; F61-S64 PolarHBondContact O-OG 2.84Å; V62-S64 VanDerWaalsContact C-N 3.28Å; V62-S64 PolarHBondContact O-N 2.68Å; S64-L66 PolarHBondContact O-N 3.19Å; S64-F67 PolarHBondContact O-N 3.23Å; S64-F67 VanDerWaalsContact O-O 3.09Å
65	R	91.9	Very high	91.7	Very high	186 Å²	186	46.8 Å²	46.8	70%	0.702	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-16	176.5	-59.1	-57.4	-168.7	112.9	-1.8	113.5	F61 V62 M63	F61-R65 PolarHBondContact O-N 2.85Å; V62-R65 WeakPolarHBondContact O-CB 3.26Å; V62-R65 PolarHBondContact O-N 3.06Å; M63-R65 PolarHBondContact O-N 2.82Å
66	L	92.5	Very high	92	Very high	39 Å²	39	47.9 Å²	47.9	20%	0.204	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-14.7	174.3	-56.4	179.1	0	0	0	111.9	M63 S64 Y272 L276 I327	M63-L66 VanDerWaalsContact O-CB 3.32Å; M63-L66 WeakPolarHBondContact O-CB 3.2Å; M63-L66 PolarHBondContact O-N 3.05Å; M63-L66 HydrophobicContact SD-CD1 3.89Å; S64-L66 PolarHBondContact O-N 3.19Å; L66-Y272 WeakPolarHBondContact O-CE1 3.3Å; L66-Y272 PolarHBondContact O-OH 2.98Å; L66-L276 HydrophobicContact CB-CD1 4.22Å; L66-I327 HydrophobicContact CD1-CD1 3.97Å; L66-I327 HydrophobicContact CD1-CG1 4.36Å; L66-I327 HydrophobicContact CD1-CG2 4.14Å
67	F	91.7	Very high	92.1	Very high	10 Å²	10	47.9 Å²	47.9	4%	0.044	22%	0.224	C	C	.	.	S	Bend	trans	-117.2	171.1	-177	-66.2	-89.1	0	0	0	111.3	M63 S64 R69 V71 V72 L269 Y272 M273 L276 L331 L369	M63-F67 HydrophobicContact CE-CE2 4.32Å; M63-F67 VanDerWaalsContact O-CD2 3.27Å; M63-F67 WeakPolarHBondContact O-CD2 3.37Å; S64-F67 PolarHBondContact O-N 3.23Å; S64-F67 VanDerWaalsContact O-O 3.09Å; F67-R69 PolarHBondContact O-N 2.93Å; F67-V71 HydrophobicContact CB-CB 4.26Å; F67-V71 HydrophobicContact CD1-CG1 4.34Å; F67-V72 HydrophobicContact CB-CG2 4.01Å; F67-V72 HydrophobicContact CD2-CG2 3.57Å; F67-V72 HydrophobicContact CE2-CG2 4.31Å; F67-V72 HydrophobicContact CG-CG2 3.94Å; F67-L269 HydrophobicContact CD1-CD1 4.16Å; F67-L269 HydrophobicContact CE1-CD1 4.2Å; F67-Y272 AromaticContact CD1-CD1 3.66Å; F67-Y272 HydrophobicContact CD1-CD1 3.66Å; F67-Y272 AromaticContact CD1-CE1 3.73Å; F67-Y272 HydrophobicContact CD1-CE1 3.73Å; F67-Y272 AromaticContact CE1-CD1 3.69Å; F67-Y272 HydrophobicContact CE1-CD1 3.69Å; F67-Y272 AromaticContact CE1-CE1 3.93Å; F67-Y272 HydrophobicContact CE1-CE1 3.93Å; F67-Y272 HydrophobicContact CG-CE1 4.31Å; F67-M273 HydrophobicContact CE1-CG 3.94Å; F67-M273 HydrophobicContact CZ-CG 4.29Å; F67-L276 HydrophobicContact CE1-CD1 3.99Å; F67-L276 HydrophobicContact CE2-CD1 3.97Å; F67-L276 HydrophobicContact CZ-CD1 3.52Å; F67-L331 HydrophobicContact CE2-CD2 4.16Å; F67-L331 HydrophobicContact CZ-CD2 3.66Å; F67-L369 HydrophobicContact CD1-CD1 3.9Å; F67-L369 HydrophobicContact CD2-CD1 4.36Å; F67-L369 HydrophobicContact CE1-CD1 3.51Å; F67-L369 HydrophobicContact CE2-CD1 4.03Å; F67-L369 HydrophobicContact CG-CD1 4.33Å; F67-L369 HydrophobicContact CZ-CD1 3.59Å
68	K	85.3	Confident	92.1	Very high	39 Å²	39	47.9 Å²	47.9	17%	0.17	22%	0.224	C	C	.	.			trans	-56.6	138.2	164.4	-61	-172.9	178.9	179.3	0	108.5	H70 V71 Y253 V264 N266	K68-H70 PolarHBondContact O-N 2.87Å; K68-V71 HydrophobicContact CB-CG2 4.06Å; K68-V71 PolarHBondContact O-N 3.06Å; K68-Y253 PolarHBondContact NZ-O 2.95Å; K68-Y253 VanDerWaalsContact NZ-O 3.12Å; K68-V264 HydrophobicContact CG-CB 4.1Å; K68-V264 HydrophobicContact CG-CG1 4.13Å; K68-N266 PolarHBondContact NZ-OD1 3.19Å
69	R	77.6	Confident	91.9	Very high	207 Å²	207	46.1 Å²	46.1	78%	0.781	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-33.4	-166.7	-174.4	175.3	176.9	163.7	-2.6	114.3	F67	F67-R69 PolarHBondContact O-N 2.93Å
70	H	84.5	Confident	91.6	Very high	82 Å²	82	45.2 Å²	45.2	38%	0.38	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-12.3	-174.5	-54.2	-65.8	0	0	0	114.7	K68 R368	K68-H70 PolarHBondContact O-N 2.87Å; H70-R368 WeakPolarHBondContact O-CD 3.38Å; H70-R368 PolarHBondContact O-NE 3.36Å; H70-R368 PolarHBondContact O-NH1 3.07Å
71	V	92.1	Very high	91.1	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.036	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-35.5	-173.5	171.6	0	0	0	0	111.8	F67 K68 Y253 L269 R368 L369	F67-V71 HydrophobicContact CB-CB 4.26Å; F67-V71 HydrophobicContact CD1-CG1 4.34Å; K68-V71 HydrophobicContact CB-CG2 4.06Å; K68-V71 PolarHBondContact O-N 3.06Å; V71-Y253 HydrophobicContact CG2-CD1 4.11Å; V71-Y253 HydrophobicContact CG2-CE1 4.09Å; V71-L269 HydrophobicContact CG1-CD1 3.74Å; V71-L269 HydrophobicContact CG1-CD2 4.06Å; V71-R368 CarbonylContact O-C 3.55Å; V71-R368 WeakPolarHBondContact O-CA 3.28Å; V71-L369 HydrophobicContact CG1-CD1 3.97Å; V71-L369 HydrophobicContact CG1-CG 3.9Å; V71-L369 PolarHBondContact O-N 3.42Å
72	V	94.6	Very high	90.6	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.055	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-93.5	125	-178.8	173.8	0	0	0	0	110	F67 V74 L369 L372	F67-V72 HydrophobicContact CB-CG2 4.01Å; F67-V72 HydrophobicContact CD2-CG2 3.57Å; F67-V72 HydrophobicContact CE2-CG2 4.31Å; F67-V72 HydrophobicContact CG-CG2 3.94Å; V72-V74 HydrophobicContact CG1-CG2 4Å; V72-V74 PolarHBondContact O-N 2.96Å; V72-L369 HydrophobicContact CG2-CB 4.3Å; V72-L369 HydrophobicContact CG2-CD1 4.39Å; V72-L372 HydrophobicContact CB-CD1 4.27Å; V72-L372 HydrophobicContact CG1-CD1 3.71Å; V72-L372 HydrophobicContact CG2-CD1 3.61Å
73	A	93.9	Very high	90	Very high	13 Å²	13	43.5 Å²	43.5	11%	0.107	21%	0.208	C	C	.	.			trans	-80.7	101.7	169.1	0	0	0	0	0	109	L112 L115 L369 I370	A73-L112 HydrophobicContact CB-CD2 4.06Å; A73-L115 HydrophobicContact CB-CD1 4.01Å; A73-L369 PolarHBondContact N-O 2.61Å; A73-I370 HydrophobicContact CB-CG2 4.07Å
74	V	94.3	Very high	89.4	Confident	54 Å²	54	45.4 Å²	45.4	33%	0.327	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-83	121	177.8	-175.9	0	0	0	0	108.7	C60 F61 V72	C60-V74 HydrophobicContact CB-CG1 4.5Å; F61-V74 HydrophobicContact CB-CG1 4.14Å; V72-V74 HydrophobicContact CG1-CG2 4Å; V72-V74 PolarHBondContact O-N 2.96Å
75	P	95.5	Very high	89	Confident	10 Å²	10	44.7 Å²	44.7	7%	0.065	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-70.4	158.7	177.1	28.1	-32	0	0	0	111.8	T57 C60 M110 E111 L112	T57-P75 HydrophobicContact CG2-CG 4.26Å; T57-P75 VanDerWaalsContact CG2-O 3.29Å; T57-P75 WeakPolarHBondContact CG2-O 3.18Å; C60-P75 HydrophobicContact CB-CG 4.32Å; P75-M110 HydrophobicContact CB-CB 3.77Å; P75-M110 HydrophobicContact CB-CG 4.09Å; P75-M110 HydrophobicContact CB-SD 4.25Å; P75-M110 HydrophobicContact CG-CB 4.48Å; P75-M110 HydrophobicContact CG-CG 4.33Å; P75-M110 HydrophobicContact CG-SD 3.93Å; P75-E111 CarbonylContact C-O 3.57Å; P75-E111 VanDerWaalsContact CA-O 3.27Å; P75-E111 WeakPolarHBondContact CA-O 3.43Å; P75-L112 HydrophobicContact CB-CD1 3.99Å; P75-L112 HydrophobicContact CB-CD2 4.2Å; P75-L112 HydrophobicContact CB-CG 3.85Å
76	Q	95	Very high	88.4	Confident	91 Å²	91	39.6 Å²	39.6	43%	0.425	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.4	163.9	-175	173.8	13.7	0	0	109.4	A4 I78 M110 E111	A4-Q76 VanDerWaalsContact CB-NE2 3.32Å; Q76-I78 HydrophobicContact CB-CG2 4.48Å; Q76-I78 HydrophobicContact CG-CG2 4.01Å; Q76-I78 PolarHBondContact O-N 2.89Å; Q76-M110 WeakPolarHBondContact O-CA 3.48Å; Q76-E111 HydrophobicContact CB-CB 4.45Å; Q76-E111 PolarHBondContact N-O 2.75Å; Q76-E111 PolarHBondContact O-N 3.07Å
77	L	94.6	Very high	87.9	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.9	170.8	-179.3	61.6	0	0	0	109.4	V3 A4 Y50 M53 T57 Y108	V3-L77 HydrophobicContact CG2-CD2 4.13Å; V3-L77 HydrophobicContact CG2-CG 4.45Å; A4-L77 PolarHBondContact N-O 3.24Å; Y50-L77 HydrophobicContact CD2-CD2 4.18Å; Y50-L77 HydrophobicContact CE2-CD2 3.69Å; M53-L77 HydrophobicContact CB-CD1 3.6Å; T57-L77 HydrophobicContact CG2-CB 4.36Å; L77-Y108 HydrophobicContact CD1-CD1 4.36Å
78	I	92.6	Very high	87.4	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	160.1	-179.6	63.2	161.9	0	0	0	111.2	A4 W36 Q76 L80 Y108 A109 E111	A4-I78 HydrophobicContact CB-CG2 4.35Å; A4-I78 WeakPolarHBondContact O-CA 3.45Å; W36-I78 VanDerWaalsContact CD1-CD1 3.41Å; W36-I78 HydrophobicContact CD2-CD1 4.49Å; W36-I78 HydrophobicContact CG-CD1 4.22Å; Q76-I78 HydrophobicContact CB-CG2 4.48Å; Q76-I78 HydrophobicContact CG-CG2 4.01Å; Q76-I78 PolarHBondContact O-N 2.89Å; I78-L80 HydrophobicContact CD1-CD1 4.13Å; I78-L80 HydrophobicContact CD1-CD2 3.54Å; I78-L80 HydrophobicContact CD1-CG 3.75Å; I78-L80 HydrophobicContact CG1-CG 4.31Å; I78-Y108 WeakPolarHBondContact O-CA 3.29Å; I78-A109 HydrophobicContact CD1-CB 4.4Å; I78-A109 HydrophobicContact CG1-CB 4.04Å; I78-A109 WeakPolarHBondContact CG1-O 3.48Å; I78-A109 PolarHBondContact N-O 3.04Å; I78-A109 PolarHBondContact O-N 3Å; I78-E111 HydrophobicContact CD1-CB 4.04Å; I78-E111 HydrophobicContact CG1-CB 4.31Å; I78-E111 HydrophobicContact CG2-CB 4.21Å
79	S	90.2	Very high	87.2	Confident	20 Å²	20	43 Å²	43	14%	0.14	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.3	167.2	-175.2	0	0	0	0	110	A4 S6 T106	A4-S79 PolarHBondContact O-N 3.29Å; S6-S79 PolarHBondContact N-O 3.02Å; S79-T106 WeakPolarHBondContact OG-CB 3.27Å; S79-T106 PolarHBondContact OG-OG1 3.07Å
80	L	87.6	Confident	87.2	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.8	-178.2	-67.8	177.4	0	0	0	110.7	W36 V38 I78 L85 T106 V107 A109	W36-L80 HydrophobicContact CB-CD1 4.11Å; W36-L80 HydrophobicContact CD2-CD1 3.57Å; W36-L80 HydrophobicContact CD2-CD2 3.96Å; W36-L80 HydrophobicContact CD2-CG 4.42Å; W36-L80 HydrophobicContact CE3-CD1 3.65Å; W36-L80 HydrophobicContact CE3-CD2 4.14Å; W36-L80 HydrophobicContact CG-CD1 3.78Å; W36-L80 HydrophobicContact CH2-CD2 3.84Å; W36-L80 HydrophobicContact CZ2-CD2 3.62Å; W36-L80 HydrophobicContact CZ3-CD1 4.29Å; W36-L80 HydrophobicContact CZ3-CD2 4.08Å; V38-L80 HydrophobicContact CG2-CD1 4.24Å; I78-L80 HydrophobicContact CD1-CD1 4.13Å; I78-L80 HydrophobicContact CD1-CD2 3.54Å; I78-L80 HydrophobicContact CD1-CG 3.75Å; I78-L80 HydrophobicContact CG1-CG 4.31Å; L80-L85 HydrophobicContact CD1-CD2 4.08Å; L80-T106 CarbonylContact O-C 3.54Å; L80-T106 WeakPolarHBondContact O-CA 3.4Å; L80-T106 WeakPolarHBondContact O-CB 3.34Å; L80-V107 HydrophobicContact CB-CG2 4.28Å; L80-V107 PolarHBondContact N-O 2.92Å; L80-V107 PolarHBondContact O-N 2.99Å; L80-A109 HydrophobicContact CD1-CB 3.5Å; L80-A109 HydrophobicContact CG-CB 4.14Å
81	D	85.1	Confident	86.9	Confident	53 Å²	53	32.5 Å²	32.5	28%	0.283	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	130.8	169.1	-171.3	-33.9	0	0	0	110.2	S83 L84	D81-S83 PolarHBondContact O-N 3.31Å; D81-S83 VanDerWaalsContact OD1-CB 3.29Å; D81-S83 WeakPolarHBondContact OD1-CB 3.4Å; D81-S83 PolarHBondContact OD1-N 2.97Å; D81-S83 PolarHBondContact OD1-OG 3.44Å; D81-S83 PolarHBondContact OD2-OG 3.2Å; D81-L84 WeakPolarHBondContact O-CB 3.34Å; D81-L84 PolarHBondContact O-N 3.49Å
82	V	82.2	Confident	86	Confident	7 Å²	7	38.1 Å²	38.1	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-36.4	178	171.1	0	0	0	0	111.5	L84 L85 E86 V96 S105 V107	V82-L84 PolarHBondContact O-N 2.85Å; V82-L85 WeakPolarHBondContact O-CA 3.42Å; V82-L85 WeakPolarHBondContact O-CB 3.4Å; V82-L85 PolarHBondContact O-N 2.89Å; V82-E86 HydrophobicContact CG1-CG 4.06Å; V82-E86 PolarHBondContact O-N 2.79Å; V82-V96 HydrophobicContact CG1-CB 4.49Å; V82-V96 HydrophobicContact CG1-CG2 4.03Å; V82-V96 HydrophobicContact CG2-CG2 4.4Å; V82-S105 WeakPolarHBondContact CB-O 3.43Å; V82-S105 VanDerWaalsContact CG2-O 3.28Å; V82-S105 WeakPolarHBondContact CG2-O 3.49Å; V82-S105 PolarHBondContact N-O 3.35Å; V82-V107 HydrophobicContact CG2-CG1 3.76Å
83	S	81.2	Confident	85.3	Confident	66 Å²	66	44.4 Å²	44.4	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-32.4	-179.8	67.4	0	0	0	0	112.7	D81 L85	D81-S83 PolarHBondContact O-N 3.31Å; D81-S83 VanDerWaalsContact OD1-CB 3.29Å; D81-S83 WeakPolarHBondContact OD1-CB 3.4Å; D81-S83 PolarHBondContact OD1-N 2.97Å; D81-S83 PolarHBondContact OD1-OG 3.44Å; D81-S83 PolarHBondContact OD2-OG 3.2Å; S83-L85 VanDerWaalsContact C-N 3.31Å; S83-L85 PolarHBondContact O-N 2.91Å
84	L	82.3	Confident	84.5	Confident	40 Å²	40	45.6 Å²	45.6	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-37	174.9	-178	61.5	0	0	0	111.4	P9 W36 D81 V82 S87	P9-L84 HydrophobicContact CG-CD1 4.22Å; P9-L84 HydrophobicContact CG-CD2 4.2Å; W36-L84 HydrophobicContact CH2-CD2 3.5Å; W36-L84 VanDerWaalsContact CH2-CD2 3.5Å; W36-L84 HydrophobicContact CH2-CG 4.47Å; W36-L84 HydrophobicContact CZ3-CD2 3.68Å; W36-L84 HydrophobicContact CZ3-CG 4.25Å; D81-L84 WeakPolarHBondContact O-CB 3.34Å; D81-L84 PolarHBondContact O-N 3.49Å; V82-L84 PolarHBondContact O-N 2.85Å; L84-S87 PolarHBondContact O-OG 2.94Å
85	L	83.4	Confident	83.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-77.9	-35.9	-178.7	-56.9	177.9	0	0	0	112.2	I25 W36 V38 L80 V82 S83 S87 V88 F91 V107	I25-L85 HydrophobicContact CD1-CD2 3.53Å; W36-L85 HydrophobicContact CE3-CD2 4.37Å; V38-L85 HydrophobicContact CG1-CD1 4.13Å; V38-L85 HydrophobicContact CG2-CD1 4.42Å; V38-L85 HydrophobicContact CG2-CD2 4.29Å; L80-L85 HydrophobicContact CD1-CD2 4.08Å; V82-L85 WeakPolarHBondContact O-CA 3.42Å; V82-L85 WeakPolarHBondContact O-CB 3.4Å; V82-L85 PolarHBondContact O-N 2.89Å; S83-L85 VanDerWaalsContact C-N 3.31Å; S83-L85 PolarHBondContact O-N 2.91Å; L85-S87 PolarHBondContact O-N 2.82Å; L85-V88 WeakPolarHBondContact O-CB 3.46Å; L85-V88 PolarHBondContact O-N 3.27Å; L85-F91 HydrophobicContact CB-CD1 3.58Å; L85-F91 HydrophobicContact CB-CD2 4.12Å; L85-F91 HydrophobicContact CB-CE1 3.52Å; L85-F91 HydrophobicContact CB-CE2 4.09Å; L85-F91 HydrophobicContact CB-CG 3.88Å; L85-F91 HydrophobicContact CB-CZ 3.78Å; L85-F91 HydrophobicContact CD1-CE1 4.17Å; L85-F91 HydrophobicContact CD1-CE2 3.85Å; L85-F91 HydrophobicContact CD1-CZ 3.61Å; L85-F91 HydrophobicContact CG-CZ 4.34Å; L85-F91 WeakPolarHBondContact O-CB 3.22Å; L85-V107 HydrophobicContact CD1-CG2 3.32Å
86	E	81.3	Confident	82	Confident	78 Å²	78	47.3 Å²	47.3	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-23.2	177.1	-72.2	-178	160.6	0	0	113.2	V82 V88 Q92	V82-E86 HydrophobicContact CG1-CG 4.06Å; V82-E86 PolarHBondContact O-N 2.79Å; E86-V88 PolarHBondContact O-N 2.94Å; E86-Q92 PolarHBondContact O-NE2 2.71Å
87	S	80.4	Confident	80.6	Confident	72 Å²	72	45 Å²	45	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.3	171.8	78.4	0	0	0	0	113.7	L84 L85 P89	L84-S87 PolarHBondContact O-OG 2.94Å; L85-S87 PolarHBondContact O-N 2.82Å; S87-P89 WeakPolarHBondContact O-CD 3.17Å
88	V	82.5	Confident	79.1	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	28%	0.279	C	S	.	.	S	Bend	trans	-92.7	111.9	179.1	-177.5	0	0	0	0	109.2	A13 F15 I25 L85 E86 H90 F91	A13-V88 HydrophobicContact CB-CG2 3.98Å; F15-V88 HydrophobicContact CB-CG1 4.08Å; I25-V88 HydrophobicContact CG2-CG2 4.18Å; L85-V88 WeakPolarHBondContact O-CB 3.46Å; L85-V88 PolarHBondContact O-N 3.27Å; E86-V88 PolarHBondContact O-N 2.94Å; V88-H90 HydrophobicContact CG1-CB 4.48Å; V88-H90 PolarHBondContact O-N 3.2Å; V88-F91 HydrophobicContact CB-CB 4.19Å; V88-F91 WeakPolarHBondContact O-CB 3.31Å; V88-F91 PolarHBondContact O-N 3.05Å
89	P	79.8	Confident	77.7	Confident	86 Å²	86	54.9 Å²	54.9	56%	0.558	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.9	-172.8	-27.7	34.9	0	0	0	114.8	S87 Q92	S87-P89 WeakPolarHBondContact O-CD 3.17Å; P89-Q92 WeakPolarHBondContact O-CB 3.4Å; P89-Q92 PolarHBondContact O-N 2.85Å
90	H	78.9	Confident	76.4	Confident	65 Å²	65	55.1 Å²	55.1	30%	0.301	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-28.2	179.2	-69.6	55.2	0	0	0	112.7	F15 V88 Q92 R93	F15-H90 HydrophobicContact CB-CB 3.88Å; F15-H90 HydrophobicContact CD1-CB 4.41Å; F15-H90 AromaticContact CD1-CD2 3.17Å; F15-H90 WeakPolarHBondContact CD1-CD2 3.4Å; F15-H90 AromaticContact CD1-CG 3.74Å; F15-H90 AromaticContact CD1-NE2 3.54Å; F15-H90 HydrophobicContact CD2-CB 3.26Å; F15-H90 AromaticContact CD2-CD2 3.54Å; F15-H90 AromaticContact CD2-CG 3.52Å; F15-H90 AromaticContact CE1-CD2 3.33Å; F15-H90 WeakPolarHBondContact CE1-CD2 3.3Å; F15-H90 AromaticContact CE1-NE2 3.81Å; F15-H90 HydrophobicContact CE2-CB 3.79Å; F15-H90 AromaticContact CE2-CD2 3.67Å; F15-H90 HydrophobicContact CG-CB 3.6Å; F15-H90 AromaticContact CG-CD2 3.26Å; F15-H90 WeakPolarHBondContact CG-CD2 3.41Å; F15-H90 AromaticContact CG-CG 3.33Å; F15-H90 AromaticContact CG-ND1 3.96Å; F15-H90 AromaticContact CG-NE2 3.96Å; F15-H90 AromaticContact CZ-CD2 3.56Å; V88-H90 HydrophobicContact CG1-CB 4.48Å; V88-H90 PolarHBondContact O-N 3.2Å; H90-Q92 VanDerWaalsContact C-N 3.27Å; H90-R93 PolarHBondContact CD2-NH2 2.98Å; H90-R93 PolarHBondContact NE2-NH2 2.85Å; H90-R93 PolarHBondContact O-N 2.94Å
91	F	76.9	Confident	75.2	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.018	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-69.1	-30.7	174.9	-170.7	-97.9	0	0	0	111.3	I23 I25 V38 F42 L85 V88 R93 H94 V96	I23-F91 HydrophobicContact CD1-CD2 3.7Å; I23-F91 HydrophobicContact CD1-CE2 4.22Å; I25-F91 HydrophobicContact CD1-CD2 4.14Å; V38-F91 HydrophobicContact CB-CE2 4.41Å; V38-F91 HydrophobicContact CG1-CE2 3.87Å; V38-F91 HydrophobicContact CG1-CZ 4.49Å; F42-F91 HydrophobicContact CE1-CZ 4.47Å; F42-F91 HydrophobicContact CE2-CE2 4.43Å; F42-F91 HydrophobicContact CE2-CZ 4.01Å; F42-F91 AromaticContact CZ-CE2 3.83Å; F42-F91 HydrophobicContact CZ-CE2 3.83Å; F42-F91 AromaticContact CZ-CZ 3.51Å; F42-F91 HydrophobicContact CZ-CZ 3.51Å; L85-F91 HydrophobicContact CB-CD1 3.58Å; L85-F91 HydrophobicContact CB-CD2 4.12Å; L85-F91 HydrophobicContact CB-CE1 3.52Å; L85-F91 HydrophobicContact CB-CE2 4.09Å; L85-F91 HydrophobicContact CB-CG 3.88Å; L85-F91 HydrophobicContact CB-CZ 3.78Å; L85-F91 HydrophobicContact CD1-CE1 4.17Å; L85-F91 HydrophobicContact CD1-CE2 3.85Å; L85-F91 HydrophobicContact CD1-CZ 3.61Å; L85-F91 HydrophobicContact CG-CZ 4.34Å; L85-F91 WeakPolarHBondContact O-CB 3.22Å; V88-F91 HydrophobicContact CB-CB 4.19Å; V88-F91 WeakPolarHBondContact O-CB 3.31Å; V88-F91 PolarHBondContact O-N 3.05Å; F91-R93 PolarHBondContact O-N 2.77Å; F91-H94 CarbonylContact O-C 3.51Å; F91-H94 PolarHBondContact O-N 2.78Å; F91-V96 HydrophobicContact CE1-CG2 4.09Å; F91-V96 HydrophobicContact CZ-CG2 4.16Å
92	Q	74.5	Confident	74	Confident	124 Å²	124	61.2 Å²	61.2	58%	0.579	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.2	-19.1	176.6	-58.7	177.4	-14.7	0	0	113.5	E86 P89 H90 H94	E86-Q92 PolarHBondContact O-NE2 2.71Å; P89-Q92 WeakPolarHBondContact O-CB 3.4Å; P89-Q92 PolarHBondContact O-N 2.85Å; H90-Q92 VanDerWaalsContact C-N 3.27Å; Q92-H94 PolarHBondContact O-N 3.21Å
93	R	78.9	Confident	72.7	Confident	140 Å²	140	66.3 Å²	66.3	53%	0.528	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-71.8	-11.9	172.5	-67.3	-168.8	-96.9	137.3	-16.1	113.8	E18 H90 F91	E18-R93 IonicContact OE2-NH1 4Å; E18-R93 PolarHBondContact OE2-NH1 3.18Å; H90-R93 PolarHBondContact CD2-NH2 2.98Å; H90-R93 PolarHBondContact NE2-NH2 2.85Å; H90-R93 PolarHBondContact O-N 2.94Å; F91-R93 PolarHBondContact O-N 2.77Å
94	H	77.7	Confident	71.8	Confident	38 Å²	38	71 Å²	71	18%	0.176	40%	0.397	C	S	.	.	S	Bend	trans	-127.7	69.4	-178.2	-60.7	-78.4	0	0	0	108.9	E18 I23 F91 Q92 V96	E18-H94 IonicContact OE1-CE1 3.3Å; E18-H94 IonicContact OE1-NE2 3.09Å; E18-H94 PolarHBondContact OE1-NE2 3.16Å; I23-H94 HydrophobicContact CD1-CB 3.86Å; I23-H94 WeakPolarHBondContact CD1-CD2 3.38Å; F91-H94 CarbonylContact O-C 3.51Å; F91-H94 PolarHBondContact O-N 2.78Å; Q92-H94 PolarHBondContact O-N 3.21Å; H94-V96 PolarHBondContact O-N 2.98Å
95	P	67.5	Low	71.6	Confident	97 Å²	97	69.9 Å²	69.9	63%	0.63	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-61.6	134.6	-172	25.6	-34	0	0	0	110.7
96	V	68.9	Low	71.6	Confident	4 Å²	4	73.1 Å²	73.1	2%	0.024	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-64.3	138.6	165.2	-179.9	0	0	0	0	107.3	F42 V82 F91 H94 V98 R100	F42-V96 HydrophobicContact CD1-CG2 4.47Å; F42-V96 HydrophobicContact CD2-CB 4.42Å; F42-V96 HydrophobicContact CD2-CG2 3.91Å; F42-V96 HydrophobicContact CE1-CG2 4.37Å; F42-V96 HydrophobicContact CE2-CG2 3.79Å; F42-V96 HydrophobicContact CG-CG2 4.27Å; F42-V96 HydrophobicContact CZ-CG2 4.04Å; V82-V96 HydrophobicContact CG1-CB 4.49Å; V82-V96 HydrophobicContact CG1-CG2 4.03Å; V82-V96 HydrophobicContact CG2-CG2 4.4Å; F91-V96 HydrophobicContact CE1-CG2 4.09Å; F91-V96 HydrophobicContact CZ-CG2 4.16Å; H94-V96 PolarHBondContact O-N 2.98Å; V96-V98 PolarHBondContact O-N 2.82Å; V96-R100 HydrophobicContact CG1-CB 3.4Å; V96-R100 VanDerWaalsContact CG1-CB 3.4Å; V96-R100 HydrophobicContact CG1-CG 4.41Å
97	S	66.4	Low	71.8	Confident	41 Å²	41	69.6 Å²	69.6	29%	0.287	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-54.5	142.2	179.5	59.7	0	0	0	0	110.8	A99 R100 Q101	S97-A99 PolarHBondContact O-N 3.38Å; S97-R100 CarbonylContact O-C 3.59Å; S97-R100 WeakPolarHBondContact O-CA 3.39Å; S97-R100 WeakPolarHBondContact O-CB 3.14Å; S97-R100 PolarHBondContact O-N 3.36Å; S97-Q101 PolarHBondContact O-N 2.95Å
98	V	63.2	Low	72.2	Confident	121 Å²	121	69 Å²	69	73%	0.733	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-52	-34.7	178.6	-179.5	0	0	0	0	112.5	V96 R100 Q101	V96-V98 PolarHBondContact O-N 2.82Å; V98-R100 PolarHBondContact O-N 2.98Å; V98-R100 VanDerWaalsContact O-N 3.11Å; V98-Q101 PolarHBondContact O-N 2.88Å
99	A	62.8	Low	72.7	Confident	93 Å²	93	68.9 Å²	68.9	77%	0.769	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-59.6	-20.9	175.3	0	0	0	0	0	114.5	S97	S97-A99 PolarHBondContact O-N 3.38Å
100	R	63.8	Low	73.4	Confident	25 Å²	25	64.9 Å²	64.9	9%	0.094	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-108.5	11.7	176.6	-84.2	-167.1	177.3	148	8.7	112.3	S43 D45 D46 V96 S97 V98 T102 S105	S43-R100 PolarHBondContact O-NH1 3.21Å; S43-R100 PolarHBondContact O-NH2 2.95Å; D45-R100 PolarHBondContact O-NH2 3.48Å; D46-R100 IonicContact OD1-CZ 3.6Å; D46-R100 IonicContact OD1-NE 3.4Å; D46-R100 PolarHBondContact OD1-NE 3.1Å; D46-R100 IonicContact OD1-NH2 2.92Å; D46-R100 PolarHBondContact OD1-NH2 2.89Å; V96-R100 HydrophobicContact CG1-CB 3.4Å; V96-R100 VanDerWaalsContact CG1-CB 3.4Å; V96-R100 HydrophobicContact CG1-CG 4.41Å; S97-R100 CarbonylContact O-C 3.59Å; S97-R100 WeakPolarHBondContact O-CA 3.39Å; S97-R100 WeakPolarHBondContact O-CB 3.14Å; S97-R100 PolarHBondContact O-N 3.36Å; V98-R100 PolarHBondContact O-N 2.98Å; V98-R100 VanDerWaalsContact O-N 3.11Å; R100-T102 VanDerWaalsContact C-N 3.32Å; R100-T102 PolarHBondContact O-N 3.36Å; R100-S105 WeakPolarHBondContact O-CB 3.33Å; R100-S105 PolarHBondContact O-OG 3.35Å
101	Q	61.4	Low	74.2	Confident	96 Å²	96	62.1 Å²	62.1	45%	0.449	34%	0.344	S	S	.	.			trans	-94.4	69.1	172.2	-71.8	-179	-24.8	0	0	108.7	S97 V98	S97-Q101 PolarHBondContact O-N 2.95Å; V98-Q101 PolarHBondContact O-N 2.88Å
102	T	59.9	Low	75	Confident	86 Å²	86	62.7 Å²	62.7	53%	0.528	35%	0.347	S	S	.	.	S	Bend	trans	-106.5	156.6	164	71.7	0	0	0	0	109	R100 E104 S105	R100-T102 VanDerWaalsContact C-N 3.32Å; R100-T102 PolarHBondContact O-N 3.36Å; T102-E104 PolarHBondContact O-N 2.96Å; T102-S105 PolarHBondContact N-OG 3.13Å; T102-S105 VanDerWaalsContact N-OG 3.13Å; T102-S105 WeakPolarHBondContact O-CB 3.39Å; T102-S105 PolarHBondContact O-N 3.29Å; T102-S105 PolarHBondContact O-OG 2.72Å; T102-S105 PolarHBondContact OG1-N 2.75Å; T102-S105 PolarHBondContact OG1-OG 3.04Å
103	S	55.4	Low	76	Confident	115 Å²	115	59.3 Å²	59.3	80%	0.804	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-10	179.6	51.5	0	0	0	0	114.7
104	E	61.7	Low	76.8	Confident	164 Å²	164	53.1 Å²	53.1	77%	0.766	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	11.2	180	-62	-177.8	172.2	0	0	112.3	T102 T106	T102-E104 PolarHBondContact O-N 2.96Å; E104-T106 PolarHBondContact O-N 3.45Å
105	S	78.2	Confident	77.6	Confident	17 Å²	17	52.2 Å²	52.2	12%	0.119	31%	0.309	C	S	.	.			trans	-70.2	128.1	-177.3	-72.1	0	0	0	0	110.9	V82 R100 T102	V82-S105 WeakPolarHBondContact CB-O 3.43Å; V82-S105 VanDerWaalsContact CG2-O 3.28Å; V82-S105 WeakPolarHBondContact CG2-O 3.49Å; V82-S105 PolarHBondContact N-O 3.35Å; R100-S105 WeakPolarHBondContact O-CB 3.33Å; R100-S105 PolarHBondContact O-OG 3.35Å; T102-S105 PolarHBondContact N-OG 3.13Å; T102-S105 VanDerWaalsContact N-OG 3.13Å; T102-S105 WeakPolarHBondContact O-CB 3.39Å; T102-S105 PolarHBondContact O-N 3.29Å; T102-S105 PolarHBondContact O-OG 2.72Å; T102-S105 PolarHBondContact OG1-N 2.75Å; T102-S105 PolarHBondContact OG1-OG 3.04Å
106	T	83.1	Confident	78.9	Confident	68 Å²	68	47.9 Å²	47.9	42%	0.417	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	156.6	177.2	63.4	0	0	0	0	111.3	S79 L80 E104	S79-T106 WeakPolarHBondContact OG-CB 3.27Å; S79-T106 PolarHBondContact OG-OG1 3.07Å; L80-T106 CarbonylContact O-C 3.54Å; L80-T106 WeakPolarHBondContact O-CA 3.4Å; L80-T106 WeakPolarHBondContact O-CB 3.34Å; E104-T106 PolarHBondContact O-N 3.45Å
107	V	86.1	Confident	80	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.2	172.5	-64	0	0	0	0	110.3	V38 F42 L80 V82 L85	V38-V107 HydrophobicContact CG1-CG2 4.16Å; F42-V107 HydrophobicContact CD1-CG1 4Å; F42-V107 HydrophobicContact CE1-CB 4.25Å; F42-V107 HydrophobicContact CE1-CG1 3.74Å; L80-V107 HydrophobicContact CB-CG2 4.28Å; L80-V107 PolarHBondContact N-O 2.92Å; L80-V107 PolarHBondContact O-N 2.99Å; V82-V107 HydrophobicContact CG2-CG1 3.76Å; L85-V107 HydrophobicContact CD1-CG2 3.32Å
108	Y	89.2	Confident	81.1	Confident	60 Å²	60	48.7 Å²	48.7	24%	0.235	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	139.3	174	-62.7	-72.3	0	0	0	111.4	V3 Y50 L77 I78	V3-Y108 HydrophobicContact CG1-CE1 4.23Å; V3-Y108 HydrophobicContact CG2-CE1 4.47Å; Y50-Y108 AromaticContact CD2-CD1 4Å; Y50-Y108 HydrophobicContact CD2-CD1 4Å; Y50-Y108 HydrophobicContact CD2-CD2 4.25Å; Y50-Y108 AromaticContact CD2-CE1 3.64Å; Y50-Y108 HydrophobicContact CD2-CE1 3.64Å; Y50-Y108 AromaticContact CD2-CE2 3.94Å; Y50-Y108 HydrophobicContact CD2-CE2 3.94Å; Y50-Y108 HydrophobicContact CD2-CG 4.28Å; Y50-Y108 AromaticContact CD2-CZ 3.61Å; Y50-Y108 HydrophobicContact CE2-CE1 4.24Å; Y50-Y108 HydrophobicContact CG-CE2 4.23Å; L77-Y108 HydrophobicContact CD1-CD1 4.36Å; I78-Y108 WeakPolarHBondContact O-CA 3.29Å
109	A	91.6	Very high	82	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	158.3	175.5	0	0	0	0	0	111.4	W36 R37 V38 I78 L80	W36-A109 HydrophobicContact CB-CB 4.39Å; R37-A109 WeakPolarHBondContact O-CA 3.28Å; V38-A109 HydrophobicContact CG2-CB 3.99Å; I78-A109 HydrophobicContact CD1-CB 4.4Å; I78-A109 HydrophobicContact CG1-CB 4.04Å; I78-A109 WeakPolarHBondContact CG1-O 3.48Å; I78-A109 PolarHBondContact N-O 3.04Å; I78-A109 PolarHBondContact O-N 3Å; L80-A109 HydrophobicContact CD1-CB 3.5Å; L80-A109 HydrophobicContact CG-CB 4.14Å
110	M	94.6	Very high	82.8	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.7	168.7	-71.3	-177.1	-67.5	0	0	109.4	W36 R37 M53 N56 P75 Q76 L112	W36-M110 WeakPolarHBondContact CA-O 2.96Å; R37-M110 HydrophobicContact CB-CB 4.29Å; R37-M110 HydrophobicContact CB-CE 4.32Å; R37-M110 PolarHBondContact N-O 3.19Å; R37-M110 PolarHBondContact O-N 3.3Å; R37-M110 VanDerWaalsContact O-N 3.11Å; M53-M110 HydrophobicContact CE-CE 4.42Å; M53-M110 HydrophobicContact SD-CE 3.9Å; M53-M110 HydrophobicContact SD-CG 4Å; M53-M110 HydrophobicContact SD-SD 4.39Å; N56-M110 HydrophobicContact CB-SD 3.94Å; P75-M110 HydrophobicContact CB-CB 3.77Å; P75-M110 HydrophobicContact CB-CG 4.09Å; P75-M110 HydrophobicContact CB-SD 4.25Å; P75-M110 HydrophobicContact CG-CB 4.48Å; P75-M110 HydrophobicContact CG-CG 4.33Å; P75-M110 HydrophobicContact CG-SD 3.93Å; Q76-M110 WeakPolarHBondContact O-CA 3.48Å; M110-L112 HydrophobicContact CB-CD1 4.31Å
111	E	95.5	Very high	83.6	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.2	173.7	-172.2	177.8	104	0	0	110.8	F27 R29 Y34 V35 W36 P75 Q76 I78	F27-E111 HydrophobicContact CE1-CG 4.46Å; F27-E111 HydrophobicContact CZ-CG 4.17Å; F27-E111 WeakPolarHBondContact CZ-OE2 3.45Å; R29-E111 IonicContact CZ-OE1 2.94Å; R29-E111 IonicContact CZ-OE2 3.96Å; R29-E111 IonicContact NH1-OE1 2.73Å; R29-E111 PolarHBondContact NH1-OE1 3.12Å; R29-E111 IonicContact NH1-OE2 3.27Å; R29-E111 PolarHBondContact NH1-OE2 3.49Å; R29-E111 IonicContact NH2-OE1 3.8Å; R29-E111 PolarHBondContact NH2-OE1 3.06Å; R29-E111 IonicContact NH2-OE2 3.33Å; Y34-E111 HydrophobicContact CD1-CG 4.38Å; V35-E111 WeakPolarHBondContact O-CA 3.38Å; W36-E111 PolarHBondContact NE1-OE2 3.1Å; P75-E111 CarbonylContact C-O 3.57Å; P75-E111 VanDerWaalsContact CA-O 3.27Å; P75-E111 WeakPolarHBondContact CA-O 3.43Å; Q76-E111 HydrophobicContact CB-CB 4.45Å; Q76-E111 PolarHBondContact N-O 2.75Å; Q76-E111 PolarHBondContact O-N 3.07Å; I78-E111 HydrophobicContact CD1-CB 4.04Å; I78-E111 HydrophobicContact CG1-CB 4.31Å; I78-E111 HydrophobicContact CG2-CB 4.21Å
112	L	95.4	Very high	83.9	Confident	15 Å²	15	46.4 Å²	46.4	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.7	173.9	-62.5	102.1	0	0	0	110.3	Y34 V35 R37 A73 P75 M110	Y34-L112 CarbonylContact C-O 3.56Å; Y34-L112 WeakPolarHBondContact CA-O 3.35Å; V35-L112 HydrophobicContact CG2-CB 4Å; V35-L112 PolarHBondContact N-O 3.18Å; V35-L112 PolarHBondContact O-N 3.48Å; R37-L112 HydrophobicContact CG-CD1 4.24Å; A73-L112 HydrophobicContact CB-CD2 4.06Å; P75-L112 HydrophobicContact CB-CD1 3.99Å; P75-L112 HydrophobicContact CB-CD2 4.2Å; P75-L112 HydrophobicContact CB-CG 3.85Å; M110-L112 HydrophobicContact CB-CD1 4.31Å
113	P	94.4	Very high	84	Confident	54 Å²	54	47.3 Å²	47.3	35%	0.351	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	144.9	164	26.6	-34.3	0	0	0	110.4	L115	P113-L115 HydrophobicContact CB-CD2 4.45Å; P113-L115 HydrophobicContact CG-CD2 3.95Å; P113-L115 PolarHBondContact O-N 2.95Å
114	D	94.9	Very high	83.8	Confident	9 Å²	9	50 Å²	50	5%	0.048	27%	0.265	C	S	.	.			trans	-73.6	96.5	174.7	-170.5	-19.3	0	0	0	109.9	R16 R33 V35 C116 Y117	R16-D114 IonicContact CZ-OD1 3.63Å; R16-D114 IonicContact CZ-OD2 3.76Å; R16-D114 IonicContact NE-OD1 3.93Å; R16-D114 IonicContact NE-OD2 2.82Å; R16-D114 PolarHBondContact NE-OD2 3.18Å; R16-D114 IonicContact NH2-OD1 3.62Å; R16-D114 PolarHBondContact NH2-OD1 3.48Å; R16-D114 IonicContact NH2-OD2 3.2Å; R16-D114 PolarHBondContact NH2-OD2 3.34Å; R33-D114 HydrophobicContact CB-CB 3.69Å; R33-D114 PolarHBondContact O-N 2.78Å; V35-D114 HydrophobicContact CG1-CB 4.09Å; D114-C116 PolarHBondContact O-N 2.96Å; D114-C116 WeakPolarHBondContact OD1-CB 3.3Å; D114-C116 PolarHBondContact OD1-N 3.2Å; D114-Y117 HydrophobicContact CB-CD2 4.15Å; D114-Y117 PolarHBondContact O-N 3.17Å; D114-Y117 WeakPolarHBondContact OD2-CE2 3.47Å
115	L	95.6	Very high	83.9	Confident	20 Å²	20	43.9 Å²	43.9	11%	0.105	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-4.7	-176.3	-59	-175.5	0	0	0	113.8	A73 P113 Y117 M337 T339 R368 I370	A73-L115 HydrophobicContact CB-CD1 4.01Å; P113-L115 HydrophobicContact CB-CD2 4.45Å; P113-L115 HydrophobicContact CG-CD2 3.95Å; P113-L115 PolarHBondContact O-N 2.95Å; L115-Y117 PolarHBondContact O-N 3.1Å; L115-M337 HydrophobicContact CB-CE 3.77Å; L115-M337 HydrophobicContact CB-SD 3.82Å; L115-M337 HydrophobicContact CD1-SD 3.79Å; L115-M337 HydrophobicContact CG-SD 4.4Å; L115-T339 PolarHBondContact O-OG1 3.35Å; L115-R368 HydrophobicContact CD1-CB 3.77Å; L115-R368 HydrophobicContact CD1-CG 4.2Å; L115-R368 HydrophobicContact CD2-CG 4.07Å; L115-I370 HydrophobicContact CD1-CG2 3.33Å
116	C	94.8	Very high	83.3	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.041	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.3	173.2	-61	0	0	0	0	113.8	R16 D114 T129 T131	R16-C116 VanDerWaalsContact NH2-CB 3.27Å; D114-C116 PolarHBondContact O-N 2.96Å; D114-C116 WeakPolarHBondContact OD1-CB 3.3Å; D114-C116 PolarHBondContact OD1-N 3.2Å; C116-T129 WeakPolarHBondContact O-CG2 3.35Å; C116-T131 VanDerWaalsContact CA-OG1 3.26Å; C116-T131 WeakPolarHBondContact CA-OG1 3.31Å; C116-T131 PolarHBondContact O-OG1 2.86Å
117	Y	92.1	Very high	83.2	Confident	46 Å²	46	50 Å²	50	18%	0.18	27%	0.267	C	S	.	.	S	Bend	trans	-132.4	154.4	-178.7	-58	-79.6	0	0	0	111.3	R33 D114 L115 N206	R33-Y117 HydrophobicContact CB-CD2 4.26Å; R33-Y117 VanDerWaalsContact CD-CD2 3.44Å; R33-Y117 HydrophobicContact CG-CD2 4.46Å; D114-Y117 HydrophobicContact CB-CD2 4.15Å; D114-Y117 PolarHBondContact O-N 3.17Å; D114-Y117 WeakPolarHBondContact OD2-CE2 3.47Å; L115-Y117 PolarHBondContact O-N 3.1Å; Y117-N206 HydrophobicContact CE1-CB 4.43Å; Y117-N206 PolarHBondContact OH-O 3.48Å
118	F	89.3	Confident	83.3	Confident	16 Å²	16	52.4 Å²	52.4	7%	0.07	28%	0.28	C	S	.	.			trans	-83.3	141.4	163.7	-70.7	-79.5	0	0	0	109.6	F121 T129 T339 K341 L352 R366	F118-F121 HydrophobicContact CB-CB 4.22Å; F118-F121 HydrophobicContact CB-CD2 3.47Å; F118-F121 VanDerWaalsContact CB-CD2 3.47Å; F118-F121 HydrophobicContact CB-CE2 4.2Å; F118-F121 HydrophobicContact CB-CG 4.2Å; F118-F121 AromaticContact CD1-CD2 3.94Å; F118-F121 HydrophobicContact CD1-CD2 3.94Å; F118-F121 AromaticContact CD1-CE2 3.79Å; F118-F121 HydrophobicContact CD1-CE2 3.79Å; F118-F121 AromaticContact CD2-CD2 3.68Å; F118-F121 HydrophobicContact CD2-CD2 3.68Å; F118-F121 HydrophobicContact CD2-CE2 4.06Å; F118-F121 HydrophobicContact CE1-CE2 4.13Å; F118-F121 HydrophobicContact CE2-CD2 4.38Å; F118-F121 HydrophobicContact CE2-CE2 4.37Å; F118-F121 AromaticContact CG-CD2 3.41Å; F118-F121 HydrophobicContact CG-CD2 3.41Å; F118-F121 VanDerWaalsContact CG-CD2 3.41Å; F118-F121 AromaticContact CG-CE2 3.75Å; F118-F121 HydrophobicContact CG-CE2 3.75Å; F118-F121 HydrophobicContact CZ-CE2 4.39Å; F118-T129 HydrophobicContact CD2-CG2 4.13Å; F118-T129 HydrophobicContact CE2-CG2 4.28Å; F118-T339 HydrophobicContact CD2-CG2 4.12Å; F118-T339 HydrophobicContact CE2-CG2 3.85Å; F118-T339 HydrophobicContact CZ-CG2 4.09Å; F118-T339 VanDerWaalsContact CZ-O 3.31Å; F118-T339 WeakPolarHBondContact CZ-O 3.4Å; F118-K341 HydrophobicContact CD2-CB 4.09Å; F118-K341 HydrophobicContact CD2-CD 4.41Å; F118-K341 HydrophobicContact CE2-CB 3.63Å; F118-L352 HydrophobicContact CD1-CD1 3.64Å; F118-L352 HydrophobicContact CE1-CD1 3.46Å; F118-L352 VanDerWaalsContact CE1-CD1 3.46Å; F118-R366 HydrophobicContact CE1-CB 3.71Å; F118-R366 HydrophobicContact CZ-CB 4.37Å
119	T	82.8	Confident	83.4	Confident	95 Å²	95	50.2 Å²	50.2	58%	0.583	27%	0.273	S	S	*	.	S	Bend	trans	-85.1	-22.5	171.8	38	0	0	0	0	111.8
120	E	79.3	Confident	83.6	Confident	98 Å²	98	50.2 Å²	50.2	46%	0.458	27%	0.273	S	S	.	.	S	Bend	trans	-89.2	-19	-172.6	-60	72.5	-163.1	0	0	113.7	R366	E120-R366 IonicContact OE1-CZ 3.83Å; E120-R366 IonicContact OE1-NH1 2.87Å; E120-R366 PolarHBondContact OE1-NH1 3.03Å; E120-R366 IonicContact OE1-NH2 3.14Å; E120-R366 PolarHBondContact OE1-NH2 3.43Å; E120-R366 IonicContact OE2-CZ 3.89Å; E120-R366 IonicContact OE2-NH1 3.47Å; E120-R366 PolarHBondContact OE2-NH1 3.38Å; E120-R366 IonicContact OE2-NH2 2.86Å; E120-R366 PolarHBondContact OE2-NH2 3.02Å; E120-R366 VanDerWaalsContact OE2-NH2 3.11Å
121	F	80.6	Confident	83.7	Confident	35 Å²	35	50.2 Å²	50.2	15%	0.154	27%	0.273	C	S	.	.	S	Bend	trans	-109.4	131.1	-174.6	-57.4	-48.2	0	0	0	110.5	F118 K341 F343 L352 V364	F118-F121 HydrophobicContact CB-CB 4.22Å; F118-F121 HydrophobicContact CB-CD2 3.47Å; F118-F121 VanDerWaalsContact CB-CD2 3.47Å; F118-F121 HydrophobicContact CB-CE2 4.2Å; F118-F121 HydrophobicContact CB-CG 4.2Å; F118-F121 AromaticContact CD1-CD2 3.94Å; F118-F121 HydrophobicContact CD1-CD2 3.94Å; F118-F121 AromaticContact CD1-CE2 3.79Å; F118-F121 HydrophobicContact CD1-CE2 3.79Å; F118-F121 AromaticContact CD2-CD2 3.68Å; F118-F121 HydrophobicContact CD2-CD2 3.68Å; F118-F121 HydrophobicContact CD2-CE2 4.06Å; F118-F121 HydrophobicContact CE1-CE2 4.13Å; F118-F121 HydrophobicContact CE2-CD2 4.38Å; F118-F121 HydrophobicContact CE2-CE2 4.37Å; F118-F121 AromaticContact CG-CD2 3.41Å; F118-F121 HydrophobicContact CG-CD2 3.41Å; F118-F121 VanDerWaalsContact CG-CD2 3.41Å; F118-F121 AromaticContact CG-CE2 3.75Å; F118-F121 HydrophobicContact CG-CE2 3.75Å; F118-F121 HydrophobicContact CZ-CE2 4.39Å; F121-K341 HydrophobicContact CD2-CD 4.26Å; F121-F343 HydrophobicContact CD1-CZ 4.08Å; F121-F343 HydrophobicContact CD2-CE2 4.49Å; F121-F343 AromaticContact CD2-CZ 3.91Å; F121-F343 HydrophobicContact CD2-CZ 3.91Å; F121-F343 HydrophobicContact CE1-CZ 4.07Å; F121-F343 HydrophobicContact CE2-CE2 4.19Å; F121-F343 AromaticContact CE2-CZ 3.92Å; F121-F343 HydrophobicContact CE2-CZ 3.92Å; F121-F343 HydrophobicContact CG-CZ 4.02Å; F121-F343 HydrophobicContact CZ-CE2 4.38Å; F121-F343 HydrophobicContact CZ-CZ 4Å; F121-L352 HydrophobicContact CE2-CD1 3.94Å; F121-L352 HydrophobicContact CZ-CD1 4.04Å; F121-V364 HydrophobicContact CE2-CG1 4Å; F121-V364 HydrophobicContact CZ-CG1 4Å
122	S	68	Low	83.8	Confident	59 Å²	59	49.8 Å²	49.8	41%	0.413	27%	0.271	S	S	.	.			trans	-57.3	137.8	174.8	173.8	0	0	0	0	110.8	E124 S125	S122-E124 PolarHBondContact O-N 3.23Å; S122-E124 VanDerWaalsContact O-N 3.1Å; S122-E124 WeakPolarHBondContact OG-CB 3.1Å; S122-E124 WeakPolarHBondContact OG-CG 3.45Å; S122-E124 PolarHBondContact OG-N 2.62Å; S122-S125 PolarHBondContact O-N 2.84Å; S122-S125 PolarHBondContact O-OG 3.35Å
123	P	60.6	Low	83.9	Confident	104 Å²	104	50 Å²	50	68%	0.675	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-24.9	170.4	-23.6	32.7	0	0	0	113.6	S125	P123-S125 PolarHBondContact O-N 3.37Å
124	E	52.6	Low	84.1	Confident	172 Å²	172	47.4 Å²	47.4	80%	0.804	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-9.2	-177.4	-61.7	174.6	170.9	0	0	114.1	S122 M126	S122-E124 PolarHBondContact O-N 3.23Å; S122-E124 VanDerWaalsContact O-N 3.1Å; S122-E124 WeakPolarHBondContact OG-CB 3.1Å; S122-E124 WeakPolarHBondContact OG-CG 3.45Å; S122-E124 PolarHBondContact OG-N 2.62Å; E124-M126 PolarHBondContact O-N 3.26Å; E124-M126 VanDerWaalsContact O-N 3.16Å
125	S	62.7	Low	84.3	Confident	36 Å²	36	49.1 Å²	49.1	25%	0.252	26%	0.262	S	S	.	.	S	Bend	trans	-67.9	113.3	172.9	49.8	0	0	0	0	110.4	S122 P123 S127 K341	S122-S125 PolarHBondContact O-N 2.84Å; S122-S125 PolarHBondContact O-OG 3.35Å; P123-S125 PolarHBondContact O-N 3.37Å; S125-S127 PolarHBondContact O-N 2.75Å; S125-K341 PolarHBondContact O-NZ 2.87Å; S125-K341 WeakPolarHBondContact OG-CE 3.44Å; S125-K341 PolarHBondContact OG-NZ 3.06Å
126	M	66.1	Low	84.4	Confident	182 Å²	182	48.2 Å²	48.2	90%	0.897	26%	0.257	S	S	*	.	S	Bend	trans	-51.4	-11.3	-173.9	-70.2	-66.5	-66.7	0	0	116.9	E124	E124-M126 PolarHBondContact O-N 3.26Å; E124-M126 VanDerWaalsContact O-N 3.16Å
127	S	80.2	Confident	84.6	Confident	30 Å²	30	49.4 Å²	49.4	21%	0.21	26%	0.262	C	S	.	.	S	Bend	trans	-88.7	143.6	179.2	60	0	0	0	0	112.6	S125 K341 I342	S125-S127 PolarHBondContact O-N 2.75Å; S127-K341 PolarHBondContact O-NZ 2.78Å; S127-K341 WeakPolarHBondContact OG-CE 3.18Å; S127-K341 VanDerWaalsContact OG-CG 3.29Å; S127-K341 WeakPolarHBondContact OG-CG 3.42Å; S127-K341 PolarHBondContact OG-NZ 3.02Å; S127-I342 VanDerWaalsContact CB-O 3.27Å; S127-I342 WeakPolarHBondContact CB-O 3.48Å; S127-I342 PolarHBondContact OG-O 3.29Å
128	N	88.3	Confident	84.8	Confident	55 Å²	55	47.5 Å²	47.5	29%	0.294	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-66.9	149.3	174.1	-61.7	-65.5	0	0	0	111.2	K205 N206	N128-K205 HydrophobicContact CB-CG 4.14Å; N128-K205 WeakPolarHBondContact ND2-CE 2.99Å; N128-K205 WeakPolarHBondContact OD1-CE 3.22Å; N128-N206 WeakPolarHBondContact CA-OD1 3.24Å; N128-N206 PolarHBondContact OD1-ND2 2.8Å
129	T	92.7	Very high	85.2	Confident	13 Å²	13	47.1 Å²	47.1	8%	0.08	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.3	163.9	-52.1	0	0	0	0	108.4	C116 F118 N206 T339	C116-T129 WeakPolarHBondContact O-CG2 3.35Å; F118-T129 HydrophobicContact CD2-CG2 4.13Å; F118-T129 HydrophobicContact CE2-CG2 4.28Å; T129-N206 PolarHBondContact N-OD1 3.05Å; T129-N206 PolarHBondContact O-N 2.88Å; T129-T339 HydrophobicContact CG2-CG2 3.62Å
130	V	94.8	Very high	85.8	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.6	179.2	178.6	0	0	0	0	108	V203 F204 L226 F227 F241 M340	V130-V203 HydrophobicContact CG1-CG1 4.07Å; V130-F204 CarbonylContact C-O 3.47Å; V130-F204 WeakPolarHBondContact CA-O 3.32Å; V130-L226 HydrophobicContact CG1-CD1 4.06Å; V130-L226 HydrophobicContact CG2-CB 4.12Å; V130-F227 HydrophobicContact CB-CE1 3.9Å; V130-F227 HydrophobicContact CB-CE2 4.48Å; V130-F227 HydrophobicContact CB-CZ 3.67Å; V130-F227 HydrophobicContact CG1-CE2 4.23Å; V130-F227 HydrophobicContact CG1-CZ 3.8Å; V130-F227 HydrophobicContact CG2-CD1 4.48Å; V130-F227 HydrophobicContact CG2-CE1 3.94Å; V130-F227 HydrophobicContact CG2-CZ 4.01Å; V130-F241 HydrophobicContact CG1-CE2 4.22Å; V130-M340 HydrophobicContact CG1-CE 4.16Å; V130-M340 PolarHBondContact N-O 3.13Å; V130-M340 PolarHBondContact O-N 3.44Å
131	T	97.1	Very high	86.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.8	-180	-55	0	0	0	0	110.6	C116 V203 F204 M337 I338	C116-T131 VanDerWaalsContact CA-OG1 3.26Å; C116-T131 WeakPolarHBondContact CA-OG1 3.31Å; C116-T131 PolarHBondContact O-OG1 2.86Å; T131-V203 CarbonylContact O-C 3.57Å; T131-V203 WeakPolarHBondContact O-CA 3.29Å; T131-F204 PolarHBondContact N-O 2.88Å; T131-F204 PolarHBondContact O-N 2.8Å; T131-M337 HydrophobicContact CG2-CE 3.49Å; T131-M337 VanDerWaalsContact CG2-CE 3.49Å; T131-I338 CarbonylContact C-O 3.56Å; T131-I338 VanDerWaalsContact CA-O 3.29Å; T131-I338 WeakPolarHBondContact CA-O 3.4Å
132	V	98	Very high	87.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	121.1	179.9	-172.7	0	0	0	0	108.6	I134 M201 K202 V203 F241 I245 M337 I338 M340	V132-I134 HydrophobicContact CG1-CD1 4.09Å; V132-I134 HydrophobicContact CG1-CG1 3.84Å; V132-M201 HydrophobicContact CG1-CE 3.43Å; V132-M201 VanDerWaalsContact CG1-CE 3.43Å; V132-M201 HydrophobicContact CG1-CG 4.44Å; V132-K202 WeakPolarHBondContact CA-O 3.45Å; V132-V203 HydrophobicContact CG1-CG2 4.46Å; V132-V203 HydrophobicContact CG2-CG1 4.33Å; V132-V203 HydrophobicContact CG2-CG2 4.45Å; V132-F241 HydrophobicContact CG2-CE1 4.34Å; V132-F241 HydrophobicContact CG2-CE2 4.04Å; V132-F241 HydrophobicContact CG2-CZ 3.42Å; V132-F241 VanDerWaalsContact CG2-CZ 3.42Å; V132-I245 HydrophobicContact CB-CD1 4.1Å; V132-I245 HydrophobicContact CG1-CD1 4.4Å; V132-I245 HydrophobicContact CG2-CD1 3.71Å; V132-I245 HydrophobicContact CG2-CG1 4.49Å; V132-M337 CarbonylContact O-C 3.58Å; V132-M337 WeakPolarHBondContact O-CA 3.07Å; V132-I338 HydrophobicContact CB-CB 4.48Å; V132-I338 PolarHBondContact N-O 3Å; V132-I338 PolarHBondContact O-N 3.46Å; V132-M340 HydrophobicContact CB-CE 4.47Å; V132-M340 HydrophobicContact CG2-CE 3.52Å
133	E	98.1	Very high	88.4	Confident	18 Å²	18	42 Å²	42	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	122.1	170.8	-172.5	-163.6	152.8	0	0	108.5	M201 K202 F204 S335 I336 M337	E133-M201 CarbonylContact O-C 3.54Å; E133-M201 VanDerWaalsContact O-CA 3.27Å; E133-M201 WeakPolarHBondContact O-CA 3.41Å; E133-K202 HydrophobicContact CB-CB 4.23Å; E133-K202 PolarHBondContact N-O 2.81Å; E133-K202 PolarHBondContact O-N 3.21Å; E133-F204 HydrophobicContact CB-CE2 4.22Å; E133-S335 PolarHBondContact OE1-OG 3.32Å; E133-I336 CarbonylContact C-O 3.45Å; E133-I336 WeakPolarHBondContact CA-O 3.4Å; E133-M337 HydrophobicContact CB-CG 4.33Å; E133-M337 HydrophobicContact CG-CG 4.16Å
134	I	98.5	Very high	90	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.8	176.1	-61.9	175	0	0	0	109.1	V132 P136 L178 L193 N200 M201 I245 L249 S335 I336	V132-I134 HydrophobicContact CG1-CD1 4.09Å; V132-I134 HydrophobicContact CG1-CG1 3.84Å; I134-P136 VanDerWaalsContact O-CD 3.26Å; I134-P136 WeakPolarHBondContact O-CD 3.07Å; I134-L178 HydrophobicContact CG2-CD2 4.23Å; I134-L193 HydrophobicContact CG2-CD1 4.02Å; I134-N200 CarbonylContact C-O 3.57Å; I134-N200 WeakPolarHBondContact CA-O 3.33Å; I134-M201 HydrophobicContact CD1-CE 4.46Å; I134-M201 HydrophobicContact CG1-CE 4.46Å; I134-I245 HydrophobicContact CD1-CG2 3.75Å; I134-L249 HydrophobicContact CD1-CD1 4.14Å; I134-S335 CarbonylContact O-C 3.22Å; I134-S335 WeakPolarHBondContact O-CA 3.5Å; I134-I336 PolarHBondContact N-O 3.1Å; I134-I336 PolarHBondContact O-N 3.14Å
135	K	98.3	Very high	92	Very high	45 Å²	45	31 Å²	31	20%	0.196	17%	0.166	C	C	.	.			trans	-90.7	102.5	167	-60.8	-162	-179.7	-142.2	0	109.2	K137 A199 N200 S335 D371	K135-K137 VanDerWaalsContact C-N 3.3Å; K135-K137 HydrophobicContact CB-CD 4.34Å; K135-K137 PolarHBondContact O-N 3.07Å; K135-A199 WeakPolarHBondContact CD-O 3.4Å; K135-N200 HydrophobicContact CB-CB 4.42Å; K135-N200 PolarHBondContact N-O 3.2Å; K135-S335 WeakPolarHBondContact CE-OG 3.46Å; K135-S335 WeakPolarHBondContact CG-OG 3.37Å; K135-D371 IonicContact NZ-OD2 3.86Å
136	P	98.2	Very high	93.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.			trans	-75.8	-20.8	-169.3	33	-37.4	0	0	0	112.8	I134 P175 L178 Y179 L270 M273 C334 I336	I134-P136 VanDerWaalsContact O-CD 3.26Å; I134-P136 WeakPolarHBondContact O-CD 3.07Å; P136-P175 WeakPolarHBondContact O-CB 3.45Å; P136-L178 HydrophobicContact CB-CD2 3.68Å; P136-Y179 HydrophobicContact CB-CE2 3.74Å; P136-Y179 WeakPolarHBondContact CB-OH 3.39Å; P136-Y179 WeakPolarHBondContact CG-OH 3.27Å; P136-Y179 WeakPolarHBondContact O-CE2 3.46Å; P136-L270 HydrophobicContact CB-CD2 3.86Å; P136-M273 HydrophobicContact CG-CE 3.79Å; P136-C334 WeakPolarHBondContact CD-O 3.23Å; P136-I336 HydrophobicContact CB-CD1 4.11Å; P136-I336 HydrophobicContact CG-CD1 3.94Å; P136-I336 HydrophobicContact CG-CG1 4.29Å
137	K	98.1	Very high	94.7	Very high	31 Å²	31	37.1 Å²	37.1	14%	0.135	17%	0.173	C	C	.	.			trans	63	-156.9	-178.6	-49.4	-57.5	-174.1	-173.6	0	112.8	K135 N154 F173 P175 Y179 N200 Q277 R332	K135-K137 VanDerWaalsContact C-N 3.3Å; K135-K137 HydrophobicContact CB-CD 4.34Å; K135-K137 PolarHBondContact O-N 3.07Å; K137-N154 HydrophobicContact CB-CB 4.26Å; K137-N154 HydrophobicContact CG-CB 4.37Å; K137-F173 HydrophobicContact CG-CE1 4.45Å; K137-P175 HydrophobicContact CB-CB 4.18Å; K137-P175 HydrophobicContact CB-CG 3.61Å; K137-P175 HydrophobicContact CG-CG 4.24Å; K137-Y179 WeakPolarHBondContact O-CE2 3.32Å; K137-Y179 PolarHBondContact O-OH 2.93Å; K137-N200 WeakPolarHBondContact CE-OD1 3.27Å; K137-Q277 PolarHBondContact O-NE2 2.96Å; K137-R332 VanDerWaalsContact CA-O 3.3Å; K137-R332 WeakPolarHBondContact CA-O 3.34Å; K137-R332 WeakPolarHBondContact CD-O 3.44Å
138	Q	97.5	Very high	95.3	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.028	19%	0.187	C	C	.	.			trans	-85	113.9	-177	-165.1	167.1	-14.4	0	0	110.6	F140 P175 R332 Y383	Q138-F140 VanDerWaalsContact C-N 3.32Å; Q138-F140 HydrophobicContact CG-CD1 3.8Å; Q138-F140 HydrophobicContact CG-CE1 3.83Å; Q138-F140 PolarHBondContact O-N 3.16Å; Q138-P175 WeakPolarHBondContact O-CB 3.33Å; Q138-R332 HydrophobicContact CB-CG 3.74Å; Q138-R332 HydrophobicContact CG-CG 4.07Å; Q138-Y383 PolarHBondContact OE1-OH 3.26Å
139	G	97.5	Very high	95.5	Very high	8 Å²	8	37.3 Å²	37.3	8%	0.082	18%	0.176	C	C	.	.			trans	-83.2	-1.3	-175.9	0	0	0	0	0	115.6	L176 Y179 L274	G139-L176 WeakPolarHBondContact O-CD2 3.14Å; G139-Y179 VanDerWaalsContact CA-CG 3.49Å; G139-L274 WeakPolarHBondContact O-CD1 3.39Å
140	F	95.8	Very high	95.5	Very high	28 Å²	28	39 Å²	39	12%	0.123	19%	0.187	C	C	.	.	S	Bend	trans	-125.2	159.5	175.6	77	-79.2	0	0	0	111.3	Q138 P142 L274 Q277 K278 T328	Q138-F140 VanDerWaalsContact C-N 3.32Å; Q138-F140 HydrophobicContact CG-CD1 3.8Å; Q138-F140 HydrophobicContact CG-CE1 3.83Å; Q138-F140 PolarHBondContact O-N 3.16Å; F140-P142 HydrophobicContact CD2-CG 4.11Å; F140-P142 HydrophobicContact CE2-CB 4.07Å; F140-P142 HydrophobicContact CE2-CG 3.59Å; F140-P142 HydrophobicContact CZ-CG 4.09Å; F140-P142 WeakPolarHBondContact O-CD 3.13Å; F140-L274 HydrophobicContact CB-CD1 3.91Å; F140-Q277 HydrophobicContact CD1-CB 3.99Å; F140-Q277 HydrophobicContact CE1-CB 3.86Å; F140-Q277 WeakPolarHBondContact CE1-O 3.45Å; F140-K278 HydrophobicContact CB-CG 4.1Å; F140-K278 HydrophobicContact CD1-CG 4.18Å; F140-K278 HydrophobicContact CD2-CG 4.46Å; F140-K278 HydrophobicContact CG-CG 4.02Å; F140-T328 HydrophobicContact CE1-CG2 4.31Å
141	F	94.8	Very high	95.6	Very high	28 Å²	28	39.1 Å²	39.1	12%	0.123	19%	0.187	C	C	.	.			trans	-106.1	100	176.9	-161.7	172.5	0	0	0	109.3	L143 L145 R146 S149 Y151 L176 V407	F141-L143 PolarHBondContact O-N 3.4Å; F141-L145 HydrophobicContact CD2-CB 4.33Å; F141-L145 HydrophobicContact CD2-CD2 4.33Å; F141-L145 HydrophobicContact CD2-CG 4.49Å; F141-L145 HydrophobicContact CE2-CB 3.94Å; F141-L145 HydrophobicContact CE2-CD2 3.83Å; F141-L145 HydrophobicContact CE2-CG 3.76Å; F141-R146 HydrophobicContact CD1-CB 4.12Å; F141-R146 HydrophobicContact CD1-CG 4Å; F141-R146 HydrophobicContact CD2-CB 3.88Å; F141-R146 HydrophobicContact CE1-CB 4.12Å; F141-R146 HydrophobicContact CE1-CG 3.95Å; F141-R146 HydrophobicContact CE2-CB 3.88Å; F141-R146 HydrophobicContact CG-CB 4.02Å; F141-R146 HydrophobicContact CG-CG 4.36Å; F141-R146 HydrophobicContact CZ-CB 4.02Å; F141-R146 HydrophobicContact CZ-CG 4.28Å; F141-S149 WeakPolarHBondContact CZ-O 3.47Å; F141-Y151 WeakPolarHBondContact CE2-O 3.37Å; F141-Y151 WeakPolarHBondContact CZ-O 3.3Å; F141-L176 HydrophobicContact CB-CD1 4.22Å; F141-L176 HydrophobicContact CB-CD2 4.38Å; F141-L176 HydrophobicContact CD1-CD1 4.27Å; F141-V407 HydrophobicContact CD1-CG2 3.81Å; F141-V407 HydrophobicContact CE1-CG2 4.27Å
142	P	94.1	Very high	95.5	Very high	7 Å²	7	39.2 Å²	39.2	5%	0.045	19%	0.188	C	C	.	.			trans	-53.8	136	179.8	-24.3	31.4	0	0	0	111.4	F140 S144 L145 R146	F140-P142 HydrophobicContact CD2-CG 4.11Å; F140-P142 HydrophobicContact CE2-CB 4.07Å; F140-P142 HydrophobicContact CE2-CG 3.59Å; F140-P142 HydrophobicContact CZ-CG 4.09Å; F140-P142 WeakPolarHBondContact O-CD 3.13Å; P142-S144 PolarHBondContact O-N 3.03Å; P142-L145 HydrophobicContact CB-CB 4.5Å; P142-L145 PolarHBondContact O-N 3.38Å; P142-R146 PolarHBondContact O-N 3.21Å
143	L	92.5	Very high	95.5	Very high	118 Å²	118	39.3 Å²	39.3	62%	0.618	19%	0.189	S	C	*	.	H	α-helix	trans	-56.3	-38.6	-179.6	-71.3	176	0	0	0	112.2	F141 L145 R146 R147	F141-L143 PolarHBondContact O-N 3.4Å; L143-L145 VanDerWaalsContact C-N 3.28Å; L143-L145 PolarHBondContact O-N 2.73Å; L143-R146 PolarHBondContact O-N 2.79Å; L143-R147 VanDerWaalsContact O-CG 3.29Å; L143-R147 WeakPolarHBondContact O-CG 3.5Å; L143-R147 PolarHBondContact O-N 2.84Å
144	S	93.4	Very high	95.4	Very high	43 Å²	43	39 Å²	39	30%	0.301	19%	0.187	S	C	.	.	H	α-helix	trans	-59.7	-36.7	177.2	51.2	0	0	0	0	112.9	P142	P142-S144 PolarHBondContact O-N 3.03Å
145	L	94.5	Very high	95.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-82.2	-40.3	175.3	-171.3	67.8	0	0	0	112	F141 P142 L143 R147 V148 S149 S153 L156 F285 L391	F141-L145 HydrophobicContact CD2-CB 4.33Å; F141-L145 HydrophobicContact CD2-CD2 4.33Å; F141-L145 HydrophobicContact CD2-CG 4.49Å; F141-L145 HydrophobicContact CE2-CB 3.94Å; F141-L145 HydrophobicContact CE2-CD2 3.83Å; F141-L145 HydrophobicContact CE2-CG 3.76Å; P142-L145 HydrophobicContact CB-CB 4.5Å; P142-L145 PolarHBondContact O-N 3.38Å; L143-L145 VanDerWaalsContact C-N 3.28Å; L143-L145 PolarHBondContact O-N 2.73Å; L145-R147 PolarHBondContact O-N 2.82Å; L145-V148 HydrophobicContact CD1-CG2 4.31Å; L145-V148 CarbonylContact O-C 3.56Å; L145-V148 WeakPolarHBondContact O-CG2 3.48Å; L145-V148 PolarHBondContact O-N 2.72Å; L145-S149 WeakPolarHBondContact O-CB 3.5Å; L145-S149 PolarHBondContact O-N 2.84Å; L145-S153 WeakPolarHBondContact CD2-OG 3.47Å; L145-L156 HydrophobicContact CD1-CD1 3.92Å; L145-L156 HydrophobicContact CD2-CD1 4.15Å; L145-L156 HydrophobicContact CG-CD1 4.37Å; L145-F285 HydrophobicContact CB-CE2 4.36Å; L145-F285 HydrophobicContact CD1-CE2 3.84Å; L145-F285 HydrophobicContact CD1-CZ 3.71Å; L145-L391 HydrophobicContact CD1-CD1 4.15Å; L145-L391 HydrophobicContact CD1-CD2 4.16Å; L145-L391 HydrophobicContact CD1-CG 4.47Å
146	R	93.4	Very high	95.1	Very high	137 Å²	137	36.8 Å²	36.8	52%	0.517	18%	0.178	S	C	.	.	H	α-helix	trans	-60.4	-30.7	179.7	-173.8	178.7	175.5	-170.2	-1	112.7	F141 P142 L143 V148	F141-R146 HydrophobicContact CD1-CB 4.12Å; F141-R146 HydrophobicContact CD1-CG 4Å; F141-R146 HydrophobicContact CD2-CB 3.88Å; F141-R146 HydrophobicContact CE1-CB 4.12Å; F141-R146 HydrophobicContact CE1-CG 3.95Å; F141-R146 HydrophobicContact CE2-CB 3.88Å; F141-R146 HydrophobicContact CG-CB 4.02Å; F141-R146 HydrophobicContact CG-CG 4.36Å; F141-R146 HydrophobicContact CZ-CB 4.02Å; F141-R146 HydrophobicContact CZ-CG 4.28Å; P142-R146 PolarHBondContact O-N 3.21Å; L143-R146 PolarHBondContact O-N 2.79Å; R146-V148 VanDerWaalsContact C-N 3.27Å; R146-V148 PolarHBondContact O-N 3.45Å
147	R	92.8	Very high	95	Very high	211 Å²	211	38 Å²	38	80%	0.796	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.2	175.6	-77	175	-178.8	177.2	1	113.8	L143 L145	L143-R147 VanDerWaalsContact O-CG 3.29Å; L143-R147 WeakPolarHBondContact O-CG 3.5Å; L143-R147 PolarHBondContact O-N 2.84Å; L145-R147 PolarHBondContact O-N 2.82Å
148	V	92.8	Very high	94.8	Very high	81 Å²	81	36.7 Å²	36.7	49%	0.491	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-0.7	-174.2	-58.5	0	0	0	0	112.8	L145 R146 L391	L145-V148 HydrophobicContact CD1-CG2 4.31Å; L145-V148 CarbonylContact O-C 3.56Å; L145-V148 WeakPolarHBondContact O-CG2 3.48Å; L145-V148 PolarHBondContact O-N 2.72Å; R146-V148 VanDerWaalsContact C-N 3.27Å; R146-V148 PolarHBondContact O-N 3.45Å; V148-L391 HydrophobicContact CG2-CD1 3.79Å; V148-L391 HydrophobicContact CG2-CD2 4.16Å
149	S	93.3	Very high	94.5	Very high	8 Å²	8	36.4 Å²	36.4	6%	0.056	18%	0.177	C	C	.	.			trans	-151.6	141.2	-177.9	-163.6	0	0	0	0	112.8	F141 L145 Y151	F141-S149 WeakPolarHBondContact CZ-O 3.47Å; L145-S149 WeakPolarHBondContact O-CB 3.5Å; L145-S149 PolarHBondContact O-N 2.84Å; S149-Y151 VanDerWaalsContact C-N 3.26Å; S149-Y151 PolarHBondContact OG-N 2.95Å; S149-Y151 VanDerWaalsContact OG-N 3.16Å; S149-Y151 PolarHBondContact OG-O 3.48Å
150	P	92.9	Very high	94.3	Very high	49 Å²	49	37.4 Å²	37.4	32%	0.318	18%	0.182	S	C	.	.	S	Bend	trans	-80.8	-3.8	166.1	32.6	-32.4	0	0	0	113.2	P405 C406	P150-P405 HydrophobicContact CB-CB 3.95Å; P150-P405 HydrophobicContact CB-CG 4.19Å; P150-C406 PolarHBondContact O-N 3.35Å
151	Y	95	Very high	94.1	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.008	19%	0.192	C	C	.	.	S	Bend	trans	-115.7	139.5	-175.8	-54.2	-74.9	0	0	0	112	F141 S149 L156 M159 V394 K400 R403 P404	F141-Y151 WeakPolarHBondContact CE2-O 3.37Å; F141-Y151 WeakPolarHBondContact CZ-O 3.3Å; S149-Y151 VanDerWaalsContact C-N 3.26Å; S149-Y151 PolarHBondContact OG-N 2.95Å; S149-Y151 VanDerWaalsContact OG-N 3.16Å; S149-Y151 PolarHBondContact OG-O 3.48Å; Y151-L156 HydrophobicContact CD2-CD2 4.15Å; Y151-L156 HydrophobicContact CG-CD2 4.46Å; Y151-M159 HydrophobicContact CD1-CE 4.42Å; Y151-M159 HydrophobicContact CD1-SD 4.27Å; Y151-M159 HydrophobicContact CD2-CE 4.22Å; Y151-M159 HydrophobicContact CD2-SD 4.32Å; Y151-M159 HydrophobicContact CE1-CE 4.13Å; Y151-M159 HydrophobicContact CE2-CE 3.92Å; Y151-M159 HydrophobicContact CG-CE 4.47Å; Y151-M159 HydrophobicContact CG-SD 4.16Å; Y151-V394 HydrophobicContact CD2-CG1 3.92Å; Y151-V394 HydrophobicContact CE2-CG1 3.71Å; Y151-K400 WeakPolarHBondContact OH-CA 3.26Å; Y151-R403 HydrophobicContact CD1-CG 4.49Å; Y151-R403 HydrophobicContact CE1-CB 4.36Å; Y151-R403 HydrophobicContact CE1-CG 4.14Å; Y151-R403 WeakPolarHBondContact CE1-O 3.22Å; Y151-R403 PolarHBondContact OH-O 3.33Å; Y151-R403 VanDerWaalsContact OH-O 3.04Å; Y151-P404 WeakPolarHBondContact CE1-O 3.32Å
152	C	96.5	Very high	93.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	19%	0.192	C	C	.	.			trans	-68.8	165.6	174.2	80	0	0	0	0	111.5	N154 C155 L156 L176 C406	C152-N154 VanDerWaalsContact C-N 3.3Å; C152-N154 PolarHBondContact O-N 3.39Å; C152-C155 PolarHBondContact O-N 2.91Å; C152-C155 VanDerWaalsContact O-N 3.1Å; C152-C155 PolarHBondContact SG-SG 2.83Å; C152-L156 PolarHBondContact O-N 3.34Å; C152-L176 HydrophobicContact CB-CD1 4.2Å; C152-L176 HydrophobicContact CB-CG 4.27Å; C152-C406 HydrophobicContact CB-CB 4.44Å; C152-C406 PolarHBondContact N-SG 3.5Å; C152-C406 VanDerWaalsContact N-SG 3.35Å
153	S	96.5	Very high	93.6	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-53.1	-42.4	-178.2	-51.7	0	0	0	0	114.1	L145 L157 Y383	L145-S153 WeakPolarHBondContact CD2-OG 3.47Å; S153-L157 WeakPolarHBondContact O-CB 3.17Å; S153-L157 VanDerWaalsContact O-CG 3.24Å; S153-L157 WeakPolarHBondContact O-CG 3.47Å; S153-L157 PolarHBondContact O-N 2.82Å; S153-L157 VanDerWaalsContact O-N 3.14Å; S153-Y383 WeakPolarHBondContact CB-OH 3.33Å; S153-Y383 PolarHBondContact OG-OH 3.27Å; S153-Y383 VanDerWaalsContact OG-OH 3.14Å
154	N	97	Very high	93.5	Very high	11 Å²	11	45.3 Å²	45.3	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-49.6	178.9	176.7	71.8	0	0	0	110.6	K137 C152 L156 L157 Q158 Y171 P175	K137-N154 HydrophobicContact CB-CB 4.26Å; K137-N154 HydrophobicContact CG-CB 4.37Å; C152-N154 VanDerWaalsContact C-N 3.3Å; C152-N154 PolarHBondContact O-N 3.39Å; N154-L156 VanDerWaalsContact C-N 3.35Å; N154-L156 PolarHBondContact O-N 2.82Å; N154-L157 PolarHBondContact O-N 3.11Å; N154-Q158 WeakPolarHBondContact O-CB 3.4Å; N154-Q158 WeakPolarHBondContact O-CG 3.2Å; N154-Q158 PolarHBondContact O-N 2.92Å; N154-Y171 PolarHBondContact ND2-OH 3.26Å; N154-Y171 PolarHBondContact OD1-OH 2.88Å; N154-P175 HydrophobicContact CB-CG 3.58Å
155	C	95.6	Very high	93.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-44.7	-177.4	-62	0	0	0	0	111.5	C152 L157 Q158 M159 R403 C406	C152-C155 PolarHBondContact O-N 2.91Å; C152-C155 VanDerWaalsContact O-N 3.1Å; C152-C155 PolarHBondContact SG-SG 2.83Å; C155-L157 PolarHBondContact O-N 2.82Å; C155-Q158 PolarHBondContact O-N 3.39Å; C155-M159 WeakPolarHBondContact O-CG 3.44Å; C155-M159 PolarHBondContact O-N 2.79Å; C155-R403 VanDerWaalsContact SG-CZ 3.52Å; C155-R403 PolarHBondContact SG-NE 2.85Å; C155-R403 PolarHBondContact SG-NH2 3.19Å; C155-C406 PolarHBondContact SG-SG 3.46Å
156	L	94.9	Very high	93	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-53.5	-53.9	173.5	-75.9	177.4	0	0	0	112.1	L145 Y151 C152 N154 Q158 M159 V160 L387 A390 L391 V394	L145-L156 HydrophobicContact CD1-CD1 3.92Å; L145-L156 HydrophobicContact CD2-CD1 4.15Å; L145-L156 HydrophobicContact CG-CD1 4.37Å; Y151-L156 HydrophobicContact CD2-CD2 4.15Å; Y151-L156 HydrophobicContact CG-CD2 4.46Å; C152-L156 PolarHBondContact O-N 3.34Å; N154-L156 VanDerWaalsContact C-N 3.35Å; N154-L156 PolarHBondContact O-N 2.82Å; L156-Q158 VanDerWaalsContact C-N 3.28Å; L156-Q158 PolarHBondContact O-N 3.43Å; L156-M159 PolarHBondContact O-N 2.87Å; L156-V160 PolarHBondContact O-N 2.59Å; L156-L387 HydrophobicContact CB-CD2 4.49Å; L156-L387 HydrophobicContact CD1-CD2 4.39Å; L156-A390 HydrophobicContact CB-CB 3.98Å; L156-L391 HydrophobicContact CD1-CD2 3.86Å; L156-L391 HydrophobicContact CD1-CG 4.38Å; L156-V394 HydrophobicContact CD2-CB 4.3Å; L156-V394 HydrophobicContact CD2-CG2 3.71Å
157	L	95.6	Very high	92.7	Very high	25 Å²	25	45.1 Å²	45.1	13%	0.131	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-30.8	-177	-66.8	174.9	0	0	0	112.8	S153 N154 C155 K161 Y383 R386 L387	S153-L157 WeakPolarHBondContact O-CB 3.17Å; S153-L157 VanDerWaalsContact O-CG 3.24Å; S153-L157 WeakPolarHBondContact O-CG 3.47Å; S153-L157 PolarHBondContact O-N 2.82Å; S153-L157 VanDerWaalsContact O-N 3.14Å; N154-L157 PolarHBondContact O-N 3.11Å; C155-L157 PolarHBondContact O-N 2.82Å; L157-K161 WeakPolarHBondContact O-CG 3.41Å; L157-K161 PolarHBondContact O-N 2.88Å; L157-Y383 HydrophobicContact CD1-CD2 4.27Å; L157-Y383 HydrophobicContact CD1-CE2 3.74Å; L157-R386 HydrophobicContact CD2-CB 3.79Å; L157-L387 HydrophobicContact CD1-CD2 4.17Å; L157-L387 HydrophobicContact CD2-CD2 4.05Å; L157-L387 HydrophobicContact CG-CD2 3.87Å
158	Q	94.3	Very high	92.3	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-74.2	-35	177.3	-65.8	-74.5	-27.7	0	0	111.4	N154 C155 L156 V160 K161 S162 M170 Y171 H198	N154-Q158 WeakPolarHBondContact O-CB 3.4Å; N154-Q158 WeakPolarHBondContact O-CG 3.2Å; N154-Q158 PolarHBondContact O-N 2.92Å; C155-Q158 PolarHBondContact O-N 3.39Å; L156-Q158 VanDerWaalsContact C-N 3.28Å; L156-Q158 PolarHBondContact O-N 3.43Å; Q158-V160 VanDerWaalsContact C-N 3.32Å; Q158-V160 PolarHBondContact O-N 3.35Å; Q158-K161 WeakPolarHBondContact O-CB 3.44Å; Q158-K161 PolarHBondContact O-N 3.05Å; Q158-K161 VanDerWaalsContact O-N 3.17Å; Q158-S162 PolarHBondContact O-N 3.36Å; Q158-S162 PolarHBondContact O-OG 2.97Å; Q158-M170 HydrophobicContact CB-CE 3.61Å; Q158-M170 HydrophobicContact CB-SD 3.71Å; Q158-Y171 HydrophobicContact CB-CE1 4.04Å; Q158-Y171 VanDerWaalsContact CD-OH 3.25Å; Q158-Y171 HydrophobicContact CG-CE1 3.78Å; Q158-Y171 VanDerWaalsContact CG-OH 3.26Å; Q158-Y171 WeakPolarHBondContact CG-OH 3.22Å; Q158-Y171 PolarHBondContact NE2-OH 2.85Å; Q158-H198 PolarHBondContact OE1-ND1 3.35Å
159	M	92.1	Very high	92.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-40	173.9	-66.5	156.8	91.3	0	0	111.4	Y151 C155 L156 S162 R163 M170 V394 W399 R403	Y151-M159 HydrophobicContact CD1-CE 4.42Å; Y151-M159 HydrophobicContact CD1-SD 4.27Å; Y151-M159 HydrophobicContact CD2-CE 4.22Å; Y151-M159 HydrophobicContact CD2-SD 4.32Å; Y151-M159 HydrophobicContact CE1-CE 4.13Å; Y151-M159 HydrophobicContact CE2-CE 3.92Å; Y151-M159 HydrophobicContact CG-CE 4.47Å; Y151-M159 HydrophobicContact CG-SD 4.16Å; C155-M159 WeakPolarHBondContact O-CG 3.44Å; C155-M159 PolarHBondContact O-N 2.79Å; L156-M159 PolarHBondContact O-N 2.87Å; M159-S162 PolarHBondContact O-N 3.49Å; M159-R163 WeakPolarHBondContact O-CB 3.03Å; M159-R163 PolarHBondContact O-N 3.43Å; M159-M170 HydrophobicContact CG-CE 4.11Å; M159-M170 HydrophobicContact CG-SD 4.19Å; M159-V394 HydrophobicContact CE-CG2 4.27Å; M159-W399 HydrophobicContact CB-CD2 4.25Å; M159-W399 HydrophobicContact CB-CE3 4.16Å; M159-W399 HydrophobicContact CB-CH2 4.04Å; M159-W399 HydrophobicContact CB-CZ2 4.11Å; M159-W399 HydrophobicContact CB-CZ3 4.06Å; M159-W399 HydrophobicContact CE-CB 3.32Å; M159-W399 HydrophobicContact CE-CD2 3.48Å; M159-W399 VanDerWaalsContact CE-CD2 3.48Å; M159-W399 HydrophobicContact CE-CE3 3.5Å; M159-W399 VanDerWaalsContact CE-CE3 3.5Å; M159-W399 HydrophobicContact CE-CG 3.41Å; M159-W399 VanDerWaalsContact CE-CG 3.41Å; M159-W399 HydrophobicContact CE-CZ3 4.47Å; M159-W399 HydrophobicContact CG-CD2 4.39Å; M159-W399 HydrophobicContact CG-CE3 3.98Å; M159-W399 HydrophobicContact CG-CZ3 4.07Å; M159-W399 WeakPolarHBondContact O-CH2 3.38Å; M159-W399 WeakPolarHBondContact O-CZ2 3.48Å; M159-R403 HydrophobicContact CE-CB 4.32Å
160	V	92.5	Very high	91.9	Very high	29 Å²	29	44.9 Å²	44.9	18%	0.176	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-47	171.8	-179.2	0	0	0	0	111.1	L156 Q158 R163 N164 A390 L393	L156-V160 PolarHBondContact O-N 2.59Å; Q158-V160 VanDerWaalsContact C-N 3.32Å; Q158-V160 PolarHBondContact O-N 3.35Å; V160-R163 WeakPolarHBondContact O-CB 3.35Å; V160-R163 PolarHBondContact O-N 3.11Å; V160-N164 WeakPolarHBondContact O-CB 3.39Å; V160-N164 VanDerWaalsContact O-CG 3.24Å; V160-N164 PolarHBondContact O-N 2.79Å; V160-N164 PolarHBondContact O-OD1 3.37Å; V160-A390 HydrophobicContact CG2-CB 3.48Å; V160-A390 VanDerWaalsContact CG2-CB 3.48Å; V160-L393 HydrophobicContact CB-CD1 4.48Å; V160-L393 HydrophobicContact CG1-CD1 4.37Å; V160-L393 HydrophobicContact CG2-CD1 4.05Å; V160-L393 HydrophobicContact CG2-CD2 4.43Å
161	K	92.6	Very high	91.9	Very high	76 Å²	76	42.6 Å²	42.6	33%	0.33	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-44.9	178.9	-74.8	-179.5	179.2	-171.9	0	112.8	L157 Q158 N164 G165 T166 Y167	L157-K161 WeakPolarHBondContact O-CG 3.41Å; L157-K161 PolarHBondContact O-N 2.88Å; Q158-K161 WeakPolarHBondContact O-CB 3.44Å; Q158-K161 PolarHBondContact O-N 3.05Å; Q158-K161 VanDerWaalsContact O-N 3.17Å; K161-N164 PolarHBondContact O-N 3.06Å; K161-G165 PolarHBondContact O-N 2.58Å; K161-T166 HydrophobicContact CB-CG2 4.3Å; K161-T166 HydrophobicContact CD-CG2 4.49Å; K161-T166 HydrophobicContact CG-CG2 4.45Å; K161-T166 VanDerWaalsContact O-CB 3.23Å; K161-T166 WeakPolarHBondContact O-CB 3.47Å; K161-T166 PolarHBondContact O-N 3.16Å; K161-T166 PolarHBondContact O-OG1 3.16Å; K161-Y167 HydrophobicContact CB-CD2 3.87Å; K161-Y167 HydrophobicContact CB-CE2 3.8Å; K161-Y167 HydrophobicContact CD-CE2 3.64Å; K161-Y167 HydrophobicContact CG-CE2 4.37Å
162	S	89.8	Confident	91.8	Very high	20 Å²	20	46.3 Å²	46.3	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-38.6	176.1	-61.4	0	0	0	0	111.7	Q158 M159 N164 G165 S169	Q158-S162 PolarHBondContact O-N 3.36Å; Q158-S162 PolarHBondContact O-OG 2.97Å; M159-S162 PolarHBondContact O-N 3.49Å; S162-N164 VanDerWaalsContact C-N 3.32Å; S162-N164 PolarHBondContact O-N 2.93Å; S162-G165 PolarHBondContact O-N 3.19Å; S162-S169 PolarHBondContact OG-O 3.33Å
163	R	86.9	Confident	91.9	Very high	139 Å²	139	46.2 Å²	46.2	53%	0.525	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-43.5	173.2	-172	-170.4	170.8	177.4	-5.2	111.7	M159 V160 G165 L393 W399	M159-R163 WeakPolarHBondContact O-CB 3.03Å; M159-R163 PolarHBondContact O-N 3.43Å; V160-R163 WeakPolarHBondContact O-CB 3.35Å; V160-R163 PolarHBondContact O-N 3.11Å; R163-G165 PolarHBondContact O-N 2.85Å; R163-L393 VanDerWaalsContact NH1-CG 3.29Å; R163-W399 HydrophobicContact CB-CZ2 4.08Å
164	N	90.2	Very high	91.9	Very high	111 Å²	111	46.2 Å²	46.2	59%	0.594	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	9.2	-177.4	-65.4	-1.6	0	0	0	112.8	V160 K161 S162 T166	V160-N164 WeakPolarHBondContact O-CB 3.39Å; V160-N164 VanDerWaalsContact O-CG 3.24Å; V160-N164 PolarHBondContact O-N 2.79Å; V160-N164 PolarHBondContact O-OD1 3.37Å; K161-N164 PolarHBondContact O-N 3.06Å; S162-N164 VanDerWaalsContact C-N 3.32Å; S162-N164 PolarHBondContact O-N 2.93Å; N164-T166 PolarHBondContact O-N 3.11Å
165	G	88.5	Confident	92	Very high	61 Å²	61	45.7 Å²	45.7	63%	0.629	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	13.5	179.4	0	0	0	0	0	114.4	K161 S162 R163 Y167	K161-G165 PolarHBondContact O-N 2.58Å; S162-G165 PolarHBondContact O-N 3.19Å; R163-G165 PolarHBondContact O-N 2.85Å; G165-Y167 PolarHBondContact O-N 3Å
166	T	88.9	Confident	92.1	Very high	83 Å²	83	46.5 Å²	46.5	51%	0.509	25%	0.25	S	C	.	.	S	Bend	trans	-64.6	-30.2	173.5	-53.5	0	0	0	0	111.4	K161 N164	K161-T166 HydrophobicContact CB-CG2 4.3Å; K161-T166 HydrophobicContact CD-CG2 4.49Å; K161-T166 HydrophobicContact CG-CG2 4.45Å; K161-T166 VanDerWaalsContact O-CB 3.23Å; K161-T166 WeakPolarHBondContact O-CB 3.47Å; K161-T166 PolarHBondContact O-N 3.16Å; K161-T166 PolarHBondContact O-OG1 3.16Å; N164-T166 PolarHBondContact O-N 3.11Å
167	Y	87.2	Confident	92.3	Very high	33 Å²	33	47.8 Å²	47.8	13%	0.129	26%	0.256	C	S	.	.	S	Bend	trans	-133.9	141.6	175.8	-54.7	-58.5	0	0	0	109.4	K161 G165 S169 H198 A199	K161-Y167 HydrophobicContact CB-CD2 3.87Å; K161-Y167 HydrophobicContact CB-CE2 3.8Å; K161-Y167 HydrophobicContact CD-CE2 3.64Å; K161-Y167 HydrophobicContact CG-CE2 4.37Å; G165-Y167 PolarHBondContact O-N 3Å; Y167-S169 PolarHBondContact O-N 3.41Å; Y167-H198 HydrophobicContact CD1-CB 4.26Å; Y167-H198 AromaticContact CD1-CD2 3.61Å; Y167-H198 AromaticContact CD1-CG 3.85Å; Y167-H198 AromaticContact CD2-CD2 3.95Å; Y167-H198 AromaticContact CD2-CE1 3.42Å; Y167-H198 VanDerWaalsContact CD2-CE1 3.42Å; Y167-H198 WeakPolarHBondContact CD2-CE1 3.02Å; Y167-H198 AromaticContact CD2-CG 3.76Å; Y167-H198 AromaticContact CD2-ND1 3.4Å; Y167-H198 WeakPolarHBondContact CD2-ND1 3.3Å; Y167-H198 AromaticContact CD2-NE2 3.78Å; Y167-H198 HydrophobicContact CE1-CB 3.77Å; Y167-H198 AromaticContact CE1-CG 3.85Å; Y167-H198 HydrophobicContact CE2-CB 4.04Å; Y167-H198 AromaticContact CE2-CG 3.74Å; Y167-H198 AromaticContact CE2-ND1 3.48Å; Y167-H198 WeakPolarHBondContact CE2-ND1 3.4Å; Y167-H198 AromaticContact CG-CD2 3.57Å; Y167-H198 AromaticContact CG-CE1 3.67Å; Y167-H198 AromaticContact CG-CG 3.82Å; Y167-H198 AromaticContact CG-ND1 3.85Å; Y167-H198 AromaticContact CG-NE2 3.51Å; Y167-H198 AromaticContact CZ-CG 3.8Å; Y167-A199 PolarHBondContact OH-N 3.12Å
168	E	85.9	Confident	92.4	Very high	206 Å²	206	46.8 Å²	46.8	96%	0.963	25%	0.251	S	S	*	.	S	Bend	trans	-61.2	-32.5	179.6	-64.2	177.2	178.2	0	0	112.8
169	S	87.5	Confident	92.6	Very high	57 Å²	57	46.8 Å²	46.8	40%	0.399	25%	0.251	S	S	.	.	S	Bend	trans	-143.2	164.3	179.3	57.1	0	0	0	0	111.5	S162 Y167 H198	S162-S169 PolarHBondContact OG-O 3.33Å; Y167-S169 PolarHBondContact O-N 3.41Å; S169-H198 PolarHBondContact O-NE2 3.44Å
170	M	89.9	Confident	92.8	Very high	32 Å²	32	48.3 Å²	48.3	16%	0.158	26%	0.261	C	S	.	.			trans	-85.2	138.1	168.9	-178.1	58.6	-171.4	0	0	108.7	Q158 M159	Q158-M170 HydrophobicContact CB-CE 3.61Å; Q158-M170 HydrophobicContact CB-SD 3.71Å; M159-M170 HydrophobicContact CG-CE 4.11Å; M159-M170 HydrophobicContact CG-SD 4.19Å
171	Y	91.8	Very high	93	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.273	C	S	.	.			trans	-86.3	170.6	175	64.1	8.8	0	0	0	113.1	N154 Q158 F173 L193 I196 H198 N200 R403	N154-Y171 PolarHBondContact ND2-OH 3.26Å; N154-Y171 PolarHBondContact OD1-OH 2.88Å; Q158-Y171 HydrophobicContact CB-CE1 4.04Å; Q158-Y171 VanDerWaalsContact CD-OH 3.25Å; Q158-Y171 HydrophobicContact CG-CE1 3.78Å; Q158-Y171 VanDerWaalsContact CG-OH 3.26Å; Q158-Y171 WeakPolarHBondContact CG-OH 3.22Å; Q158-Y171 PolarHBondContact NE2-OH 2.85Å; Y171-F173 HydrophobicContact CD1-CB 4.13Å; Y171-F173 HydrophobicContact CD2-CB 3.9Å; Y171-F173 HydrophobicContact CE1-CB 4.1Å; Y171-F173 HydrophobicContact CE1-CD1 4.26Å; Y171-F173 HydrophobicContact CE2-CB 3.9Å; Y171-F173 AromaticContact CE2-CD1 3.95Å; Y171-F173 HydrophobicContact CE2-CD1 3.95Å; Y171-F173 HydrophobicContact CE2-CG 4.32Å; Y171-F173 HydrophobicContact CG-CB 4.02Å; Y171-F173 AromaticContact CZ-CD1 3.65Å; Y171-F173 WeakPolarHBondContact OH-CD1 3.5Å; Y171-L193 HydrophobicContact CE2-CD2 4.24Å; Y171-I196 WeakPolarHBondContact CD2-O 3.39Å; Y171-H198 HydrophobicContact CD2-CB 4.15Å; Y171-H198 AromaticContact CD2-CE1 3.8Å; Y171-H198 AromaticContact CD2-CG 3.65Å; Y171-H198 AromaticContact CD2-ND1 3.4Å; Y171-H198 WeakPolarHBondContact CD2-ND1 3.47Å; Y171-H198 HydrophobicContact CE2-CB 3.93Å; Y171-H198 AromaticContact CE2-CG 3.79Å; Y171-H198 AromaticContact CE2-ND1 3.46Å; Y171-H198 WeakPolarHBondContact CE2-ND1 3.4Å; Y171-H198 AromaticContact CG-CE1 3.73Å; Y171-H198 AromaticContact CG-ND1 3.78Å; Y171-H198 AromaticContact CZ-ND1 3.89Å; Y171-N200 PolarHBondContact OH-ND2 2.84Å; Y171-R403 PolarHBondContact O-NH1 2.96Å
172	D	94.3	Very high	93.2	Very high	79 Å²	79	50.7 Å²	50.7	42%	0.422	28%	0.276	S	S	.	.			trans	-90.3	-13.9	175	-69.1	-40.2	0	0	0	113.4	C174 S192 R403	D172-C174 PolarHBondContact O-N 2.93Å; D172-S192 WeakPolarHBondContact CB-OG 3.35Å; D172-R403 PolarHBondContact O-NH1 3.03Å; D172-R403 VanDerWaalsContact O-NH1 3.16Å; D172-R403 PolarHBondContact O-NH2 3.46Å
173	F	97.2	Very high	93.6	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.			trans	-53.3	121.7	-176.5	171.8	-103.8	0	0	0	113	K137 Y171 P175 L178 A189 L193 R403	K137-F173 HydrophobicContact CG-CE1 4.45Å; Y171-F173 HydrophobicContact CD1-CB 4.13Å; Y171-F173 HydrophobicContact CD2-CB 3.9Å; Y171-F173 HydrophobicContact CE1-CB 4.1Å; Y171-F173 HydrophobicContact CE1-CD1 4.26Å; Y171-F173 HydrophobicContact CE2-CB 3.9Å; Y171-F173 AromaticContact CE2-CD1 3.95Å; Y171-F173 HydrophobicContact CE2-CD1 3.95Å; Y171-F173 HydrophobicContact CE2-CG 4.32Å; Y171-F173 HydrophobicContact CG-CB 4.02Å; Y171-F173 AromaticContact CZ-CD1 3.65Å; Y171-F173 WeakPolarHBondContact OH-CD1 3.5Å; F173-P175 HydrophobicContact CE1-CG 3.81Å; F173-P175 HydrophobicContact CZ-CG 4.11Å; F173-L178 HydrophobicContact CE2-CB 4.05Å; F173-L178 HydrophobicContact CE2-CD1 4.45Å; F173-L178 HydrophobicContact CE2-CD2 3.97Å; F173-L178 HydrophobicContact CE2-CG 4.39Å; F173-L178 HydrophobicContact CZ-CD2 4.04Å; F173-A189 HydrophobicContact CD2-CB 3.99Å; F173-A189 WeakPolarHBondContact CD2-O 3.32Å; F173-A189 HydrophobicContact CE2-CB 4.23Å; F173-L193 HydrophobicContact CB-CD2 3.93Å; F173-L193 HydrophobicContact CB-CG 4.09Å; F173-L193 HydrophobicContact CD1-CD2 3.98Å; F173-L193 HydrophobicContact CD2-CD1 3.63Å; F173-L193 HydrophobicContact CD2-CD2 3.85Å; F173-L193 HydrophobicContact CD2-CG 3.49Å; F173-L193 VanDerWaalsContact CD2-CG 3.49Å; F173-L193 HydrophobicContact CE1-CD2 4.46Å; F173-L193 HydrophobicContact CE2-CD1 3.6Å; F173-L193 HydrophobicContact CE2-CD2 4.35Å; F173-L193 HydrophobicContact CE2-CG 4.01Å; F173-L193 HydrophobicContact CG-CD1 4.29Å; F173-L193 HydrophobicContact CG-CD2 3.63Å; F173-L193 HydrophobicContact CG-CG 3.78Å; F173-L193 HydrophobicContact CZ-CD1 4.23Å; F173-R403 PolarHBondContact O-NH2 3.25Å
174	C	97.9	Very high	94.1	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.02	29%	0.294	C	S	.	.			trans	-119.9	124.1	171.1	-167.7	0	0	0	0	109.9	D172 L176 D177 L178	D172-C174 PolarHBondContact O-N 2.93Å; C174-L176 PolarHBondContact O-N 3.08Å; C174-D177 HydrophobicContact CB-CB 4.4Å; C174-D177 WeakPolarHBondContact CB-OD2 3.33Å; C174-D177 WeakPolarHBondContact O-CB 3.27Å; C174-D177 PolarHBondContact O-N 3.24Å; C174-L178 PolarHBondContact O-N 3.4Å
175	P	98.3	Very high	94.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.8	-33.1	172.7	-30.5	38.9	0	0	0	113.4	P136 K137 Q138 N154 F173 D177 L178 Y179	P136-P175 WeakPolarHBondContact O-CB 3.45Å; K137-P175 HydrophobicContact CB-CB 4.18Å; K137-P175 HydrophobicContact CB-CG 3.61Å; K137-P175 HydrophobicContact CG-CG 4.24Å; Q138-P175 WeakPolarHBondContact O-CB 3.33Å; N154-P175 HydrophobicContact CB-CG 3.58Å; F173-P175 HydrophobicContact CE1-CG 3.81Å; F173-P175 HydrophobicContact CZ-CG 4.11Å; P175-D177 PolarHBondContact O-N 3.46Å; P175-L178 PolarHBondContact O-N 3.24Å; P175-L178 VanDerWaalsContact O-N 3.17Å; P175-Y179 VanDerWaalsContact O-CD2 3.3Å; P175-Y179 WeakPolarHBondContact O-CD2 3.3Å; P175-Y179 PolarHBondContact O-N 2.92Å
176	L	98.2	Very high	94.9	Very high	18 Å²	18	51.1 Å²	51.1	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-31	178.9	-54.6	-173.9	0	0	0	112.2	G139 F141 C152 C174 S180 R185 C406 V407	G139-L176 WeakPolarHBondContact O-CD2 3.14Å; F141-L176 HydrophobicContact CB-CD1 4.22Å; F141-L176 HydrophobicContact CB-CD2 4.38Å; F141-L176 HydrophobicContact CD1-CD1 4.27Å; C152-L176 HydrophobicContact CB-CD1 4.2Å; C152-L176 HydrophobicContact CB-CG 4.27Å; C174-L176 PolarHBondContact O-N 3.08Å; L176-S180 WeakPolarHBondContact O-CB 3.47Å; L176-S180 PolarHBondContact O-N 2.9Å; L176-R185 PolarHBondContact O-NH2 2.97Å; L176-C406 HydrophobicContact CD1-CB 4.06Å; L176-V407 HydrophobicContact CD1-CG2 4.19Å
177	D	98.2	Very high	95.4	Very high	27 Å²	27	49.1 Å²	49.1	14%	0.144	24%	0.239	C	C	.	.	H	α-helix	trans	-75.9	-42.5	174.8	-66.2	-29.2	0	0	0	111.1	C174 P175 Y179 S180 R185 V186 A189	C174-D177 HydrophobicContact CB-CB 4.4Å; C174-D177 WeakPolarHBondContact CB-OD2 3.33Å; C174-D177 WeakPolarHBondContact O-CB 3.27Å; C174-D177 PolarHBondContact O-N 3.24Å; P175-D177 PolarHBondContact O-N 3.46Å; D177-Y179 VanDerWaalsContact C-N 3.28Å; D177-Y179 PolarHBondContact O-N 3.42Å; D177-S180 VanDerWaalsContact O-CB 3.3Å; D177-S180 WeakPolarHBondContact O-CB 3.24Å; D177-S180 PolarHBondContact O-N 3.13Å; D177-S180 VanDerWaalsContact O-N 3.13Å; D177-S180 PolarHBondContact O-OG 3.39Å; D177-R185 HydrophobicContact CB-CB 4.04Å; D177-R185 IonicContact OD1-CZ 2.67Å; D177-R185 IonicContact OD1-NE 3.36Å; D177-R185 PolarHBondContact OD1-NE 3.02Å; D177-R185 IonicContact OD1-NH2 3.45Å; D177-R185 PolarHBondContact OD1-NH2 2.86Å; D177-V186 WeakPolarHBondContact O-CG2 3.32Å; D177-A189 HydrophobicContact CB-CB 3.98Å
178	L	98.5	Very high	95.9	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-39.4	176.7	-169.7	72.1	0	0	0	112.2	I134 P136 F173 C174 P175 V186 A189 V190 L249 L270	I134-L178 HydrophobicContact CG2-CD2 4.23Å; P136-L178 HydrophobicContact CB-CD2 3.68Å; F173-L178 HydrophobicContact CE2-CB 4.05Å; F173-L178 HydrophobicContact CE2-CD1 4.45Å; F173-L178 HydrophobicContact CE2-CD2 3.97Å; F173-L178 HydrophobicContact CE2-CG 4.39Å; F173-L178 HydrophobicContact CZ-CD2 4.04Å; C174-L178 PolarHBondContact O-N 3.4Å; P175-L178 PolarHBondContact O-N 3.24Å; P175-L178 VanDerWaalsContact O-N 3.17Å; L178-V186 HydrophobicContact CD1-CG1 4.43Å; L178-V186 WeakPolarHBondContact O-CG2 3.13Å; L178-A189 HydrophobicContact CB-CB 4.16Å; L178-A189 HydrophobicContact CD1-CB 4.33Å; L178-V190 HydrophobicContact CD1-CG2 4.1Å; L178-L249 HydrophobicContact CD1-CD1 3.8Å; L178-L270 HydrophobicContact CG-CD1 4Å; L178-L270 WeakPolarHBondContact O-CD1 3.42Å
179	Y	98.3	Very high	96.5	Very high	5 Å²	5	42 Å²	42	2%	0.02	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	5.3	179.4	-78.1	-88.1	0	0	0	114	P136 K137 G139 P175 D177 L181 L270 Q271 M273 L274 Q277	P136-Y179 HydrophobicContact CB-CE2 3.74Å; P136-Y179 WeakPolarHBondContact CB-OH 3.39Å; P136-Y179 WeakPolarHBondContact CG-OH 3.27Å; P136-Y179 WeakPolarHBondContact O-CE2 3.46Å; K137-Y179 WeakPolarHBondContact O-CE2 3.32Å; K137-Y179 PolarHBondContact O-OH 2.93Å; G139-Y179 VanDerWaalsContact CA-CG 3.49Å; P175-Y179 VanDerWaalsContact O-CD2 3.3Å; P175-Y179 WeakPolarHBondContact O-CD2 3.3Å; P175-Y179 PolarHBondContact O-N 2.92Å; D177-Y179 VanDerWaalsContact C-N 3.28Å; D177-Y179 PolarHBondContact O-N 3.42Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 2.97Å; Y179-L270 HydrophobicContact CD1-CB 3.86Å; Y179-L270 HydrophobicContact CD1-CD2 4.03Å; Y179-L270 HydrophobicContact CD1-CG 4.49Å; Y179-L270 WeakPolarHBondContact CD1-O 3.49Å; Y179-L270 HydrophobicContact CE1-CB 4.01Å; Y179-L270 HydrophobicContact CE1-CD2 3.59Å; Y179-L270 HydrophobicContact CE1-CG 4.41Å; Y179-L270 WeakPolarHBondContact CE1-O 3.45Å; Y179-L270 HydrophobicContact CE2-CD2 4.26Å; Y179-Q271 PolarHBondContact O-NE2 2.98Å; Y179-M273 HydrophobicContact CE1-CB 4.09Å; Y179-L274 HydrophobicContact CD1-CB 3.8Å; Y179-L274 HydrophobicContact CD1-CD1 4.48Å; Y179-L274 HydrophobicContact CE1-CB 4.16Å; Y179-Q277 PolarHBondContact OH-NE2 3.47Å
180	S	97	Very high	97	Very high	31 Å²	31	39.3 Å²	39.3	22%	0.217	19%	0.188	C	C	.	.	S	Bend	trans	-75.8	-13.4	-170.4	66.4	0	0	0	0	115.9	L176 D177 D182 R185	L176-S180 WeakPolarHBondContact O-CB 3.47Å; L176-S180 PolarHBondContact O-N 2.9Å; D177-S180 VanDerWaalsContact O-CB 3.3Å; D177-S180 WeakPolarHBondContact O-CB 3.24Å; D177-S180 PolarHBondContact O-N 3.13Å; D177-S180 VanDerWaalsContact O-N 3.13Å; D177-S180 PolarHBondContact O-OG 3.39Å; S180-D182 PolarHBondContact O-N 3.46Å; S180-D182 PolarHBondContact OG-N 3.26Å; S180-R185 WeakPolarHBondContact OG-CB 3.25Å
181	L	95.3	Very high	97.3	Very high	82 Å²	82	43.9 Å²	43.9	43%	0.429	21%	0.207	S	C	.	.			trans	57.6	-17.8	-161.9	-68.9	-176.9	0	0	0	116.1	Y179 F183 P268 Q271	Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 2.97Å; L181-F183 PolarHBondContact O-N 2.88Å; L181-F183 VanDerWaalsContact O-N 3.11Å; L181-P268 HydrophobicContact CD2-CB 4.28Å; L181-P268 HydrophobicContact CD2-CG 4Å; L181-Q271 HydrophobicContact CD1-CG 3.73Å; L181-Q271 HydrophobicContact CD2-CG 3.32Å; L181-Q271 HydrophobicContact CG-CG 3.57Å; L181-Q271 VanDerWaalsContact CG-NE2 3.34Å
182	D	97.5	Very high	97.5	Very high	73 Å²	73	44.4 Å²	44.4	39%	0.39	21%	0.211	S	C	.	.			trans	-66.5	112	174.2	176.6	-92.7	0	0	0	109.2	S180 K184 R185 V186	S180-D182 PolarHBondContact O-N 3.46Å; S180-D182 PolarHBondContact OG-N 3.26Å; D182-K184 PolarHBondContact O-N 3.15Å; D182-K184 VanDerWaalsContact O-N 3.13Å; D182-K184 WeakPolarHBondContact OD1-CB 3.42Å; D182-K184 PolarHBondContact OD1-N 2.88Å; D182-R185 HydrophobicContact CB-CB 4.15Å; D182-R185 HydrophobicContact CB-CG 4.24Å; D182-R185 PolarHBondContact O-N 3.41Å; D182-R185 VanDerWaalsContact O-N 3.08Å; D182-R185 WeakPolarHBondContact OD1-CB 3.44Å; D182-R185 VanDerWaalsContact OD1-CG 3.3Å; D182-R185 WeakPolarHBondContact OD1-CG 3.43Å; D182-R185 PolarHBondContact OD1-N 2.87Å; D182-V186 WeakPolarHBondContact O-CG2 3.25Å; D182-V186 PolarHBondContact O-N 2.81Å
183	F	97.6	Very high	97.7	Very high	69 Å²	69	40.6 Å²	40.6	30%	0.303	19%	0.19	S	C	.	.	H	α-helix	trans	-55.3	-37	-173.7	-179	-96.7	0	0	0	112.8	L181 H187 K243 A246 K247	L181-F183 PolarHBondContact O-N 2.88Å; L181-F183 VanDerWaalsContact O-N 3.11Å; F183-H187 HydrophobicContact CE1-CB 4.42Å; F183-H187 WeakPolarHBondContact O-CB 3.25Å; F183-H187 PolarHBondContact O-N 3.26Å; F183-K243 HydrophobicContact CE1-CG 4.36Å; F183-K243 HydrophobicContact CZ-CG 3.74Å; F183-A246 HydrophobicContact CD2-CB 4.34Å; F183-A246 HydrophobicContact CE2-CB 3.76Å; F183-A246 HydrophobicContact CZ-CB 4.22Å; F183-K247 HydrophobicContact CE2-CB 4.4Å; F183-K247 HydrophobicContact CE2-CG 3.65Å; F183-K247 HydrophobicContact CZ-CG 4.1Å
184	K	98	Very high	97.6	Very high	169 Å²	169	42.3 Å²	42.3	74%	0.735	20%	0.201	S	C	*	.	H	α-helix	trans	-66.3	-44.7	179.9	-68.2	177.4	177.5	176.8	0	111	D182 H188	D182-K184 PolarHBondContact O-N 3.15Å; D182-K184 VanDerWaalsContact O-N 3.13Å; D182-K184 WeakPolarHBondContact OD1-CB 3.42Å; D182-K184 PolarHBondContact OD1-N 2.88Å; K184-H188 WeakPolarHBondContact O-CB 3.28Å; K184-H188 PolarHBondContact O-N 2.81Å
185	R	98	Very high	97.3	Very high	101 Å²	101	50 Å²	50	38%	0.381	23%	0.234	S	C	.	.	H	α-helix	trans	-66.6	-44	176.2	-70.7	176.8	69.4	-163.9	-0.7	112	L176 D177 S180 D182 H187 H188 A189	L176-R185 PolarHBondContact O-NH2 2.97Å; D177-R185 HydrophobicContact CB-CB 4.04Å; D177-R185 IonicContact OD1-CZ 2.67Å; D177-R185 IonicContact OD1-NE 3.36Å; D177-R185 PolarHBondContact OD1-NE 3.02Å; D177-R185 IonicContact OD1-NH2 3.45Å; D177-R185 PolarHBondContact OD1-NH2 2.86Å; S180-R185 WeakPolarHBondContact OG-CB 3.25Å; D182-R185 HydrophobicContact CB-CB 4.15Å; D182-R185 HydrophobicContact CB-CG 4.24Å; D182-R185 PolarHBondContact O-N 3.41Å; D182-R185 VanDerWaalsContact O-N 3.08Å; D182-R185 WeakPolarHBondContact OD1-CB 3.44Å; D182-R185 VanDerWaalsContact OD1-CG 3.3Å; D182-R185 WeakPolarHBondContact OD1-CG 3.43Å; D182-R185 PolarHBondContact OD1-N 2.87Å; R185-H187 PolarHBondContact O-N 3.35Å; R185-H188 PolarHBondContact O-N 3.44Å; R185-A189 PolarHBondContact O-N 3.5Å
186	V	98.5	Very high	97.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-47.1	175.9	178.3	0	0	0	0	110.5	D177 L178 D182 H188 A189 V190 A246 L249 T250	D177-V186 WeakPolarHBondContact O-CG2 3.32Å; L178-V186 HydrophobicContact CD1-CG1 4.43Å; L178-V186 WeakPolarHBondContact O-CG2 3.13Å; D182-V186 WeakPolarHBondContact O-CG2 3.25Å; D182-V186 PolarHBondContact O-N 2.81Å; V186-H188 VanDerWaalsContact C-N 3.35Å; V186-H188 PolarHBondContact O-N 3.36Å; V186-A189 PolarHBondContact O-N 3.22Å; V186-V190 HydrophobicContact CG1-CG2 4.5Å; V186-V190 WeakPolarHBondContact O-CG2 3.36Å; V186-V190 PolarHBondContact O-N 2.72Å; V186-A246 HydrophobicContact CG1-CB 3.96Å; V186-L249 HydrophobicContact CG1-CB 4.34Å; V186-T250 HydrophobicContact CB-CG2 4.09Å; V186-T250 HydrophobicContact CG1-CG2 4.08Å; V186-T250 HydrophobicContact CG2-CG2 3.85Å
187	H	98.2	Very high	96.8	Very high	41 Å²	41	51.3 Å²	51.3	19%	0.19	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-44.2	176.2	177.3	-143.2	0	0	0	112	F183 R185 A189 V190 K191 D240 A246	F183-H187 HydrophobicContact CE1-CB 4.42Å; F183-H187 WeakPolarHBondContact O-CB 3.25Å; F183-H187 PolarHBondContact O-N 3.26Å; R185-H187 PolarHBondContact O-N 3.35Å; H187-A189 PolarHBondContact O-N 3.04Å; H187-V190 PolarHBondContact O-N 2.86Å; H187-K191 WeakPolarHBondContact O-CB 3.41Å; H187-K191 PolarHBondContact O-N 2.79Å; H187-D240 IonicContact CE1-OD2 3.98Å; H187-D240 IonicContact NE2-OD1 2.6Å; H187-D240 IonicContact NE2-OD2 2.64Å; H187-A246 HydrophobicContact CB-CB 3.98Å
188	H	97.7	Very high	96.6	Very high	90 Å²	90	50.4 Å²	50.4	42%	0.417	24%	0.236	S	C	.	.	H	α-helix	trans	-57.4	-49.1	174.2	178.6	71.6	0	0	0	111.6	K184 R185 V186 V190 K191 S192	K184-H188 WeakPolarHBondContact O-CB 3.28Å; K184-H188 PolarHBondContact O-N 2.81Å; R185-H188 PolarHBondContact O-N 3.44Å; V186-H188 VanDerWaalsContact C-N 3.35Å; V186-H188 PolarHBondContact O-N 3.36Å; H188-V190 VanDerWaalsContact C-N 3.35Å; H188-V190 PolarHBondContact O-N 2.95Å; H188-K191 PolarHBondContact O-N 3.17Å; H188-S192 PolarHBondContact O-N 2.89Å; H188-S192 PolarHBondContact O-OG 2.92Å
189	A	98.2	Very high	96.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-44.2	178.8	0	0	0	0	0	112.5	F173 D177 L178 R185 V186 H187 S192 L193	F173-A189 HydrophobicContact CD2-CB 3.99Å; F173-A189 WeakPolarHBondContact CD2-O 3.32Å; F173-A189 HydrophobicContact CE2-CB 4.23Å; D177-A189 HydrophobicContact CB-CB 3.98Å; L178-A189 HydrophobicContact CB-CB 4.16Å; L178-A189 HydrophobicContact CD1-CB 4.33Å; R185-A189 PolarHBondContact O-N 3.5Å; V186-A189 PolarHBondContact O-N 3.22Å; H187-A189 PolarHBondContact O-N 3.04Å; A189-S192 PolarHBondContact O-N 2.79Å; A189-L193 PolarHBondContact O-N 3.12Å
190	V	98.3	Very high	96.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-43.4	176.8	177.8	0	0	0	0	111	L178 V186 H187 H188 S192 L193 V194 A242 I245 L249	L178-V190 HydrophobicContact CD1-CG2 4.1Å; V186-V190 HydrophobicContact CG1-CG2 4.5Å; V186-V190 WeakPolarHBondContact O-CG2 3.36Å; V186-V190 PolarHBondContact O-N 2.72Å; H187-V190 PolarHBondContact O-N 2.86Å; H188-V190 VanDerWaalsContact C-N 3.35Å; H188-V190 PolarHBondContact O-N 2.95Å; V190-S192 VanDerWaalsContact C-N 3.29Å; V190-S192 PolarHBondContact O-N 2.99Å; V190-L193 WeakPolarHBondContact O-CB 3.48Å; V190-L193 PolarHBondContact O-N 3.05Å; V190-L193 VanDerWaalsContact O-N 3.09Å; V190-V194 HydrophobicContact CG1-CG2 4.47Å; V190-V194 WeakPolarHBondContact O-CG2 3.23Å; V190-V194 PolarHBondContact O-N 3.38Å; V190-A242 HydrophobicContact CB-CB 4.37Å; V190-A242 HydrophobicContact CG1-CB 3.83Å; V190-I245 HydrophobicContact CG1-CB 3.96Å; V190-I245 HydrophobicContact CG1-CG2 3.87Å; V190-I245 HydrophobicContact CG2-CG2 4.01Å; V190-L249 HydrophobicContact CG2-CD1 4.11Å
191	K	96.9	Very high	96.1	Very high	129 Å²	129	51.3 Å²	51.3	56%	0.561	25%	0.246	S	C	*	.	H	α-helix	trans	-61.5	-38	177.5	-170.8	173.2	-175.4	170.6	0	111.9	H187 H188 L193 V194 K195 A242	H187-K191 WeakPolarHBondContact O-CB 3.41Å; H187-K191 PolarHBondContact O-N 2.79Å; H188-K191 PolarHBondContact O-N 3.17Å; K191-L193 VanDerWaalsContact C-N 3.34Å; K191-V194 PolarHBondContact O-N 3.28Å; K191-K195 PolarHBondContact O-N 3.21Å; K191-A242 HydrophobicContact CB-CB 4.16Å
192	S	96.6	Very high	96.1	Very high	11 Å²	11	50.1 Å²	50.1	8%	0.077	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-40.6	173.3	-54.4	0	0	0	0	112.2	D172 H188 A189 V190 K195 I196	D172-S192 WeakPolarHBondContact CB-OG 3.35Å; H188-S192 PolarHBondContact O-N 2.89Å; H188-S192 PolarHBondContact O-OG 2.92Å; A189-S192 PolarHBondContact O-N 2.79Å; V190-S192 VanDerWaalsContact C-N 3.29Å; V190-S192 PolarHBondContact O-N 2.99Å; S192-K195 PolarHBondContact O-N 3.49Å; S192-I196 PolarHBondContact O-N 2.97Å
193	L	96.8	Very high	96.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-39.7	176	-72.4	173.8	0	0	0	112.5	I134 Y171 F173 A189 V190 K191 K195 I196 P197 N200 M201	I134-L193 HydrophobicContact CG2-CD1 4.02Å; Y171-L193 HydrophobicContact CE2-CD2 4.24Å; F173-L193 HydrophobicContact CB-CD2 3.93Å; F173-L193 HydrophobicContact CB-CG 4.09Å; F173-L193 HydrophobicContact CD1-CD2 3.98Å; F173-L193 HydrophobicContact CD2-CD1 3.63Å; F173-L193 HydrophobicContact CD2-CD2 3.85Å; F173-L193 HydrophobicContact CD2-CG 3.49Å; F173-L193 VanDerWaalsContact CD2-CG 3.49Å; F173-L193 HydrophobicContact CE1-CD2 4.46Å; F173-L193 HydrophobicContact CE2-CD1 3.6Å; F173-L193 HydrophobicContact CE2-CD2 4.35Å; F173-L193 HydrophobicContact CE2-CG 4.01Å; F173-L193 HydrophobicContact CG-CD1 4.29Å; F173-L193 HydrophobicContact CG-CD2 3.63Å; F173-L193 HydrophobicContact CG-CG 3.78Å; F173-L193 HydrophobicContact CZ-CD1 4.23Å; A189-L193 PolarHBondContact O-N 3.12Å; V190-L193 WeakPolarHBondContact O-CB 3.48Å; V190-L193 PolarHBondContact O-N 3.05Å; V190-L193 VanDerWaalsContact O-N 3.09Å; K191-L193 VanDerWaalsContact C-N 3.34Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 2.99Å; L193-I196 CarbonylContact O-C 3.44Å; L193-I196 VanDerWaalsContact O-C 3.22Å; L193-I196 PolarHBondContact O-N 3.2Å; L193-P197 WeakPolarHBondContact O-CA 3.27Å; L193-P197 VanDerWaalsContact O-N 3.08Å; L193-N200 HydrophobicContact CD2-CB 3.67Å; L193-M201 HydrophobicContact CB-CB 4.03Å; L193-M201 HydrophobicContact CB-CG 4.44Å; L193-M201 HydrophobicContact CB-SD 3.6Å; L193-M201 HydrophobicContact CD2-CB 4.4Å
194	V	94.9	Very high	95.9	Very high	36 Å²	36	44.5 Å²	44.5	22%	0.218	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-38.8	174.5	163.7	0	0	0	0	111.3	V190 K191 M201 H211 L223 F241 A242	V190-V194 HydrophobicContact CG1-CG2 4.47Å; V190-V194 WeakPolarHBondContact O-CG2 3.23Å; V190-V194 PolarHBondContact O-N 3.38Å; K191-V194 PolarHBondContact O-N 3.28Å; V194-M201 HydrophobicContact CG2-CE 3.98Å; V194-M201 HydrophobicContact CG2-SD 4Å; V194-H211 PolarHBondContact O-CE1 2.78Å; V194-H211 PolarHBondContact O-NE2 3.39Å; V194-L223 HydrophobicContact CB-CD1 4.36Å; V194-L223 HydrophobicContact CG1-CD1 3.76Å; V194-L223 HydrophobicContact CG2-CD1 4.03Å; V194-F241 HydrophobicContact CG2-CD1 3.8Å; V194-F241 HydrophobicContact CG2-CE1 4Å; V194-A242 HydrophobicContact CG2-CB 4.45Å
195	K	93	Very high	95.7	Very high	165 Å²	165	40 Å²	40	72%	0.717	19%	0.19	S	C	*	.	H	α-helix	trans	-73.3	-46.3	178.4	-170	-173.7	174.8	-177	0	111.9	K191 S192 L193	K191-K195 PolarHBondContact O-N 3.21Å; S192-K195 PolarHBondContact O-N 3.49Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 2.99Å
196	I	92.6	Very high	95.3	Very high	35 Å²	35	38.3 Å²	38.3	18%	0.179	19%	0.188	C	C	.	.			trans	-136.9	94	-176.5	-56	174.6	0	0	0	107.9	Y171 S192 L193 H198	Y171-I196 WeakPolarHBondContact CD2-O 3.39Å; S192-I196 PolarHBondContact O-N 2.97Å; L193-I196 CarbonylContact O-C 3.44Å; L193-I196 VanDerWaalsContact O-C 3.22Å; L193-I196 PolarHBondContact O-N 3.2Å; I196-H198 WeakPolarHBondContact CG2-CD2 3.43Å; I196-H198 VanDerWaalsContact CG2-NE2 3.26Å; I196-H198 WeakPolarHBondContact CG2-NE2 3.32Å; I196-H198 PolarHBondContact O-N 2.92Å
197	P	93.7	Very high	95	Very high	9 Å²	9	38.4 Å²	38.4	6%	0.058	19%	0.19	C	C	.	.			trans	-73.6	-25.4	-171.3	24.1	-33.1	0	0	0	114	L193 A199 N200 M201	L193-P197 WeakPolarHBondContact O-CA 3.27Å; L193-P197 VanDerWaalsContact O-N 3.08Å; P197-A199 PolarHBondContact O-N 2.79Å; P197-N200 WeakPolarHBondContact O-CA 2.9Å; P197-N200 PolarHBondContact O-N 3.5Å; P197-M201 HydrophobicContact CB-CB 3.88Å; P197-M201 WeakPolarHBondContact CB-O 2.92Å; P197-M201 PolarHBondContact O-N 3.32Å
198	H	92.7	Very high	94.6	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.037	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	-138.7	-165.8	-71.9	-174	0	0	0	110.2	Q158 Y167 S169 Y171 I196 N200 S213	Q158-H198 PolarHBondContact OE1-ND1 3.35Å; Y167-H198 HydrophobicContact CD1-CB 4.26Å; Y167-H198 AromaticContact CD1-CD2 3.61Å; Y167-H198 AromaticContact CD1-CG 3.85Å; Y167-H198 AromaticContact CD2-CD2 3.95Å; Y167-H198 AromaticContact CD2-CE1 3.42Å; Y167-H198 VanDerWaalsContact CD2-CE1 3.42Å; Y167-H198 WeakPolarHBondContact CD2-CE1 3.02Å; Y167-H198 AromaticContact CD2-CG 3.76Å; Y167-H198 AromaticContact CD2-ND1 3.4Å; Y167-H198 WeakPolarHBondContact CD2-ND1 3.3Å; Y167-H198 AromaticContact CD2-NE2 3.78Å; Y167-H198 HydrophobicContact CE1-CB 3.77Å; Y167-H198 AromaticContact CE1-CG 3.85Å; Y167-H198 HydrophobicContact CE2-CB 4.04Å; Y167-H198 AromaticContact CE2-CG 3.74Å; Y167-H198 AromaticContact CE2-ND1 3.48Å; Y167-H198 WeakPolarHBondContact CE2-ND1 3.4Å; Y167-H198 AromaticContact CG-CD2 3.57Å; Y167-H198 AromaticContact CG-CE1 3.67Å; Y167-H198 AromaticContact CG-CG 3.82Å; Y167-H198 AromaticContact CG-ND1 3.85Å; Y167-H198 AromaticContact CG-NE2 3.51Å; Y167-H198 AromaticContact CZ-CG 3.8Å; S169-H198 PolarHBondContact O-NE2 3.44Å; Y171-H198 HydrophobicContact CD2-CB 4.15Å; Y171-H198 AromaticContact CD2-CE1 3.8Å; Y171-H198 AromaticContact CD2-CG 3.65Å; Y171-H198 AromaticContact CD2-ND1 3.4Å; Y171-H198 WeakPolarHBondContact CD2-ND1 3.47Å; Y171-H198 HydrophobicContact CE2-CB 3.93Å; Y171-H198 AromaticContact CE2-CG 3.79Å; Y171-H198 AromaticContact CE2-ND1 3.46Å; Y171-H198 WeakPolarHBondContact CE2-ND1 3.4Å; Y171-H198 AromaticContact CG-CE1 3.73Å; Y171-H198 AromaticContact CG-ND1 3.78Å; Y171-H198 AromaticContact CZ-ND1 3.89Å; I196-H198 WeakPolarHBondContact CG2-CD2 3.43Å; I196-H198 VanDerWaalsContact CG2-NE2 3.26Å; I196-H198 WeakPolarHBondContact CG2-NE2 3.32Å; I196-H198 PolarHBondContact O-N 2.92Å; H198-N200 VanDerWaalsContact C-N 3.29Å; H198-S213 WeakPolarHBondContact CA-OG 3.42Å; H198-S213 PolarHBondContact N-OG 3.48Å; H198-S213 WeakPolarHBondContact O-CB 3.45Å; H198-S213 PolarHBondContact O-OG 3.22Å; H198-S213 VanDerWaalsContact O-OG 3.12Å
199	A	91	Very high	94.3	Very high	53 Å²	53	41.3 Å²	41.3	44%	0.438	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	17.2	168.6	0	0	0	0	0	113	K135 Y167 P197	K135-A199 WeakPolarHBondContact CD-O 3.4Å; Y167-A199 PolarHBondContact OH-N 3.12Å; P197-A199 PolarHBondContact O-N 2.79Å
200	N	95.8	Very high	94.1	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-11.9	-171.4	-74.3	1.3	0	0	0	114.3	I134 K135 K137 Y171 L193 P197 H198	I134-N200 CarbonylContact C-O 3.57Å; I134-N200 WeakPolarHBondContact CA-O 3.33Å; K135-N200 HydrophobicContact CB-CB 4.42Å; K135-N200 PolarHBondContact N-O 3.2Å; K137-N200 WeakPolarHBondContact CE-OD1 3.27Å; Y171-N200 PolarHBondContact OH-ND2 2.84Å; L193-N200 HydrophobicContact CD2-CB 3.67Å; P197-N200 WeakPolarHBondContact O-CA 2.9Å; P197-N200 PolarHBondContact O-N 3.5Å; H198-N200 VanDerWaalsContact C-N 3.29Å
201	M	96.8	Very high	93.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139	174.1	-172.5	176.4	-147.7	0	0	111.5	V132 E133 I134 L193 V194 P197 V203 F241	V132-M201 HydrophobicContact CG1-CE 3.43Å; V132-M201 VanDerWaalsContact CG1-CE 3.43Å; V132-M201 HydrophobicContact CG1-CG 4.44Å; E133-M201 CarbonylContact O-C 3.54Å; E133-M201 VanDerWaalsContact O-CA 3.27Å; E133-M201 WeakPolarHBondContact O-CA 3.41Å; I134-M201 HydrophobicContact CD1-CE 4.46Å; I134-M201 HydrophobicContact CG1-CE 4.46Å; L193-M201 HydrophobicContact CB-CB 4.03Å; L193-M201 HydrophobicContact CB-CG 4.44Å; L193-M201 HydrophobicContact CB-SD 3.6Å; L193-M201 HydrophobicContact CD2-CB 4.4Å; V194-M201 HydrophobicContact CG2-CE 3.98Å; V194-M201 HydrophobicContact CG2-SD 4Å; P197-M201 HydrophobicContact CB-CB 3.88Å; P197-M201 WeakPolarHBondContact CB-O 2.92Å; P197-M201 PolarHBondContact O-N 3.32Å; M201-V203 HydrophobicContact CE-CG2 4.41Å; M201-F241 HydrophobicContact CE-CE1 3.79Å
202	K	95.6	Very high	93.6	Very high	57 Å²	57	38 Å²	38	25%	0.248	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.5	165.1	-62.7	-178.9	-175.7	172.8	0	109.5	V132 E133 F204 L209 H211	V132-K202 WeakPolarHBondContact CA-O 3.45Å; E133-K202 HydrophobicContact CB-CB 4.23Å; E133-K202 PolarHBondContact N-O 2.81Å; E133-K202 PolarHBondContact O-N 3.21Å; K202-F204 HydrophobicContact CB-CD2 4.48Å; K202-F204 HydrophobicContact CB-CE2 3.63Å; K202-F204 HydrophobicContact CB-CZ 3.93Å; K202-F204 HydrophobicContact CD-CE2 4.41Å; K202-F204 HydrophobicContact CD-CZ 3.94Å; K202-L209 HydrophobicContact CB-CD1 3.86Å; K202-L209 HydrophobicContact CD-CD1 4.21Å; K202-L209 HydrophobicContact CG-CD1 4.22Å; K202-H211 WeakPolarHBondContact CA-O 3.16Å
203	V	96.5	Very high	93	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.8	172.8	-171.2	0	0	0	0	109.4	V130 T131 V132 M201 V210 H211 L223 L226 F241	V130-V203 HydrophobicContact CG1-CG1 4.07Å; T131-V203 CarbonylContact O-C 3.57Å; T131-V203 WeakPolarHBondContact O-CA 3.29Å; V132-V203 HydrophobicContact CG1-CG2 4.46Å; V132-V203 HydrophobicContact CG2-CG1 4.33Å; V132-V203 HydrophobicContact CG2-CG2 4.45Å; M201-V203 HydrophobicContact CE-CG2 4.41Å; V203-V210 HydrophobicContact CB-CG2 4.14Å; V203-V210 HydrophobicContact CG1-CG2 4Å; V203-V210 WeakPolarHBondContact O-CG2 3.49Å; V203-V210 PolarHBondContact O-N 3.43Å; V203-H211 HydrophobicContact CB-CB 3.85Å; V203-H211 HydrophobicContact CG2-CB 3.98Å; V203-H211 PolarHBondContact N-O 3.19Å; V203-H211 PolarHBondContact O-N 3.27Å; V203-L223 HydrophobicContact CB-CD2 4.4Å; V203-L223 HydrophobicContact CG1-CD2 4.37Å; V203-L223 HydrophobicContact CG2-CD1 4.21Å; V203-L223 HydrophobicContact CG2-CD2 4.34Å; V203-L226 HydrophobicContact CG1-CD1 3.7Å; V203-F241 HydrophobicContact CG1-CE2 4.3Å; V203-F241 HydrophobicContact CG1-CZ 3.99Å; V203-F241 HydrophobicContact CG2-CE1 4.22Å; V203-F241 HydrophobicContact CG2-CZ 3.8Å
204	F	94.5	Very high	91.9	Very high	23 Å²	23	47.6 Å²	47.6	10%	0.101	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.3	179.3	-53.5	-98.2	0	0	0	109.9	V130 T131 E133 K202 Q208 L209	V130-F204 CarbonylContact C-O 3.47Å; V130-F204 WeakPolarHBondContact CA-O 3.32Å; T131-F204 PolarHBondContact N-O 2.88Å; T131-F204 PolarHBondContact O-N 2.8Å; E133-F204 HydrophobicContact CB-CE2 4.22Å; K202-F204 HydrophobicContact CB-CD2 4.48Å; K202-F204 HydrophobicContact CB-CE2 3.63Å; K202-F204 HydrophobicContact CB-CZ 3.93Å; K202-F204 HydrophobicContact CD-CE2 4.41Å; K202-F204 HydrophobicContact CD-CZ 3.94Å; F204-Q208 CarbonylContact C-O 3.41Å; F204-Q208 WeakPolarHBondContact CA-O 3.38Å; F204-L209 HydrophobicContact CD1-CB 4.04Å; F204-L209 HydrophobicContact CD1-CD1 4.03Å; F204-L209 HydrophobicContact CE1-CB 4.01Å; F204-L209 HydrophobicContact CE1-CD1 3.65Å; F204-L209 HydrophobicContact CE1-CG 4.41Å; F204-L209 HydrophobicContact CE2-CD1 4.39Å; F204-L209 HydrophobicContact CZ-CD1 3.85Å
205	K	93.1	Very high	90.5	Very high	75 Å²	75	49 Å²	49	33%	0.326	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.7	172.3	-177.1	-173.4	179.7	-177.7	0	108.2	N128 G207 Q208 V210 L226	N128-K205 HydrophobicContact CB-CG 4.14Å; N128-K205 WeakPolarHBondContact ND2-CE 2.99Å; N128-K205 WeakPolarHBondContact OD1-CE 3.22Å; K205-G207 PolarHBondContact O-N 3.33Å; K205-Q208 PolarHBondContact N-O 3.4Å; K205-Q208 WeakPolarHBondContact O-CB 3.09Å; K205-Q208 PolarHBondContact O-N 2.91Å; K205-V210 HydrophobicContact CB-CG1 3.81Å; K205-V210 HydrophobicContact CB-CG2 4.2Å; K205-L226 HydrophobicContact CB-CD2 4.39Å; K205-L226 HydrophobicContact CD-CD2 3.98Å; K205-L226 HydrophobicContact CG-CD2 4.44Å
206	N	90.7	Very high	88.6	Confident	66 Å²	66	48 Å²	48	35%	0.353	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	46.1	-171	-55.7	-29.9	0	0	0	110.4	Y117 N128 T129 Q208	Y117-N206 HydrophobicContact CE1-CB 4.43Å; Y117-N206 PolarHBondContact OH-O 3.48Å; N128-N206 WeakPolarHBondContact CA-OD1 3.24Å; N128-N206 PolarHBondContact OD1-ND2 2.8Å; T129-N206 PolarHBondContact N-OD1 3.05Å; T129-N206 PolarHBondContact O-N 2.88Å; N206-Q208 PolarHBondContact O-N 2.78Å
207	G	90.8	Very high	86.8	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.031	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	-11.7	-178.8	0	0	0	0	0	117.6	R16 K205	R16-G207 VanDerWaalsContact CZ-CA 3.41Å; R16-G207 VanDerWaalsContact NH1-CA 3.27Å; R16-G207 PolarHBondContact NH1-O 3.42Å; K205-G207 PolarHBondContact O-N 3.33Å
208	Q	90.7	Very high	85.1	Confident	142 Å²	142	54.1 Å²	54.1	66%	0.664	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.7	175.1	-173.6	-179.5	2.7	0	0	110.1	F204 K205 N206 V210	F204-Q208 CarbonylContact C-O 3.41Å; F204-Q208 WeakPolarHBondContact CA-O 3.38Å; K205-Q208 PolarHBondContact N-O 3.4Å; K205-Q208 WeakPolarHBondContact O-CB 3.09Å; K205-Q208 PolarHBondContact O-N 2.91Å; N206-Q208 PolarHBondContact O-N 2.78Å; Q208-V210 PolarHBondContact O-N 2.95Å
209	L	91.8	Very high	83.7	Confident	49 Å²	49	60.1 Å²	60.1	26%	0.257	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	122.3	175.3	-176.1	67.8	0	0	0	110.5	K202 F204 Q215	K202-L209 HydrophobicContact CB-CD1 3.86Å; K202-L209 HydrophobicContact CD-CD1 4.21Å; K202-L209 HydrophobicContact CG-CD1 4.22Å; F204-L209 HydrophobicContact CD1-CB 4.04Å; F204-L209 HydrophobicContact CD1-CD1 4.03Å; F204-L209 HydrophobicContact CE1-CB 4.01Å; F204-L209 HydrophobicContact CE1-CD1 3.65Å; F204-L209 HydrophobicContact CE1-CG 4.41Å; F204-L209 HydrophobicContact CE2-CD1 4.39Å; F204-L209 HydrophobicContact CZ-CD1 3.85Å; L209-Q215 PolarHBondContact O-NE2 2.6Å
210	V	92.4	Very high	82.8	Confident	19 Å²	19	62.9 Å²	62.9	12%	0.115	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	-9.6	-178.1	-64.1	0	0	0	0	114	V203 K205 Q208 Q215 T221 L226	V203-V210 HydrophobicContact CB-CG2 4.14Å; V203-V210 HydrophobicContact CG1-CG2 4Å; V203-V210 WeakPolarHBondContact O-CG2 3.49Å; V203-V210 PolarHBondContact O-N 3.43Å; K205-V210 HydrophobicContact CB-CG1 3.81Å; K205-V210 HydrophobicContact CB-CG2 4.2Å; Q208-V210 PolarHBondContact O-N 2.95Å; V210-Q215 PolarHBondContact O-OE1 3.36Å; V210-T221 HydrophobicContact CB-CG2 4.29Å; V210-T221 HydrophobicContact CG2-CG2 4.47Å; V210-T221 WeakPolarHBondContact O-CB 3.39Å; V210-T221 PolarHBondContact O-OG1 3.2Å; V210-L226 HydrophobicContact CG2-CD2 4.46Å
211	H	93	Very high	82.2	Confident	29 Å²	29	65.1 Å²	65.1	13%	0.134	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	123.8	175.1	-177.8	79.6	0	0	0	111.5	V194 K202 V203 Q215 L223	V194-H211 PolarHBondContact O-CE1 2.78Å; V194-H211 PolarHBondContact O-NE2 3.39Å; K202-H211 WeakPolarHBondContact CA-O 3.16Å; V203-H211 HydrophobicContact CB-CB 3.85Å; V203-H211 HydrophobicContact CG2-CB 3.98Å; V203-H211 PolarHBondContact N-O 3.19Å; V203-H211 PolarHBondContact O-N 3.27Å; H211-Q215 VanDerWaalsContact CA-OE1 3.26Å; H211-Q215 VanDerWaalsContact N-OE1 3.09Å; H211-L223 HydrophobicContact CB-CD2 4Å
212	S	91.7	Very high	81.8	Confident	11 Å²	11	68.2 Å²	68.2	8%	0.077	38%	0.381	C	S	.	.			trans	-166.4	170.8	172.2	69.8	0	0	0	0	110.8	Q214 Q215	S212-Q214 VanDerWaalsContact C-N 3.27Å; S212-Q214 PolarHBondContact O-N 2.65Å; S212-Q214 PolarHBondContact OG-N 3.11Å; S212-Q215 PolarHBondContact O-N 2.74Å
213	S	85.7	Confident	81.5	Confident	56 Å²	56	66 Å²	66	39%	0.392	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.9	173.1	-80.3	0	0	0	0	115.2	H198 Q215	H198-S213 WeakPolarHBondContact CA-OG 3.42Å; H198-S213 PolarHBondContact N-OG 3.48Å; H198-S213 WeakPolarHBondContact O-CB 3.45Å; H198-S213 PolarHBondContact O-OG 3.22Å; H198-S213 VanDerWaalsContact O-OG 3.12Å; S213-Q215 VanDerWaalsContact C-N 3.26Å
214	Q	72.4	Confident	81.2	Confident	157 Å²	157	69.4 Å²	69.4	73%	0.734	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.8	-180	-68.8	173.6	-16.8	0	0	112.4	S212 T216	S212-Q214 VanDerWaalsContact C-N 3.27Å; S212-Q214 PolarHBondContact O-N 2.65Å; S212-Q214 PolarHBondContact OG-N 3.11Å; Q214-T216 PolarHBondContact O-N 3.08Å
215	Q	66	Low	80.8	Confident	66 Å²	66	75.1 Å²	75.1	31%	0.308	41%	0.414	S	S	.	.			trans	-91	100.8	-178.9	-94.1	-176.9	-20.3	0	0	110	L209 V210 H211 S212 S213 V217	L209-Q215 PolarHBondContact O-NE2 2.6Å; V210-Q215 PolarHBondContact O-OE1 3.36Å; H211-Q215 VanDerWaalsContact CA-OE1 3.26Å; H211-Q215 VanDerWaalsContact N-OE1 3.09Å; S212-Q215 PolarHBondContact O-N 2.74Å; S213-Q215 VanDerWaalsContact C-N 3.26Å; Q215-V217 HydrophobicContact CB-CG2 3.6Å; Q215-V217 HydrophobicContact CG-CG2 4.26Å; Q215-V217 PolarHBondContact O-N 3.47Å
216	T	53.3	Low	80.4	Confident	145 Å²	145	72 Å²	72	89%	0.89	40%	0.402	S	S	*	.			trans	-75.5	74.5	163.2	50.7	0	0	0	0	108.4	Q214 A218	Q214-T216 PolarHBondContact O-N 3.08Å; T216-A218 PolarHBondContact O-N 3.3Å
217	V	54	Low	79.8	Confident	71 Å²	71	69 Å²	69	43%	0.43	39%	0.386	S	S	.	.			trans	-84.5	121.4	-174.8	-147.1	0	0	0	0	110	Q215 N219	Q215-V217 HydrophobicContact CB-CG2 3.6Å; Q215-V217 HydrophobicContact CG-CG2 4.26Å; Q215-V217 PolarHBondContact O-N 3.47Å; V217-N219 WeakPolarHBondContact CG1-O 3.41Å; V217-N219 PolarHBondContact O-N 3.22Å
218	A	58.6	Low	79	Confident	100 Å²	100	71 Å²	71	83%	0.826	41%	0.406	S	S	*	.	S	Bend	trans	-55.9	-24.7	164.6	0	0	0	0	0	112.3	T216	T216-A218 PolarHBondContact O-N 3.3Å
219	N	62.5	Low	78.1	Confident	134 Å²	134	65 Å²	65	72%	0.717	38%	0.378	S	S	*	.	S	Bend	trans	-134.3	91.4	177.3	-74.5	-32.4	0	0	0	110.7	V217 T221	V217-N219 WeakPolarHBondContact CG1-O 3.41Å; V217-N219 PolarHBondContact O-N 3.22Å; N219-T221 PolarHBondContact O-N 3.39Å
220	P	74.1	Confident	77.2	Confident	111 Å²	111	72.4 Å²	72.4	72%	0.721	40%	0.402	S	S	*	.			trans	-56.4	133	178.2	22.5	-32.3	0	0	0	111.1	D222	P220-D222 PolarHBondContact O-N 3.21Å
221	T	82.9	Confident	76.3	Confident	51 Å²	51	71.9 Å²	71.9	31%	0.313	40%	0.4	S	S	.	.			trans	-62.3	120.7	175.6	-54.6	0	0	0	0	109.5	V210 N219 L223 L226	V210-T221 HydrophobicContact CB-CG2 4.29Å; V210-T221 HydrophobicContact CG2-CG2 4.47Å; V210-T221 WeakPolarHBondContact O-CB 3.39Å; V210-T221 PolarHBondContact O-OG1 3.2Å; N219-T221 PolarHBondContact O-N 3.39Å; T221-L223 HydrophobicContact CG2-CD2 4.16Å; T221-L223 PolarHBondContact O-N 2.91Å; T221-L226 HydrophobicContact CG2-CD2 4.06Å; T221-L226 HydrophobicContact CG2-CG 4.47Å
222	D	86.7	Confident	74.9	Confident	68 Å²	68	76.8 Å²	76.8	36%	0.364	43%	0.431	S	S	.	.			trans	-69.9	99.6	168.9	-173.3	-14.2	0	0	0	109.2	P220 D224 K225	P220-D222 PolarHBondContact O-N 3.21Å; D222-D224 PolarHBondContact O-N 3.4Å; D222-D224 PolarHBondContact OD1-N 2.8Å; D222-K225 HydrophobicContact CB-CB 4.3Å; D222-K225 HydrophobicContact CB-CD 4.05Å; D222-K225 HydrophobicContact CB-CG 4.23Å; D222-K225 PolarHBondContact O-N 2.85Å; D222-K225 VanDerWaalsContact O-N 3.16Å; D222-K225 VanDerWaalsContact OD2-CD 3.23Å; D222-K225 WeakPolarHBondContact OD2-CD 3.37Å; D222-K225 WeakPolarHBondContact OD2-CE 3.42Å; D222-K225 WeakPolarHBondContact OD2-CG 3.08Å; D222-K225 IonicContact OD2-NZ 2.67Å; D222-K225 PolarHBondContact OD2-NZ 3.5Å
223	L	90.7	Very high	73.5	Confident	11 Å²	11	82.3 Å²	82.3	6%	0.058	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-65.5	-29.2	-175.2	-61.7	-172.8	0	0	0	112.5	V194 V203 H211 T221 K225 L226 F241	V194-L223 HydrophobicContact CB-CD1 4.36Å; V194-L223 HydrophobicContact CG1-CD1 3.76Å; V194-L223 HydrophobicContact CG2-CD1 4.03Å; V203-L223 HydrophobicContact CB-CD2 4.4Å; V203-L223 HydrophobicContact CG1-CD2 4.37Å; V203-L223 HydrophobicContact CG2-CD1 4.21Å; V203-L223 HydrophobicContact CG2-CD2 4.34Å; H211-L223 HydrophobicContact CB-CD2 4Å; T221-L223 HydrophobicContact CG2-CD2 4.16Å; T221-L223 PolarHBondContact O-N 2.91Å; L223-K225 PolarHBondContact O-N 3.33Å; L223-L226 HydrophobicContact CB-CD1 4.31Å; L223-L226 HydrophobicContact CD2-CD1 3.56Å; L223-L226 HydrophobicContact CD2-CG 4.38Å; L223-L226 VanDerWaalsContact O-CB 3.31Å; L223-L226 WeakPolarHBondContact O-CB 3.15Å; L223-L226 PolarHBondContact O-N 2.86Å; L223-F241 HydrophobicContact CB-CB 4.07Å; L223-F241 HydrophobicContact CB-CD1 4.07Å; L223-F241 HydrophobicContact CB-CD2 4.11Å; L223-F241 HydrophobicContact CB-CG 3.83Å; L223-F241 HydrophobicContact CD1-CD1 3.92Å; L223-F241 HydrophobicContact CD1-CE1 3.81Å; L223-F241 HydrophobicContact CD1-CZ 4.31Å
224	D	89.2	Confident	72.2	Confident	70 Å²	70	82.4 Å²	82.4	37%	0.374	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-68.5	-21.4	179.3	-65	-23.2	0	0	0	111.3	D222 G238 E239 F241	D222-D224 PolarHBondContact O-N 3.4Å; D222-D224 PolarHBondContact OD1-N 2.8Å; D224-G238 CarbonylContact O-C 3.56Å; D224-G238 WeakPolarHBondContact O-CA 3.33Å; D224-E239 VanDerWaalsContact CA-O 3.27Å; D224-E239 WeakPolarHBondContact CA-O 3.15Å; D224-E239 WeakPolarHBondContact CB-O 3.33Å; D224-E239 PolarHBondContact O-N 3.09Å; D224-E239 VanDerWaalsContact O-N 3.1Å; D224-F241 VanDerWaalsContact OD1-CB 3.28Å; D224-F241 WeakPolarHBondContact OD1-CB 3.47Å; D224-F241 PolarHBondContact OD1-N 3.38Å
225	K	87	Confident	71.5	Confident	143 Å²	143	79.8 Å²	79.8	62%	0.622	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-86.8	-6.1	173.7	-68.3	-178.8	-177.6	133.7	0	114.3	D222 L223 F227 G228	D222-K225 HydrophobicContact CB-CB 4.3Å; D222-K225 HydrophobicContact CB-CD 4.05Å; D222-K225 HydrophobicContact CB-CG 4.23Å; D222-K225 PolarHBondContact O-N 2.85Å; D222-K225 VanDerWaalsContact O-N 3.16Å; D222-K225 VanDerWaalsContact OD2-CD 3.23Å; D222-K225 WeakPolarHBondContact OD2-CD 3.37Å; D222-K225 WeakPolarHBondContact OD2-CE 3.42Å; D222-K225 WeakPolarHBondContact OD2-CG 3.08Å; D222-K225 IonicContact OD2-NZ 2.67Å; D222-K225 PolarHBondContact OD2-NZ 3.5Å; L223-K225 PolarHBondContact O-N 3.33Å; K225-F227 PolarHBondContact O-N 2.88Å; K225-G228 PolarHBondContact O-N 3.4Å
226	L	84.7	Confident	71.3	Confident	11 Å²	11	80.2 Å²	80.2	6%	0.058	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.9	-179.8	-74.4	177.1	0	0	0	113	V130 V203 K205 V210 T221 L223 F241	V130-L226 HydrophobicContact CG1-CD1 4.06Å; V130-L226 HydrophobicContact CG2-CB 4.12Å; V203-L226 HydrophobicContact CG1-CD1 3.7Å; K205-L226 HydrophobicContact CB-CD2 4.39Å; K205-L226 HydrophobicContact CD-CD2 3.98Å; K205-L226 HydrophobicContact CG-CD2 4.44Å; V210-L226 HydrophobicContact CG2-CD2 4.46Å; T221-L226 HydrophobicContact CG2-CD2 4.06Å; T221-L226 HydrophobicContact CG2-CG 4.47Å; L223-L226 HydrophobicContact CB-CD1 4.31Å; L223-L226 HydrophobicContact CD2-CD1 3.56Å; L223-L226 HydrophobicContact CD2-CG 4.38Å; L223-L226 VanDerWaalsContact O-CB 3.31Å; L223-L226 WeakPolarHBondContact O-CB 3.15Å; L223-L226 PolarHBondContact O-N 2.86Å; L226-F241 HydrophobicContact CD1-CD2 4.41Å; L226-F241 HydrophobicContact CD1-CE2 4.01Å
227	F	77.8	Confident	71.9	Confident	3 Å²	3	77.4 Å²	77.4	1%	0.013	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	18.5	176.2	-61.7	-77.5	0	0	0	113.1	V130 K225 H229 F241 L244 M340 I342	V130-F227 HydrophobicContact CB-CE1 3.9Å; V130-F227 HydrophobicContact CB-CE2 4.48Å; V130-F227 HydrophobicContact CB-CZ 3.67Å; V130-F227 HydrophobicContact CG1-CE2 4.23Å; V130-F227 HydrophobicContact CG1-CZ 3.8Å; V130-F227 HydrophobicContact CG2-CD1 4.48Å; V130-F227 HydrophobicContact CG2-CE1 3.94Å; V130-F227 HydrophobicContact CG2-CZ 4.01Å; K225-F227 PolarHBondContact O-N 2.88Å; F227-H229 PolarHBondContact O-N 3.26Å; F227-H229 PolarHBondContact O-ND1 3.4Å; F227-F241 HydrophobicContact CD2-CD2 4.3Å; F227-F241 AromaticContact CE2-CD2 3.74Å; F227-F241 HydrophobicContact CE2-CD2 3.74Å; F227-F241 AromaticContact CE2-CE2 3.96Å; F227-F241 HydrophobicContact CE2-CE2 3.96Å; F227-L244 HydrophobicContact CD2-CD2 4.07Å; F227-L244 HydrophobicContact CE2-CD2 3.76Å; F227-L244 HydrophobicContact CZ-CD2 4.01Å; F227-M340 HydrophobicContact CE1-CB 3.95Å; F227-M340 HydrophobicContact CE2-CE 4.41Å; F227-M340 HydrophobicContact CZ-CB 4Å; F227-M340 HydrophobicContact CZ-CE 3.71Å; F227-M340 HydrophobicContact CZ-SD 3.79Å; F227-I342 HydrophobicContact CB-CD1 4.44Å; F227-I342 HydrophobicContact CD1-CB 4.44Å
228	G	74.5	Confident	72.6	Confident	45 Å²	45	76.2 Å²	76.2	46%	0.464	45%	0.454	S	S	.	.			trans	-56.2	115.5	173.7	0	0	0	0	0	110.6	K225	K225-G228 PolarHBondContact O-N 3.4Å
229	H	72	Confident	73.7	Confident	16 Å²	16	72.9 Å²	72.9	7%	0.074	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.2	-177.6	61.3	-71.8	0	0	0	109.5	F227 C231 A236 I342 C359 C361	F227-H229 PolarHBondContact O-N 3.26Å; F227-H229 PolarHBondContact O-ND1 3.4Å; H229-C231 PolarHBondContact O-N 3.21Å; H229-C231 VanDerWaalsContact O-N 3.1Å; H229-A236 WeakPolarHBondContact O-CA 3.45Å; H229-I342 HydrophobicContact CB-CD1 4.06Å; H229-I342 HydrophobicContact CB-CG2 4.39Å; H229-I342 VanDerWaalsContact CG-CD1 3.48Å; H229-I342 WeakPolarHBondContact ND1-CD1 3.37Å; H229-C359 PolarHBondContact NE2-SG 3.33Å; H229-C361 PolarHBondContact CD2-SG 3.41Å; H229-C361 PolarHBondContact NE2-SG 3.15Å
230	R	71.1	Confident	75	Confident	204 Å²	204	69.5 Å²	69.5	77%	0.77	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	89.1	168.4	-72.3	-169.6	-72.2	-110.1	2.8	107.9	L344	R230-L344 WeakPolarHBondContact O-CD2 3.42Å
231	C	74.3	Confident	75.9	Confident	8 Å²	8	64.2 Å²	64.2	5%	0.054	37%	0.368	C	S	.	.			trans	-65.4	172.2	174.2	69	0	0	0	0	110.9	H229 N233 G234 I235 C359	H229-C231 PolarHBondContact O-N 3.21Å; H229-C231 VanDerWaalsContact O-N 3.1Å; C231-N233 PolarHBondContact O-N 3.28Å; C231-G234 PolarHBondContact O-N 2.91Å; C231-I235 PolarHBondContact SG-O 2.93Å; C231-I235 VanDerWaalsContact SG-O 3.32Å; C231-C359 HydrophobicContact CB-CB 4.48Å
232	V	64.4	Low	76.5	Confident	132 Å²	132	62 Å²	62	80%	0.8	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-27.6	179.7	-179	0	0	0	0	112.2	G234	V232-G234 VanDerWaalsContact C-N 3.31Å; V232-G234 PolarHBondContact O-N 3.37Å
233	N	61.9	Low	77	Confident	127 Å²	127	63.2 Å²	63.2	68%	0.679	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	4.3	178.8	-61.2	-19.2	0	0	0	114.1	C231 I235	C231-N233 PolarHBondContact O-N 3.28Å; N233-I235 PolarHBondContact O-N 3.26Å; N233-I235 VanDerWaalsContact O-N 3.13Å
234	G	57.6	Low	77.2	Confident	58 Å²	58	63 Å²	63	60%	0.598	36%	0.356	S	S	*	.	S	Bend	trans	74.1	-3.9	174.7	0	0	0	0	0	116.2	C231 V232	C231-G234 PolarHBondContact O-N 2.91Å; V232-G234 VanDerWaalsContact C-N 3.31Å; V232-G234 PolarHBondContact O-N 3.37Å
235	I	58.9	Low	77.6	Confident	102 Å²	102	59.6 Å²	59.6	52%	0.523	34%	0.338	S	S	.	.			trans	-95.2	121	-179.5	-57.1	172.3	0	0	0	109.5	C231 N233 Q237	C231-I235 PolarHBondContact SG-O 2.93Å; C231-I235 VanDerWaalsContact SG-O 3.32Å; N233-I235 PolarHBondContact O-N 3.26Å; N233-I235 VanDerWaalsContact O-N 3.13Å; I235-Q237 HydrophobicContact CB-CG 4.46Å; I235-Q237 HydrophobicContact CG2-CG 3.89Å; I235-Q237 PolarHBondContact O-N 3.38Å
236	A	61.4	Low	78.1	Confident	74 Å²	74	52.8 Å²	52.8	61%	0.612	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	102.7	166.6	0	0	0	0	0	109	H229	H229-A236 WeakPolarHBondContact O-CA 3.45Å
237	Q	65	Low	78.7	Confident	86 Å²	86	55.7 Å²	55.7	40%	0.402	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.6	172.1	-65.9	-171.1	-9.8	0	0	109.1	I235	I235-Q237 HydrophobicContact CB-CG 4.46Å; I235-Q237 HydrophobicContact CG2-CG 3.89Å; I235-Q237 PolarHBondContact O-N 3.38Å
238	G	70.3	Confident	79.6	Confident	47 Å²	47	55.6 Å²	55.6	49%	0.485	32%	0.32	S	S	.	.			trans	-73.2	146.8	161.5	0	0	0	0	0	109.1	D224	D224-G238 CarbonylContact O-C 3.56Å; D224-G238 WeakPolarHBondContact O-CA 3.33Å
239	E	80.3	Confident	80.7	Confident	30 Å²	30	53.7 Å²	53.7	14%	0.14	30%	0.3	C	S	.	.			trans	-107.5	144	174.4	-72.6	-68.2	161.7	0	0	108.4	D224 F241 L357	D224-E239 VanDerWaalsContact CA-O 3.27Å; D224-E239 WeakPolarHBondContact CA-O 3.15Å; D224-E239 WeakPolarHBondContact CB-O 3.33Å; D224-E239 PolarHBondContact O-N 3.09Å; D224-E239 VanDerWaalsContact O-N 3.1Å; E239-F241 PolarHBondContact O-N 2.92Å; E239-L357 HydrophobicContact CG-CD1 3.95Å; E239-L357 HydrophobicContact CG-CD2 4.19Å
240	D	89.5	Confident	81.8	Confident	63 Å²	63	54.6 Å²	54.6	34%	0.337	31%	0.306	S	S	.	.			trans	-61.1	103.4	172.2	178.8	-23	0	0	0	108.8	H187 A242 K243 L244	H187-D240 IonicContact CE1-OD2 3.98Å; H187-D240 IonicContact NE2-OD1 2.6Å; H187-D240 IonicContact NE2-OD2 2.64Å; D240-A242 VanDerWaalsContact C-N 3.31Å; D240-A242 PolarHBondContact O-N 3.03Å; D240-A242 PolarHBondContact OD1-N 2.95Å; D240-A242 VanDerWaalsContact OD1-N 3.15Å; D240-K243 HydrophobicContact CB-CB 3.7Å; D240-K243 HydrophobicContact CB-CD 4.25Å; D240-K243 WeakPolarHBondContact O-CB 3.47Å; D240-K243 PolarHBondContact O-N 2.87Å; D240-K243 WeakPolarHBondContact OD1-CB 3.43Å; D240-K243 PolarHBondContact OD1-N 3.17Å; D240-K243 WeakPolarHBondContact OD2-CB 3.37Å; D240-L244 PolarHBondContact O-N 3.46Å
241	F	93.7	Very high	82.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-42.1	-172.7	177.3	-90.7	0	0	0	110.8	V130 V132 V194 M201 V203 L223 D224 L226 F227 E239 L244 I245	V130-F241 HydrophobicContact CG1-CE2 4.22Å; V132-F241 HydrophobicContact CG2-CE1 4.34Å; V132-F241 HydrophobicContact CG2-CE2 4.04Å; V132-F241 HydrophobicContact CG2-CZ 3.42Å; V132-F241 VanDerWaalsContact CG2-CZ 3.42Å; V194-F241 HydrophobicContact CG2-CD1 3.8Å; V194-F241 HydrophobicContact CG2-CE1 4Å; M201-F241 HydrophobicContact CE-CE1 3.79Å; V203-F241 HydrophobicContact CG1-CE2 4.3Å; V203-F241 HydrophobicContact CG1-CZ 3.99Å; V203-F241 HydrophobicContact CG2-CE1 4.22Å; V203-F241 HydrophobicContact CG2-CZ 3.8Å; L223-F241 HydrophobicContact CB-CB 4.07Å; L223-F241 HydrophobicContact CB-CD1 4.07Å; L223-F241 HydrophobicContact CB-CD2 4.11Å; L223-F241 HydrophobicContact CB-CG 3.83Å; L223-F241 HydrophobicContact CD1-CD1 3.92Å; L223-F241 HydrophobicContact CD1-CE1 3.81Å; L223-F241 HydrophobicContact CD1-CZ 4.31Å; D224-F241 VanDerWaalsContact OD1-CB 3.28Å; D224-F241 WeakPolarHBondContact OD1-CB 3.47Å; D224-F241 PolarHBondContact OD1-N 3.38Å; L226-F241 HydrophobicContact CD1-CD2 4.41Å; L226-F241 HydrophobicContact CD1-CE2 4.01Å; F227-F241 HydrophobicContact CD2-CD2 4.3Å; F227-F241 AromaticContact CE2-CD2 3.74Å; F227-F241 HydrophobicContact CE2-CD2 3.74Å; F227-F241 AromaticContact CE2-CE2 3.96Å; F227-F241 HydrophobicContact CE2-CE2 3.96Å; E239-F241 PolarHBondContact O-N 2.92Å; F241-L244 PolarHBondContact O-N 3.42Å; F241-I245 HydrophobicContact CD1-CG1 4.44Å; F241-I245 HydrophobicContact CE1-CG1 4.18Å; F241-I245 HydrophobicContact CZ-CG1 4.39Å; F241-I245 VanDerWaalsContact O-CG1 3.32Å; F241-I245 WeakPolarHBondContact O-CG1 3.47Å; F241-I245 PolarHBondContact O-N 3.06Å; F241-I245 VanDerWaalsContact O-N 3.13Å
242	A	96.5	Very high	83.6	Confident	5 Å²	5	49.8 Å²	49.8	4%	0.041	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-40.1	-180	0	0	0	0	0	111.4	V190 K191 V194 D240 I245 A246	V190-A242 HydrophobicContact CB-CB 4.37Å; V190-A242 HydrophobicContact CG1-CB 3.83Å; K191-A242 HydrophobicContact CB-CB 4.16Å; V194-A242 HydrophobicContact CG2-CB 4.45Å; D240-A242 VanDerWaalsContact C-N 3.31Å; D240-A242 PolarHBondContact O-N 3.03Å; D240-A242 PolarHBondContact OD1-N 2.95Å; D240-A242 VanDerWaalsContact OD1-N 3.15Å; A242-I245 PolarHBondContact O-N 3.31Å; A242-A246 WeakPolarHBondContact O-CB 3.31Å; A242-A246 PolarHBondContact O-N 2.59Å
243	K	95.6	Very high	84.7	Confident	92 Å²	92	44 Å²	44	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-41.1	176	-170.8	-173.9	-175.2	175.8	0	112	F183 D240 A246 K247	F183-K243 HydrophobicContact CE1-CG 4.36Å; F183-K243 HydrophobicContact CZ-CG 3.74Å; D240-K243 HydrophobicContact CB-CB 3.7Å; D240-K243 HydrophobicContact CB-CD 4.25Å; D240-K243 WeakPolarHBondContact O-CB 3.47Å; D240-K243 PolarHBondContact O-N 2.87Å; D240-K243 WeakPolarHBondContact OD1-CB 3.43Å; D240-K243 PolarHBondContact OD1-N 3.17Å; D240-K243 WeakPolarHBondContact OD2-CB 3.37Å; K243-A246 PolarHBondContact O-N 3.21Å; K243-K247 WeakPolarHBondContact O-CG 3.44Å; K243-K247 PolarHBondContact O-N 2.96Å
244	L	95.2	Very high	85.7	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-48.8	176.5	177.9	61.4	0	0	0	111.2	F227 D240 F241 A246 K247 I248 M340 L355 L357 V363	F227-L244 HydrophobicContact CD2-CD2 4.07Å; F227-L244 HydrophobicContact CE2-CD2 3.76Å; F227-L244 HydrophobicContact CZ-CD2 4.01Å; D240-L244 PolarHBondContact O-N 3.46Å; F241-L244 PolarHBondContact O-N 3.42Å; L244-A246 VanDerWaalsContact C-N 3.34Å; L244-A246 PolarHBondContact O-N 3.07Å; L244-K247 WeakPolarHBondContact O-CB 3.26Å; L244-K247 PolarHBondContact O-N 3.43Å; L244-I248 HydrophobicContact CG-CD1 4.4Å; L244-I248 WeakPolarHBondContact O-CG1 3.32Å; L244-I248 PolarHBondContact O-N 2.99Å; L244-I248 VanDerWaalsContact O-N 3.08Å; L244-M340 HydrophobicContact CD2-SD 4.16Å; L244-M340 HydrophobicContact CG-SD 4.5Å; L244-L355 HydrophobicContact CD1-CD1 3.81Å; L244-L357 HydrophobicContact CD1-CD2 4.38Å; L244-V363 HydrophobicContact CD1-CB 4.37Å; L244-V363 HydrophobicContact CD1-CG1 4.43Å; L244-V363 HydrophobicContact CD1-CG2 4.25Å; L244-V363 HydrophobicContact CD2-CG1 4.27Å; L244-V363 HydrophobicContact CD2-CG2 4.16Å
245	I	97.5	Very high	86.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-41.7	177.7	-63.4	-66.6	0	0	0	111.2	V132 I134 V190 F241 A242 K247 I248 L249 I338 M340	V132-I245 HydrophobicContact CB-CD1 4.1Å; V132-I245 HydrophobicContact CG1-CD1 4.4Å; V132-I245 HydrophobicContact CG2-CD1 3.71Å; V132-I245 HydrophobicContact CG2-CG1 4.49Å; I134-I245 HydrophobicContact CD1-CG2 3.75Å; V190-I245 HydrophobicContact CG1-CB 3.96Å; V190-I245 HydrophobicContact CG1-CG2 3.87Å; V190-I245 HydrophobicContact CG2-CG2 4.01Å; F241-I245 HydrophobicContact CD1-CG1 4.44Å; F241-I245 HydrophobicContact CE1-CG1 4.18Å; F241-I245 HydrophobicContact CZ-CG1 4.39Å; F241-I245 VanDerWaalsContact O-CG1 3.32Å; F241-I245 WeakPolarHBondContact O-CG1 3.47Å; F241-I245 PolarHBondContact O-N 3.06Å; F241-I245 VanDerWaalsContact O-N 3.13Å; A242-I245 PolarHBondContact O-N 3.31Å; I245-K247 VanDerWaalsContact C-N 3.33Å; I245-K247 PolarHBondContact O-N 3.38Å; I245-I248 PolarHBondContact O-N 3.3Å; I245-L249 HydrophobicContact CG2-CD1 3.83Å; I245-L249 HydrophobicContact CG2-CG 4.25Å; I245-L249 WeakPolarHBondContact O-CB 3.49Å; I245-L249 VanDerWaalsContact O-CG 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.45Å; I245-L249 PolarHBondContact O-N 3.37Å; I245-I338 HydrophobicContact CD1-CD1 4.12Å; I245-I338 HydrophobicContact CG2-CD1 4.07Å; I245-M340 HydrophobicContact CD1-CE 3.56Å; I245-M340 HydrophobicContact CD1-SD 3.82Å
246	A	98.1	Very high	87.4	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-44.4	175.5	0	0	0	0	0	111.8	F183 V186 H187 A242 K243 L244 I248 L249 T250	F183-A246 HydrophobicContact CD2-CB 4.34Å; F183-A246 HydrophobicContact CE2-CB 3.76Å; F183-A246 HydrophobicContact CZ-CB 4.22Å; V186-A246 HydrophobicContact CG1-CB 3.96Å; H187-A246 HydrophobicContact CB-CB 3.98Å; A242-A246 WeakPolarHBondContact O-CB 3.31Å; A242-A246 PolarHBondContact O-N 2.59Å; K243-A246 PolarHBondContact O-N 3.21Å; L244-A246 VanDerWaalsContact C-N 3.34Å; L244-A246 PolarHBondContact O-N 3.07Å; A246-I248 PolarHBondContact O-N 2.64Å; A246-L249 PolarHBondContact O-N 3.03Å; A246-T250 WeakPolarHBondContact O-CG2 3.39Å; A246-T250 PolarHBondContact O-N 3.44Å; A246-T250 PolarHBondContact O-OG1 2.89Å
247	K	96.4	Very high	87.5	Confident	72 Å²	72	37.1 Å²	37.1	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-58.7	-46.8	176	-74.7	177.9	176.3	-177	0	111.6	F183 K243 L244 I245 L249 T250 C251 L355	F183-K247 HydrophobicContact CE2-CB 4.4Å; F183-K247 HydrophobicContact CE2-CG 3.65Å; F183-K247 HydrophobicContact CZ-CG 4.1Å; K243-K247 WeakPolarHBondContact O-CG 3.44Å; K243-K247 PolarHBondContact O-N 2.96Å; L244-K247 WeakPolarHBondContact O-CB 3.26Å; L244-K247 PolarHBondContact O-N 3.43Å; I245-K247 VanDerWaalsContact C-N 3.33Å; I245-K247 PolarHBondContact O-N 3.38Å; K247-L249 VanDerWaalsContact C-N 3.33Å; K247-L249 PolarHBondContact O-N 3.45Å; K247-T250 PolarHBondContact O-N 3.34Å; K247-T250 PolarHBondContact O-OG1 3.29Å; K247-C251 WeakPolarHBondContact O-CB 3.45Å; K247-C251 PolarHBondContact O-N 2.85Å; K247-C251 VanDerWaalsContact O-N 3.11Å; K247-C251 PolarHBondContact O-SG 3.19Å; K247-L355 HydrophobicContact CB-CD1 3.95Å
248	I	96.8	Very high	87.6	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-45.2	177.9	-69.4	172.3	0	0	0	110.7	L244 I245 A246 T250 C251 I338 M340 L355 Y365 M367	L244-I248 HydrophobicContact CG-CD1 4.4Å; L244-I248 WeakPolarHBondContact O-CG1 3.32Å; L244-I248 PolarHBondContact O-N 2.99Å; L244-I248 VanDerWaalsContact O-N 3.08Å; I245-I248 PolarHBondContact O-N 3.3Å; A246-I248 PolarHBondContact O-N 2.64Å; I248-T250 VanDerWaalsContact C-N 3.31Å; I248-T250 PolarHBondContact O-N 2.63Å; I248-C251 PolarHBondContact O-SG 3.1Å; I248-I338 HydrophobicContact CD1-CG2 3.9Å; I248-I338 HydrophobicContact CG2-CD1 4.14Å; I248-I338 HydrophobicContact CG2-CG2 3.92Å; I248-M340 HydrophobicContact CD1-CG 4.08Å; I248-M340 HydrophobicContact CD1-SD 3.6Å; I248-L355 HydrophobicContact CD1-CD1 4.36Å; I248-L355 HydrophobicContact CG1-CD1 3.51Å; I248-Y365 HydrophobicContact CB-CD2 4.47Å; I248-Y365 HydrophobicContact CB-CE2 4.38Å; I248-Y365 HydrophobicContact CD1-CD1 4.26Å; I248-Y365 HydrophobicContact CD1-CD2 4.19Å; I248-Y365 HydrophobicContact CD1-CG 3.9Å; I248-Y365 HydrophobicContact CG1-CD1 4.21Å; I248-Y365 HydrophobicContact CG1-CD2 4.14Å; I248-Y365 HydrophobicContact CG1-CE1 4.34Å; I248-Y365 HydrophobicContact CG1-CE2 4.26Å; I248-Y365 HydrophobicContact CG1-CG 4.11Å; I248-Y365 HydrophobicContact CG2-CD2 3.58Å; I248-Y365 HydrophobicContact CG2-CE2 3.56Å; I248-Y365 HydrophobicContact CG2-CG 4.36Å; I248-M367 HydrophobicContact CG2-CE 4.46Å; I248-M367 HydrophobicContact CG2-CG 4.2Å; I248-M367 HydrophobicContact CG2-SD 3.74Å
249	L	97.5	Very high	87.4	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-24.6	-177.5	-71.5	177.9	0	0	0	113.8	I134 L178 V186 V190 I245 A246 K247 L270 I338 M367	I134-L249 HydrophobicContact CD1-CD1 4.14Å; L178-L249 HydrophobicContact CD1-CD1 3.8Å; V186-L249 HydrophobicContact CG1-CB 4.34Å; V190-L249 HydrophobicContact CG2-CD1 4.11Å; I245-L249 HydrophobicContact CG2-CD1 3.83Å; I245-L249 HydrophobicContact CG2-CG 4.25Å; I245-L249 WeakPolarHBondContact O-CB 3.49Å; I245-L249 VanDerWaalsContact O-CG 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.45Å; I245-L249 PolarHBondContact O-N 3.37Å; A246-L249 PolarHBondContact O-N 3.03Å; K247-L249 VanDerWaalsContact C-N 3.33Å; K247-L249 PolarHBondContact O-N 3.45Å; L249-L270 HydrophobicContact CB-CD1 3.9Å; L249-L270 HydrophobicContact CD1-CD1 4.26Å; L249-L270 HydrophobicContact CD2-CD1 3.94Å; L249-L270 HydrophobicContact CD2-CG 4.29Å; L249-L270 HydrophobicContact CG-CD1 4.26Å; L249-I338 HydrophobicContact CD2-CD1 3.87Å; L249-I338 HydrophobicContact CG-CD1 4.16Å; L249-M367 HydrophobicContact CD2-SD 4.47Å
250	T	96.7	Very high	86.4	Confident	35 Å²	35	43.2 Å²	43.2	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-94.8	-12.3	179.4	55.2	0	0	0	0	114.4	V186 A246 K247 I248 P268	V186-T250 HydrophobicContact CB-CG2 4.09Å; V186-T250 HydrophobicContact CG1-CG2 4.08Å; V186-T250 HydrophobicContact CG2-CG2 3.85Å; A246-T250 WeakPolarHBondContact O-CG2 3.39Å; A246-T250 PolarHBondContact O-N 3.44Å; A246-T250 PolarHBondContact O-OG1 2.89Å; K247-T250 PolarHBondContact O-N 3.34Å; K247-T250 PolarHBondContact O-OG1 3.29Å; I248-T250 VanDerWaalsContact C-N 3.31Å; I248-T250 PolarHBondContact O-N 2.63Å; T250-P268 VanDerWaalsContact O-CG 3.22Å; T250-P268 WeakPolarHBondContact O-CG 3.45Å
251	C	93.6	Very high	85.1	Confident	33 Å²	33	48.7 Å²	48.7	22%	0.223	27%	0.265	C	S	.	.	S	Bend	trans	-90.2	158.6	-179.8	72.8	0	0	0	0	112.5	K247 I248 P268 Y365	K247-C251 WeakPolarHBondContact O-CB 3.45Å; K247-C251 PolarHBondContact O-N 2.85Å; K247-C251 VanDerWaalsContact O-N 3.11Å; K247-C251 PolarHBondContact O-SG 3.19Å; I248-C251 PolarHBondContact O-SG 3.1Å; C251-P268 WeakPolarHBondContact O-CA 3.44Å; C251-P268 WeakPolarHBondContact O-CB 3.41Å; C251-Y365 PolarHBondContact SG-OH 3.23Å
252	N	89.7	Confident	83.8	Confident	77 Å²	77	50.4 Å²	50.4	41%	0.412	28%	0.277	S	S	.	.			trans	-64.6	140.2	171.5	-72.6	-4.8	0	0	0	110	N266 P268	N252-N266 PolarHBondContact ND2-O 3.23Å; N252-P268 WeakPolarHBondContact OD1-CD 3.3Å
253	Y	87.3	Confident	82.8	Confident	10 Å²	10	58.7 Å²	58.7	4%	0.039	32%	0.319	C	S	.	.			trans	-106.8	116.3	177.5	-172.8	-113.7	0	0	0	111	K68 V71 E255 P353 Y365 M367 R368	K68-Y253 PolarHBondContact NZ-O 2.95Å; K68-Y253 VanDerWaalsContact NZ-O 3.12Å; V71-Y253 HydrophobicContact CG2-CD1 4.11Å; V71-Y253 HydrophobicContact CG2-CE1 4.09Å; Y253-E255 HydrophobicContact CE1-CB 4.45Å; Y253-E255 PolarHBondContact OH-OE2 2.88Å; Y253-E255 VanDerWaalsContact OH-OE2 3.06Å; Y253-P353 HydrophobicContact CD2-CG 3.82Å; Y253-P353 HydrophobicContact CE2-CG 3.55Å; Y253-Y365 AromaticContact CD2-CE2 3.86Å; Y253-Y365 HydrophobicContact CD2-CE2 3.86Å; Y253-Y365 HydrophobicContact CE2-CD2 4.34Å; Y253-Y365 HydrophobicContact CE2-CE2 4.06Å; Y253-M367 VanDerWaalsContact CB-CE 3.43Å; Y253-M367 HydrophobicContact CD1-CB 4.47Å; Y253-M367 HydrophobicContact CD1-CE 4.21Å; Y253-M367 HydrophobicContact CD2-CB 4.34Å; Y253-M367 HydrophobicContact CD2-CE 3.46Å; Y253-M367 VanDerWaalsContact CD2-CE 3.46Å; Y253-M367 HydrophobicContact CD2-CG 4.34Å; Y253-M367 HydrophobicContact CE1-CB 4.19Å; Y253-M367 HydrophobicContact CE2-CB 4.08Å; Y253-M367 HydrophobicContact CE2-CE 4.28Å; Y253-M367 HydrophobicContact CE2-CG 4.26Å; Y253-M367 HydrophobicContact CG-CE 3.42Å; Y253-M367 VanDerWaalsContact CG-CE 3.42Å; Y253-M367 PolarHBondContact OH-N 3.33Å; Y253-R368 PolarHBondContact OH-NH1 3.35Å
254	V	81.6	Confident	82.2	Confident	46 Å²	46	55.3 Å²	55.3	28%	0.279	31%	0.307	S	S	.	.			trans	-133.5	116.4	178	-173.2	0	0	0	0	107.4	P257 N266 P353	V254-P257 HydrophobicContact CG1-CB 4.36Å; V254-N266 WeakPolarHBondContact CG2-OD1 3.4Å; V254-P353 WeakPolarHBondContact O-CD 3.24Å
255	E	80.7	Confident	81.6	Confident	26 Å²	26	58 Å²	58	12%	0.121	33%	0.325	C	S	.	.	S	Bend	trans	-106.8	-19.5	173	177.4	168.3	-162.8	0	0	111.6	Y253 K351 L352 R366 R368	Y253-E255 HydrophobicContact CE1-CB 4.45Å; Y253-E255 PolarHBondContact OH-OE2 2.88Å; Y253-E255 VanDerWaalsContact OH-OE2 3.06Å; E255-K351 WeakPolarHBondContact O-CB 3.46Å; E255-L352 HydrophobicContact CG-CD2 3.81Å; E255-L352 VanDerWaalsContact OE1-CD2 3.27Å; E255-L352 WeakPolarHBondContact OE1-CD2 3.11Å; E255-R366 IonicContact OE1-CZ 2.71Å; E255-R366 IonicContact OE1-NE 3.15Å; E255-R366 PolarHBondContact OE1-NE 3.35Å; E255-R366 VanDerWaalsContact OE1-NE 3.14Å; E255-R366 IonicContact OE1-NH2 3.81Å; E255-R366 PolarHBondContact OE1-NH2 3.37Å; E255-R368 VanDerWaalsContact CD-NH2 3.26Å; E255-R368 IonicContact OE1-CZ 2.85Å; E255-R368 IonicContact OE1-NH1 3.21Å; E255-R368 IonicContact OE1-NH2 3.27Å; E255-R368 PolarHBondContact OE1-NH2 3.13Å; E255-R368 IonicContact OE2-CZ 2.59Å; E255-R368 IonicContact OE2-NH1 3.11Å; E255-R368 PolarHBondContact OE2-NH1 3.02Å; E255-R368 IonicContact OE2-NH2 2.96Å; E255-R368 PolarHBondContact OE2-NH2 3.08Å
256	D	72.2	Confident	81.1	Confident	48 Å²	48	62.2 Å²	62.2	26%	0.257	35%	0.347	S	S	.	.			trans	-139.7	110.2	170.5	-159.4	-16.7	0	0	0	109.6	D258 D259	D256-D258 PolarHBondContact OD1-N 3.13Å; D256-D259 HydrophobicContact CB-CB 4.3Å
257	P	63.2	Low	80.8	Confident	97 Å²	97	64.8 Å²	64.8	63%	0.63	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-19.5	174.7	28.1	-31.7	0	0	0	112.7	V254 D259	V254-P257 HydrophobicContact CG1-CB 4.36Å; P257-D259 VanDerWaalsContact C-N 3.28Å; P257-D259 PolarHBondContact O-N 3.35Å
258	D	67.1	Low	80.7	Confident	126 Å²	126	61.9 Å²	61.9	67%	0.674	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-1	-178.6	-60	-36.8	0	0	0	112.8	D256 S260	D256-D258 PolarHBondContact OD1-N 3.13Å; D258-S260 PolarHBondContact O-N 2.67Å
259	D	66.3	Low	80.6	Confident	53 Å²	53	62.5 Å²	62.5	28%	0.283	35%	0.352	S	S	.	.			trans	-73.3	55	173.2	-167	14.2	0	0	0	111.2	D256 P257 E261 C262	D256-D259 HydrophobicContact CB-CB 4.3Å; P257-D259 VanDerWaalsContact C-N 3.28Å; P257-D259 PolarHBondContact O-N 3.35Å; D259-E261 PolarHBondContact O-N 2.92Å; D259-C262 WeakPolarHBondContact O-CB 3.5Å; D259-C262 PolarHBondContact O-N 2.93Å
260	S	59.3	Low	80.6	Confident	113 Å²	113	62.3 Å²	62.3	79%	0.79	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.3	-178	70	0	0	0	0	113.1	D258 C262	D258-S260 PolarHBondContact O-N 2.67Å; S260-C262 VanDerWaalsContact C-N 3.26Å; S260-C262 PolarHBondContact O-N 2.85Å
261	E	62.3	Low	80.5	Confident	177 Å²	177	62.2 Å²	62.2	83%	0.827	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-5.6	178.4	-66.3	-172.9	171.8	0	0	113.2	D259 L263	D259-E261 PolarHBondContact O-N 2.92Å; E261-L263 PolarHBondContact O-N 3.45Å
262	C	66.9	Low	80.6	Confident	37 Å²	37	61.8 Å²	61.8	25%	0.25	34%	0.342	C	S	.	.			trans	-77.9	110.9	-175	-156.6	0	0	0	0	112.5	D259 S260 V264	D259-C262 WeakPolarHBondContact O-CB 3.5Å; D259-C262 PolarHBondContact O-N 2.93Å; S260-C262 VanDerWaalsContact C-N 3.26Å; S260-C262 PolarHBondContact O-N 2.85Å; C262-V264 PolarHBondContact O-N 3.02Å; C262-V264 VanDerWaalsContact SG-CB 3.57Å; C262-V264 VanDerWaalsContact SG-CG2 3.6Å
263	L	75.8	Confident	81	Confident	178 Å²	178	58.1 Å²	58.1	93%	0.932	32%	0.322	S	S	*	.			trans	-65.1	-3.5	171.6	-65.6	174.1	0	0	0	114	E261 P265	E261-L263 PolarHBondContact O-N 3.45Å; L263-P265 WeakPolarHBondContact O-CD 3.3Å
264	V	81.5	Confident	81.5	Confident	22 Å²	22	58.4 Å²	58.4	13%	0.133	32%	0.324	C	S	.	.	S	Bend	trans	-80	121.4	-178.5	178.3	0	0	0	0	109.6	K68 C262 Y272	K68-V264 HydrophobicContact CG-CB 4.1Å; K68-V264 HydrophobicContact CG-CG1 4.13Å; C262-V264 PolarHBondContact O-N 3.02Å; C262-V264 VanDerWaalsContact SG-CB 3.57Å; C262-V264 VanDerWaalsContact SG-CG2 3.6Å; V264-Y272 HydrophobicContact CG1-CD1 3.99Å; V264-Y272 HydrophobicContact CG1-CD2 4.05Å; V264-Y272 HydrophobicContact CG1-CE1 3.74Å; V264-Y272 HydrophobicContact CG1-CE2 3.84Å; V264-Y272 HydrophobicContact CG1-CG 4.12Å
265	P	84.1	Confident	82.2	Confident	63 Å²	63	60.5 Å²	60.5	41%	0.409	33%	0.334	S	S	.	.			trans	-54.6	142.4	179.9	-26.4	34.4	0	0	0	113.2	L263 I267	L263-P265 WeakPolarHBondContact O-CD 3.3Å; P265-I267 VanDerWaalsContact C-N 3.25Å; P265-I267 HydrophobicContact CB-CD1 4.4Å; P265-I267 HydrophobicContact CB-CG1 4.34Å; P265-I267 HydrophobicContact CB-CG2 4.34Å; P265-I267 PolarHBondContact O-N 3.46Å
266	N	85.1	Confident	83	Confident	87 Å²	87	59.4 Å²	59.4	47%	0.465	33%	0.328	S	S	.	.	S	Bend	trans	-80.7	71.3	176.7	-164.2	31.9	0	0	0	111.8	K68 N252 V254	K68-N266 PolarHBondContact NZ-OD1 3.19Å; N252-N266 PolarHBondContact ND2-O 3.23Å; V254-N266 WeakPolarHBondContact CG2-OD1 3.4Å
267	I	91.8	Very high	84.2	Confident	54 Å²	54	57.1 Å²	57.1	28%	0.277	32%	0.316	S	S	.	.	S	Bend	trans	-122.3	165.1	177.3	62.3	-180	0	0	0	110.1	P265 Q271 Y272 L275	P265-I267 VanDerWaalsContact C-N 3.25Å; P265-I267 HydrophobicContact CB-CD1 4.4Å; P265-I267 HydrophobicContact CB-CG1 4.34Å; P265-I267 HydrophobicContact CB-CG2 4.34Å; P265-I267 PolarHBondContact O-N 3.46Å; I267-Q271 HydrophobicContact CB-CB 4.47Å; I267-Q271 HydrophobicContact CD1-CB 3.89Å; I267-Q271 HydrophobicContact CG1-CB 4.25Å; I267-Y272 HydrophobicContact CD1-CD2 4.29Å; I267-L275 HydrophobicContact CD1-CD1 3.56Å; I267-L275 HydrophobicContact CD1-CG 4.5Å
268	P	94.5	Very high	85.8	Confident	11 Å²	11	58 Å²	58	7%	0.071	31%	0.31	C	S	.	.			trans	-57.1	142.3	176	-25.9	37.4	0	0	0	111.4	L181 T250 C251 N252 L270 Q271 Y272	L181-P268 HydrophobicContact CD2-CB 4.28Å; L181-P268 HydrophobicContact CD2-CG 4Å; T250-P268 VanDerWaalsContact O-CG 3.22Å; T250-P268 WeakPolarHBondContact O-CG 3.45Å; C251-P268 WeakPolarHBondContact O-CA 3.44Å; C251-P268 WeakPolarHBondContact O-CB 3.41Å; N252-P268 WeakPolarHBondContact OD1-CD 3.3Å; P268-L270 VanDerWaalsContact C-N 3.27Å; P268-L270 PolarHBondContact O-N 2.96Å; P268-L270 VanDerWaalsContact O-N 3.16Å; P268-Q271 HydrophobicContact CB-CG 4.32Å; P268-Q271 WeakPolarHBondContact O-CA 2.96Å; P268-Q271 WeakPolarHBondContact O-CB 3.45Å; P268-Q271 PolarHBondContact O-N 3.35Å; P268-Y272 PolarHBondContact O-N 3.25Å
269	L	95.1	Very high	87.1	Confident	13 Å²	13	58.5 Å²	58.5	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-53.3	-43.5	-171.9	176.2	58	0	0	0	112.6	F67 V71 Q271 Y272 M273 I336 M367 L369	F67-L269 HydrophobicContact CD1-CD1 4.16Å; F67-L269 HydrophobicContact CE1-CD1 4.2Å; V71-L269 HydrophobicContact CG1-CD1 3.74Å; V71-L269 HydrophobicContact CG1-CD2 4.06Å; L269-Q271 VanDerWaalsContact C-N 3.27Å; L269-Q271 PolarHBondContact O-N 3.27Å; L269-Y272 PolarHBondContact O-N 3.48Å; L269-M273 HydrophobicContact CD1-CG 4.27Å; L269-M273 HydrophobicContact CD1-SD 4.41Å; L269-M273 HydrophobicContact CG-CG 4.48Å; L269-M273 HydrophobicContact CG-SD 4.08Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 2.95Å; L269-I336 HydrophobicContact CD2-CG2 4.49Å; L269-M367 HydrophobicContact CB-CE 4.05Å; L269-M367 HydrophobicContact CD2-CB 4.2Å; L269-M367 HydrophobicContact CD2-CE 4.37Å; L269-M367 HydrophobicContact CD2-SD 4.35Å; L269-L369 HydrophobicContact CD1-CD1 4.33Å; L269-L369 HydrophobicContact CD2-CD2 4.32Å; L269-L369 HydrophobicContact CD2-CG 4.38Å
270	L	97	Very high	88.5	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-37.5	176.5	-76.9	175.9	0	0	0	112.5	P136 L178 Y179 L249 P268 M273 L274 I336	P136-L270 HydrophobicContact CB-CD2 3.86Å; L178-L270 HydrophobicContact CG-CD1 4Å; L178-L270 WeakPolarHBondContact O-CD1 3.42Å; Y179-L270 HydrophobicContact CD1-CB 3.86Å; Y179-L270 HydrophobicContact CD1-CD2 4.03Å; Y179-L270 HydrophobicContact CD1-CG 4.49Å; Y179-L270 WeakPolarHBondContact CD1-O 3.49Å; Y179-L270 HydrophobicContact CE1-CB 4.01Å; Y179-L270 HydrophobicContact CE1-CD2 3.59Å; Y179-L270 HydrophobicContact CE1-CG 4.41Å; Y179-L270 WeakPolarHBondContact CE1-O 3.45Å; Y179-L270 HydrophobicContact CE2-CD2 4.26Å; L249-L270 HydrophobicContact CB-CD1 3.9Å; L249-L270 HydrophobicContact CD1-CD1 4.26Å; L249-L270 HydrophobicContact CD2-CD1 3.94Å; L249-L270 HydrophobicContact CD2-CG 4.29Å; L249-L270 HydrophobicContact CG-CD1 4.26Å; P268-L270 VanDerWaalsContact C-N 3.27Å; P268-L270 PolarHBondContact O-N 2.96Å; P268-L270 VanDerWaalsContact O-N 3.16Å; L270-M273 HydrophobicContact CD2-SD 4.39Å; L270-M273 PolarHBondContact O-N 3.26Å; L270-L274 WeakPolarHBondContact O-CB 3.35Å; L270-L274 PolarHBondContact O-N 3.17Å; L270-I336 HydrophobicContact CD2-CD1 3.4Å; L270-I336 HydrophobicContact CG-CD1 4.11Å
271	Q	96.5	Very high	90	Very high	33 Å²	33	57 Å²	57	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-69	-39.3	178.3	-63.3	-53	-54	0	0	112.1	Y179 L181 I267 P268 L269 L274 L275	Y179-Q271 PolarHBondContact O-NE2 2.98Å; L181-Q271 HydrophobicContact CD1-CG 3.73Å; L181-Q271 HydrophobicContact CD2-CG 3.32Å; L181-Q271 HydrophobicContact CG-CG 3.57Å; L181-Q271 VanDerWaalsContact CG-NE2 3.34Å; I267-Q271 HydrophobicContact CB-CB 4.47Å; I267-Q271 HydrophobicContact CD1-CB 3.89Å; I267-Q271 HydrophobicContact CG1-CB 4.25Å; P268-Q271 HydrophobicContact CB-CG 4.32Å; P268-Q271 WeakPolarHBondContact O-CA 2.96Å; P268-Q271 WeakPolarHBondContact O-CB 3.45Å; P268-Q271 PolarHBondContact O-N 3.35Å; L269-Q271 VanDerWaalsContact C-N 3.27Å; L269-Q271 PolarHBondContact O-N 3.27Å; Q271-L274 WeakPolarHBondContact O-CB 3.32Å; Q271-L274 PolarHBondContact O-N 3.38Å; Q271-L275 WeakPolarHBondContact O-CG 3.35Å; Q271-L275 PolarHBondContact O-N 3.34Å
272	Y	95.8	Very high	91.4	Very high	24 Å²	24	51.9 Å²	51.9	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-42.2	175.4	-172.1	-110.3	0	0	0	111.9	L66 F67 V264 I267 P268 L269 L274 L275 L276	L66-Y272 WeakPolarHBondContact O-CE1 3.3Å; L66-Y272 PolarHBondContact O-OH 2.98Å; F67-Y272 AromaticContact CD1-CD1 3.66Å; F67-Y272 HydrophobicContact CD1-CD1 3.66Å; F67-Y272 AromaticContact CD1-CE1 3.73Å; F67-Y272 HydrophobicContact CD1-CE1 3.73Å; F67-Y272 AromaticContact CE1-CD1 3.69Å; F67-Y272 HydrophobicContact CE1-CD1 3.69Å; F67-Y272 AromaticContact CE1-CE1 3.93Å; F67-Y272 HydrophobicContact CE1-CE1 3.93Å; F67-Y272 HydrophobicContact CG-CE1 4.31Å; V264-Y272 HydrophobicContact CG1-CD1 3.99Å; V264-Y272 HydrophobicContact CG1-CD2 4.05Å; V264-Y272 HydrophobicContact CG1-CE1 3.74Å; V264-Y272 HydrophobicContact CG1-CE2 3.84Å; V264-Y272 HydrophobicContact CG1-CG 4.12Å; I267-Y272 HydrophobicContact CD1-CD2 4.29Å; P268-Y272 PolarHBondContact O-N 3.25Å; L269-Y272 PolarHBondContact O-N 3.48Å; Y272-L274 VanDerWaalsContact C-N 3.3Å; Y272-L274 PolarHBondContact O-N 3.22Å; Y272-L275 HydrophobicContact CD2-CD1 4.49Å; Y272-L275 WeakPolarHBondContact O-CB 3.28Å; Y272-L275 PolarHBondContact O-N 2.92Å; Y272-L276 HydrophobicContact CD1-CD1 4.21Å; Y272-L276 HydrophobicContact CE1-CD1 3.69Å; Y272-L276 HydrophobicContact CE1-CG 4.21Å; Y272-L276 PolarHBondContact O-N 3.28Å; Y272-L276 VanDerWaalsContact O-N 3.08Å
273	M	97.3	Very high	92.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.2	-41.7	171.1	-67.9	172.3	71.5	0	0	111.9	F67 P136 Y179 L269 L270 L276 Q277 L331 C334 I336 L369	F67-M273 HydrophobicContact CE1-CG 3.94Å; F67-M273 HydrophobicContact CZ-CG 4.29Å; P136-M273 HydrophobicContact CG-CE 3.79Å; Y179-M273 HydrophobicContact CE1-CB 4.09Å; L269-M273 HydrophobicContact CD1-CG 4.27Å; L269-M273 HydrophobicContact CD1-SD 4.41Å; L269-M273 HydrophobicContact CG-CG 4.48Å; L269-M273 HydrophobicContact CG-SD 4.08Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 2.95Å; L270-M273 HydrophobicContact CD2-SD 4.39Å; L270-M273 PolarHBondContact O-N 3.26Å; M273-L276 PolarHBondContact O-N 2.87Å; M273-Q277 WeakPolarHBondContact O-CB 3.42Å; M273-Q277 WeakPolarHBondContact O-CG 3.4Å; M273-Q277 PolarHBondContact O-N 2.9Å; M273-L331 HydrophobicContact CE-CD2 4.37Å; M273-C334 VanDerWaalsContact CE-SG 3.51Å; M273-I336 HydrophobicContact CE-CD1 4.38Å; M273-I336 HydrophobicContact CE-CG1 4.4Å; M273-I336 HydrophobicContact SD-CD1 3.89Å; M273-I336 HydrophobicContact SD-CG1 4.13Å; M273-L369 HydrophobicContact CE-CD2 3.87Å; M273-L369 HydrophobicContact CG-CD1 4.43Å; M273-L369 HydrophobicContact SD-CD1 4.31Å; M273-L369 HydrophobicContact SD-CD2 3.74Å
274	L	97.6	Very high	93.5	Very high	15 Å²	15	41.9 Å²	41.9	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-62.6	-42.1	176.6	-178.6	61.5	0	0	0	112.2	G139 F140 Y179 L270 Q271 Y272 L276 Q277 K278	G139-L274 WeakPolarHBondContact O-CD1 3.39Å; F140-L274 HydrophobicContact CB-CD1 3.91Å; Y179-L274 HydrophobicContact CD1-CB 3.8Å; Y179-L274 HydrophobicContact CD1-CD1 4.48Å; Y179-L274 HydrophobicContact CE1-CB 4.16Å; L270-L274 WeakPolarHBondContact O-CB 3.35Å; L270-L274 PolarHBondContact O-N 3.17Å; Q271-L274 WeakPolarHBondContact O-CB 3.32Å; Q271-L274 PolarHBondContact O-N 3.38Å; Y272-L274 VanDerWaalsContact C-N 3.3Å; Y272-L274 PolarHBondContact O-N 3.22Å; L274-L276 VanDerWaalsContact C-N 3.32Å; L274-L276 PolarHBondContact O-N 3.23Å; L274-Q277 PolarHBondContact O-N 3.19Å; L274-K278 HydrophobicContact CD1-CD 4.38Å; L274-K278 HydrophobicContact CD1-CG 4.32Å; L274-K278 HydrophobicContact CG-CD 4.23Å; L274-K278 WeakPolarHBondContact O-CB 3.31Å; L274-K278 WeakPolarHBondContact O-CG 3.37Å; L274-K278 PolarHBondContact O-N 3.45Å
275	L	97	Very high	94.3	Very high	91 Å²	91	43 Å²	43	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	-60.2	-42.7	175.8	-71	177.8	0	0	0	111.4	I267 Q271 Y272	I267-L275 HydrophobicContact CD1-CD1 3.56Å; I267-L275 HydrophobicContact CD1-CG 4.5Å; Q271-L275 WeakPolarHBondContact O-CG 3.35Å; Q271-L275 PolarHBondContact O-N 3.34Å; Y272-L275 HydrophobicContact CD2-CD1 4.49Å; Y272-L275 WeakPolarHBondContact O-CB 3.28Å; Y272-L275 PolarHBondContact O-N 2.92Å
276	L	96.6	Very high	94.8	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-44.5	175.7	-67.5	177.6	0	0	0	111.9	L66 F67 Y272 M273 L274 K278 R279 L331	L66-L276 HydrophobicContact CB-CD1 4.22Å; F67-L276 HydrophobicContact CE1-CD1 3.99Å; F67-L276 HydrophobicContact CE2-CD1 3.97Å; F67-L276 HydrophobicContact CZ-CD1 3.52Å; Y272-L276 HydrophobicContact CD1-CD1 4.21Å; Y272-L276 HydrophobicContact CE1-CD1 3.69Å; Y272-L276 HydrophobicContact CE1-CG 4.21Å; Y272-L276 PolarHBondContact O-N 3.28Å; Y272-L276 VanDerWaalsContact O-N 3.08Å; M273-L276 PolarHBondContact O-N 2.87Å; L274-L276 VanDerWaalsContact C-N 3.32Å; L274-L276 PolarHBondContact O-N 3.23Å; L276-K278 VanDerWaalsContact C-N 3.28Å; L276-K278 PolarHBondContact O-N 3.42Å; L276-R279 VanDerWaalsContact O-CB 3.31Å; L276-R279 WeakPolarHBondContact O-CB 3.33Å; L276-R279 PolarHBondContact O-N 3.32Å; L276-R279 VanDerWaalsContact O-N 3.1Å; L276-L331 HydrophobicContact CB-CD1 3.56Å; L276-L331 HydrophobicContact CD1-CD1 4.19Å
277	Q	97.5	Very high	95.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-40	177.1	-77.4	-174.8	-2.6	0	0	112.2	K137 F140 Y179 M273 L274 R279 D280 T328 L331	K137-Q277 PolarHBondContact O-NE2 2.96Å; F140-Q277 HydrophobicContact CD1-CB 3.99Å; F140-Q277 HydrophobicContact CE1-CB 3.86Å; F140-Q277 WeakPolarHBondContact CE1-O 3.45Å; Y179-Q277 PolarHBondContact OH-NE2 3.47Å; M273-Q277 WeakPolarHBondContact O-CB 3.42Å; M273-Q277 WeakPolarHBondContact O-CG 3.4Å; M273-Q277 PolarHBondContact O-N 2.9Å; L274-Q277 PolarHBondContact O-N 3.19Å; Q277-R279 PolarHBondContact O-N 2.93Å; Q277-D280 PolarHBondContact O-N 3.44Å; Q277-T328 WeakPolarHBondContact CA-OG1 3.48Å; Q277-T328 HydrophobicContact CB-CG2 4.34Å; Q277-T328 HydrophobicContact CG-CG2 4.42Å; Q277-T328 PolarHBondContact O-OG1 3.43Å; Q277-L331 HydrophobicContact CG-CB 3.89Å; Q277-L331 HydrophobicContact CG-CD1 4.11Å; Q277-L331 PolarHBondContact NE2-O 3.46Å
278	K	96.7	Very high	95.6	Very high	116 Å²	116	35.8 Å²	35.8	50%	0.504	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.7	179	-75.9	178.9	176.4	178.3	0	114.2	F140 L274 L276 D280	F140-K278 HydrophobicContact CB-CG 4.1Å; F140-K278 HydrophobicContact CD1-CG 4.18Å; F140-K278 HydrophobicContact CD2-CG 4.46Å; F140-K278 HydrophobicContact CG-CG 4.02Å; L274-K278 HydrophobicContact CD1-CD 4.38Å; L274-K278 HydrophobicContact CD1-CG 4.32Å; L274-K278 HydrophobicContact CG-CD 4.23Å; L274-K278 WeakPolarHBondContact O-CB 3.31Å; L274-K278 WeakPolarHBondContact O-CG 3.37Å; L274-K278 PolarHBondContact O-N 3.45Å; L276-K278 VanDerWaalsContact C-N 3.28Å; L276-K278 PolarHBondContact O-N 3.42Å; K278-D280 PolarHBondContact O-N 3.45Å
279	R	95.5	Very high	95.7	Very high	137 Å²	137	43.1 Å²	43.1	52%	0.517	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-19.1	171	-63.4	-176.6	175.3	-173.5	-0.7	112.3	L276 Q277 I281 R324	L276-R279 VanDerWaalsContact O-CB 3.31Å; L276-R279 WeakPolarHBondContact O-CB 3.33Å; L276-R279 PolarHBondContact O-N 3.32Å; L276-R279 VanDerWaalsContact O-N 3.1Å; Q277-R279 PolarHBondContact O-N 2.93Å; R279-I281 PolarHBondContact O-N 3.43Å; R279-I281 VanDerWaalsContact O-N 3.14Å; R279-R324 HydrophobicContact CB-CG 4.26Å; R279-R324 WeakPolarHBondContact O-CD 3.38Å
280	D	94.7	Very high	95.7	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.032	22%	0.215	C	C	.	.			trans	-74.4	96.6	168.6	178.5	18.7	0	0	0	110	Q277 K278 E282 G283 S325 T328	Q277-D280 PolarHBondContact O-N 3.44Å; K278-D280 PolarHBondContact O-N 3.45Å; D280-E282 PolarHBondContact OD1-N 3.21Å; D280-G283 PolarHBondContact OD1-N 2.9Å; D280-S325 PolarHBondContact OD1-OG 3.23Å; D280-T328 HydrophobicContact CB-CG2 4.06Å; D280-T328 WeakPolarHBondContact CB-OG1 3.43Å
281	I	90.7	Very high	95.6	Very high	129 Å²	129	44.3 Å²	44.3	66%	0.662	21%	0.214	S	C	*	.			trans	-86.3	-17.7	179.9	60.7	172.9	0	0	0	113.3	R279	R279-I281 PolarHBondContact O-N 3.43Å; R279-I281 VanDerWaalsContact O-N 3.14Å
282	E	91.8	Very high	95.5	Very high	69 Å²	69	48.2 Å²	48.2	32%	0.322	23%	0.23	S	C	.	.	S	Bend	trans	-77.1	-43.2	-177.8	-60.2	-63.8	165.9	0	0	110.6	D280 A286 I287 N321	D280-E282 PolarHBondContact OD1-N 3.21Å; E282-A286 HydrophobicContact CB-CB 4.16Å; E282-A286 WeakPolarHBondContact O-CB 3.46Å; E282-I287 HydrophobicContact CB-CB 4.18Å; E282-I287 HydrophobicContact CG-CD1 4.39Å; E282-N321 HydrophobicContact CG-CB 4.19Å; E282-N321 PolarHBondContact OE1-ND2 3.4Å
283	G	92.3	Very high	95.4	Very high	3 Å²	3	51.1 Å²	51.1	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	72.8	177.1	-171.1	0	0	0	0	0	112.8	D280 F285 I287	D280-G283 PolarHBondContact OD1-N 2.9Å; G283-F285 PolarHBondContact O-N 2.92Å; G283-I287 VanDerWaalsContact O-CG2 3.24Å; G283-I287 WeakPolarHBondContact O-CG2 3.49Å; G283-I287 PolarHBondContact O-N 3.5Å
284	P	95.3	Very high	95.2	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.013	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-38.1	-162.3	22.3	-32.9	0	0	0	114.9	S288 Y383 A384 L387	P284-S288 VanDerWaalsContact O-CB 3.23Å; P284-S288 WeakPolarHBondContact O-CB 3.3Å; P284-S288 PolarHBondContact O-N 2.82Å; P284-Y383 HydrophobicContact CB-CD1 4.08Å; P284-Y383 HydrophobicContact CB-CE1 3.82Å; P284-A384 WeakPolarHBondContact O-CB 3.33Å; P284-L387 HydrophobicContact CB-CD1 3.84Å; P284-L387 HydrophobicContact CG-CD1 3.85Å
285	F	96.8	Very high	94.9	Very high	45 Å²	45	53.5 Å²	53.5	20%	0.197	26%	0.257	C	S	.	.	H	α-helix	trans	-78.8	-45.3	-173.4	-52.6	-61.7	0	0	0	112.2	L145 G283 S288 K289 A384 L387 E388 L391	L145-F285 HydrophobicContact CB-CE2 4.36Å; L145-F285 HydrophobicContact CD1-CE2 3.84Å; L145-F285 HydrophobicContact CD1-CZ 3.71Å; G283-F285 PolarHBondContact O-N 2.92Å; F285-S288 PolarHBondContact O-N 3.01Å; F285-K289 PolarHBondContact O-N 3.17Å; F285-A384 HydrophobicContact CD1-CB 4.36Å; F285-L387 HydrophobicContact CE1-CB 4.04Å; F285-L387 HydrophobicContact CZ-CB 4.19Å; F285-E388 HydrophobicContact CD1-CG 4.12Å; F285-E388 HydrophobicContact CE1-CG 3.77Å; F285-L391 HydrophobicContact CZ-CD1 3.89Å
286	A	96.3	Very high	94.6	Very high	43 Å²	43	54.7 Å²	54.7	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-44.3	179.4	0	0	0	0	0	111.2	E282 S288 K289 C290	E282-A286 HydrophobicContact CB-CB 4.16Å; E282-A286 WeakPolarHBondContact O-CB 3.46Å; A286-S288 VanDerWaalsContact C-N 3.35Å; A286-S288 PolarHBondContact O-N 3.47Å; A286-K289 PolarHBondContact O-N 2.92Å; A286-C290 PolarHBondContact O-N 3.38Å
287	I	95.4	Very high	94.3	Very high	6 Å²	6	61.3 Å²	61.3	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-35.7	177.8	-162.1	70.2	0	0	0	112.5	E282 G283 K289 C290 F291 S325 L380	E282-I287 HydrophobicContact CB-CB 4.18Å; E282-I287 HydrophobicContact CG-CD1 4.39Å; G283-I287 VanDerWaalsContact O-CG2 3.24Å; G283-I287 WeakPolarHBondContact O-CG2 3.49Å; G283-I287 PolarHBondContact O-N 3.5Å; I287-K289 VanDerWaalsContact C-N 3.35Å; I287-K289 PolarHBondContact O-N 3.23Å; I287-C290 HydrophobicContact CD1-CB 4.4Å; I287-C290 WeakPolarHBondContact O-CB 3.47Å; I287-C290 PolarHBondContact O-N 3.36Å; I287-F291 HydrophobicContact CD1-CE2 4.04Å; I287-F291 HydrophobicContact CD1-CZ 4.32Å; I287-F291 HydrophobicContact CG1-CD2 3.78Å; I287-F291 HydrophobicContact CG1-CE2 3.39Å; I287-F291 HydrophobicContact CG1-CZ 4.14Å; I287-F291 WeakPolarHBondContact O-CD2 3.41Å; I287-F291 PolarHBondContact O-N 2.86Å; I287-S325 WeakPolarHBondContact CD1-OG 3.44Å; I287-S325 WeakPolarHBondContact CG1-OG 3.16Å; I287-L380 HydrophobicContact CG2-CD2 4.5Å
288	S	96.8	Very high	93.8	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-44.8	173.7	174.5	0	0	0	0	111.5	P284 F285 A286 C290 F291 K292	P284-S288 VanDerWaalsContact O-CB 3.23Å; P284-S288 WeakPolarHBondContact O-CB 3.3Å; P284-S288 PolarHBondContact O-N 2.82Å; F285-S288 PolarHBondContact O-N 3.01Å; A286-S288 VanDerWaalsContact C-N 3.35Å; A286-S288 PolarHBondContact O-N 3.47Å; S288-C290 VanDerWaalsContact C-N 3.34Å; S288-C290 PolarHBondContact O-N 3.18Å; S288-F291 PolarHBondContact O-N 3.31Å; S288-K292 WeakPolarHBondContact O-CG 3.33Å; S288-K292 PolarHBondContact O-N 3.38Å
289	K	97	Very high	93.3	Very high	165 Å²	165	61.8 Å²	61.8	72%	0.717	29%	0.288	S	S	*	.	H	α-helix	trans	-60.9	-43.5	174.7	-174	179.2	178.6	-178.9	0	111.7	F285 A286 I287 K292 E293	F285-K289 PolarHBondContact O-N 3.17Å; A286-K289 PolarHBondContact O-N 2.92Å; I287-K289 VanDerWaalsContact C-N 3.35Å; I287-K289 PolarHBondContact O-N 3.23Å; K289-K292 PolarHBondContact O-N 3.44Å; K289-E293 PolarHBondContact O-N 2.91Å; K289-E293 VanDerWaalsContact O-N 3.16Å
290	C	95.2	Very high	92.9	Very high	40 Å²	40	61.2 Å²	61.2	27%	0.27	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-47.7	176.2	179.6	0	0	0	0	111.8	A286 I287 S288 E293 L294	A286-C290 PolarHBondContact O-N 3.38Å; I287-C290 HydrophobicContact CD1-CB 4.4Å; I287-C290 WeakPolarHBondContact O-CB 3.47Å; I287-C290 PolarHBondContact O-N 3.36Å; S288-C290 VanDerWaalsContact C-N 3.34Å; S288-C290 PolarHBondContact O-N 3.18Å; C290-E293 PolarHBondContact O-N 3.42Å; C290-L294 WeakPolarHBondContact O-CG 3.36Å; C290-L294 PolarHBondContact O-N 3.04Å
291	F	95	Very high	92.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.4	-76.8	-48.9	0	0	0	113.3	I287 S288 E293 L294 M295 F311 A322 M326 P377 L380 V381	I287-F291 HydrophobicContact CD1-CE2 4.04Å; I287-F291 HydrophobicContact CD1-CZ 4.32Å; I287-F291 HydrophobicContact CG1-CD2 3.78Å; I287-F291 HydrophobicContact CG1-CE2 3.39Å; I287-F291 HydrophobicContact CG1-CZ 4.14Å; I287-F291 WeakPolarHBondContact O-CD2 3.41Å; I287-F291 PolarHBondContact O-N 2.86Å; S288-F291 PolarHBondContact O-N 3.31Å; F291-E293 VanDerWaalsContact C-N 3.27Å; F291-E293 PolarHBondContact O-N 3.22Å; F291-L294 HydrophobicContact CD1-CD1 4.21Å; F291-L294 PolarHBondContact O-N 2.93Å; F291-M295 WeakPolarHBondContact O-CB 3.3Å; F291-M295 WeakPolarHBondContact O-CG 3.2Å; F291-M295 PolarHBondContact O-N 2.78Å; F291-F311 AromaticContact CE1-CE1 3.84Å; F291-F311 HydrophobicContact CE1-CE1 3.84Å; F291-F311 AromaticContact CE1-CZ 3.73Å; F291-F311 HydrophobicContact CE1-CZ 3.73Å; F291-A322 HydrophobicContact CE1-CB 3.78Å; F291-A322 HydrophobicContact CZ-CB 3.74Å; F291-M326 HydrophobicContact CZ-CE 4.36Å; F291-M326 HydrophobicContact CZ-CG 4.4Å; F291-P377 HydrophobicContact CB-CB 4.15Å; F291-P377 HydrophobicContact CD1-CB 3.66Å; F291-P377 HydrophobicContact CD1-CG 3.98Å; F291-P377 HydrophobicContact CD2-CB 4.42Å; F291-P377 HydrophobicContact CE1-CB 4.15Å; F291-P377 HydrophobicContact CE1-CG 4.02Å; F291-P377 HydrophobicContact CG-CB 3.83Å; F291-L380 HydrophobicContact CD2-CB 4.02Å; F291-L380 HydrophobicContact CD2-CD2 4.36Å; F291-L380 HydrophobicContact CE2-CB 4.06Å; F291-L380 HydrophobicContact CE2-CD2 3.58Å; F291-L380 HydrophobicContact CE2-CG 4.33Å; F291-L380 HydrophobicContact CZ-CD2 4.45Å; F291-V381 HydrophobicContact CB-CG2 3.85Å
292	K	94.9	Very high	92	Very high	115 Å²	115	61.2 Å²	61.2	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-56.7	-43.1	174.4	-74.1	178.3	-177.8	-176.2	0	111.7	S288 K289 K296 V381	S288-K292 WeakPolarHBondContact O-CG 3.33Å; S288-K292 PolarHBondContact O-N 3.38Å; K289-K292 PolarHBondContact O-N 3.44Å; K292-K296 WeakPolarHBondContact O-CB 3.3Å; K292-K296 PolarHBondContact O-N 2.87Å; K292-V381 HydrophobicContact CD-CG1 4.4Å; K292-V381 VanDerWaalsContact CE-CG1 3.43Å; K292-V381 HydrophobicContact CG-CG1 4.08Å; K292-V381 HydrophobicContact CG-CG2 4.02Å
293	E	93.7	Very high	91.2	Very high	85 Å²	85	59 Å²	59	40%	0.397	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-44.3	176.8	178.4	62.8	-163.5	0	0	112.1	K289 C290 F291 K296 R297	K289-E293 PolarHBondContact O-N 2.91Å; K289-E293 VanDerWaalsContact O-N 3.16Å; C290-E293 PolarHBondContact O-N 3.42Å; F291-E293 VanDerWaalsContact C-N 3.27Å; F291-E293 PolarHBondContact O-N 3.22Å; E293-K296 PolarHBondContact O-N 3.03Å; E293-R297 WeakPolarHBondContact O-CG 3.5Å; E293-R297 PolarHBondContact O-N 3.47Å; E293-R297 IonicContact OE1-CZ 3.88Å; E293-R297 VanDerWaalsContact OE1-CZ 3.26Å; E293-R297 IonicContact OE1-NE 2.78Å; E293-R297 PolarHBondContact OE1-NE 3.42Å; E293-R297 IonicContact OE1-NH2 2.68Å; E293-R297 PolarHBondContact OE1-NH2 3.05Å
294	L	92.2	Very high	90	Very high	8 Å²	8	61.7 Å²	61.7	4%	0.042	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-40.9	178.1	-68.3	174.2	0	0	0	112.5	C290 F291 R297 S298 I310 F311 T314 V318	C290-L294 WeakPolarHBondContact O-CG 3.36Å; C290-L294 PolarHBondContact O-N 3.04Å; F291-L294 HydrophobicContact CD1-CD1 4.21Å; F291-L294 PolarHBondContact O-N 2.93Å; L294-R297 PolarHBondContact O-N 3.43Å; L294-S298 PolarHBondContact O-N 3.43Å; L294-S298 VanDerWaalsContact O-N 3.08Å; L294-I310 HydrophobicContact CB-CD1 4.28Å; L294-I310 HydrophobicContact CB-CG1 3.92Å; L294-F311 HydrophobicContact CD1-CD1 4.1Å; L294-F311 HydrophobicContact CD1-CE1 3.93Å; L294-T314 HydrophobicContact CD2-CG2 3.99Å; L294-T314 WeakPolarHBondContact CD2-OG1 3.22Å; L294-V318 HydrophobicContact CD1-CG1 4.35Å
295	M	91.7	Very high	88.6	Confident	58 Å²	58	67.2 Å²	67.2	29%	0.286	37%	0.374	S	S	.	.	H	α-helix	trans	-60.9	-48.8	175.4	-70.3	174.4	64	0	0	110.6	F291 R297 S298 E299 I310 P377	F291-M295 WeakPolarHBondContact O-CB 3.3Å; F291-M295 WeakPolarHBondContact O-CG 3.2Å; F291-M295 PolarHBondContact O-N 2.78Å; M295-R297 VanDerWaalsContact C-N 3.34Å; M295-R297 PolarHBondContact O-N 3.43Å; M295-S298 WeakPolarHBondContact O-CB 3.48Å; M295-S298 PolarHBondContact O-N 3.45Å; M295-S298 VanDerWaalsContact O-N 3.1Å; M295-E299 WeakPolarHBondContact O-CG 3.22Å; M295-E299 PolarHBondContact O-N 3.18Å; M295-I310 HydrophobicContact CB-CD1 4.45Å; M295-I310 HydrophobicContact CG-CD1 3.5Å; M295-I310 VanDerWaalsContact CG-CD1 3.5Å; M295-I310 HydrophobicContact CG-CG1 4.47Å; M295-P377 HydrophobicContact SD-CB 4.27Å
296	K	91.1	Very high	87.3	Confident	115 Å²	115	67.3 Å²	67.3	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-57.8	-44.2	177.5	-174.2	-176.8	176.1	-173.3	0	112.3	K292 E293 S298 E299 D300	K292-K296 WeakPolarHBondContact O-CB 3.3Å; K292-K296 PolarHBondContact O-N 2.87Å; E293-K296 PolarHBondContact O-N 3.03Å; K296-S298 VanDerWaalsContact C-N 3.31Å; K296-S298 PolarHBondContact O-N 3.22Å; K296-E299 WeakPolarHBondContact O-CB 3.4Å; K296-E299 PolarHBondContact O-N 3.5Å; K296-D300 VanDerWaalsContact O-CG 3.29Å; K296-D300 PolarHBondContact O-N 3.12Å
297	R	88.8	Confident	85.8	Confident	141 Å²	141	69.3 Å²	69.3	53%	0.532	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-37.8	176.4	-71.8	175.1	-171.7	-164.2	0.2	113	E293 L294 M295 A301	E293-R297 WeakPolarHBondContact O-CG 3.5Å; E293-R297 PolarHBondContact O-N 3.47Å; E293-R297 IonicContact OE1-CZ 3.88Å; E293-R297 VanDerWaalsContact OE1-CZ 3.26Å; E293-R297 IonicContact OE1-NE 2.78Å; E293-R297 PolarHBondContact OE1-NE 3.42Å; E293-R297 IonicContact OE1-NH2 2.68Å; E293-R297 PolarHBondContact OE1-NH2 3.05Å; L294-R297 PolarHBondContact O-N 3.43Å; M295-R297 VanDerWaalsContact C-N 3.34Å; M295-R297 PolarHBondContact O-N 3.43Å; R297-A301 VanDerWaalsContact O-CB 3.28Å; R297-A301 WeakPolarHBondContact O-CB 3.41Å; R297-A301 PolarHBondContact O-N 2.93Å
298	S	87.6	Confident	84.5	Confident	12 Å²	12	74.3 Å²	74.3	8%	0.084	42%	0.417	C	S	.	.	H	α-helix	trans	-67.3	-38.7	175.8	-168	0	0	0	0	111.5	L294 M295 K296 A301 G302 T303 A304	L294-S298 PolarHBondContact O-N 3.43Å; L294-S298 VanDerWaalsContact O-N 3.08Å; M295-S298 WeakPolarHBondContact O-CB 3.48Å; M295-S298 PolarHBondContact O-N 3.45Å; M295-S298 VanDerWaalsContact O-N 3.1Å; K296-S298 VanDerWaalsContact C-N 3.31Å; K296-S298 PolarHBondContact O-N 3.22Å; S298-A301 PolarHBondContact O-N 2.93Å; S298-G302 PolarHBondContact O-N 3.07Å; S298-T303 PolarHBondContact O-N 3.15Å; S298-T303 PolarHBondContact O-OG1 2.71Å; S298-T303 VanDerWaalsContact O-OG1 3.09Å; S298-T303 VanDerWaalsContact OG-C 3.27Å; S298-T303 PolarHBondContact OG-O 3.45Å; S298-T303 PolarHBondContact OG-OG1 2.78Å; S298-A304 PolarHBondContact O-N 3.19Å
299	E	87.5	Confident	83.5	Confident	114 Å²	114	79.6 Å²	79.6	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-62.9	-50.2	173.1	-70.9	166.9	-163.7	0	0	111.7	M295 K296 A301 G302 A304	M295-E299 WeakPolarHBondContact O-CG 3.22Å; M295-E299 PolarHBondContact O-N 3.18Å; K296-E299 WeakPolarHBondContact O-CB 3.4Å; K296-E299 PolarHBondContact O-N 3.5Å; E299-A301 PolarHBondContact O-N 2.94Å; E299-G302 PolarHBondContact O-N 3.42Å; E299-A304 HydrophobicContact CB-CB 4.43Å; E299-A304 HydrophobicContact CG-CB 3.72Å
300	D	87	Confident	82.9	Confident	125 Å²	125	72.5 Å²	72.5	67%	0.668	41%	0.406	S	S	*	.	H	α-helix	trans	-60.9	-29.7	178.1	-67	-24.3	0	0	0	112.2	K296 G302	K296-D300 VanDerWaalsContact O-CG 3.29Å; K296-D300 PolarHBondContact O-N 3.12Å; D300-G302 VanDerWaalsContact C-N 3.34Å
301	A	85	Confident	82.4	Confident	71 Å²	71	72.5 Å²	72.5	59%	0.587	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.8	176.2	0	0	0	0	0	114.2	R297 S298 E299 T303	R297-A301 VanDerWaalsContact O-CB 3.28Å; R297-A301 WeakPolarHBondContact O-CB 3.41Å; R297-A301 PolarHBondContact O-N 2.93Å; S298-A301 PolarHBondContact O-N 2.93Å; E299-A301 PolarHBondContact O-N 2.94Å; A301-T303 VanDerWaalsContact C-N 3.29Å; A301-T303 PolarHBondContact O-N 3.14Å
302	G	79.9	Confident	81.9	Confident	65 Å²	65	77.5 Å²	77.5	67%	0.67	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	20.5	-177.1	0	0	0	0	0	114.3	S298 E299 D300	S298-G302 PolarHBondContact O-N 3.07Å; E299-G302 PolarHBondContact O-N 3.42Å; D300-G302 VanDerWaalsContact C-N 3.34Å
303	T	74.9	Confident	81.4	Confident	21 Å²	21	79.5 Å²	79.5	13%	0.129	44%	0.441	C	S	.	.			trans	-110.5	13.7	-177.5	56.5	0	0	0	0	113.6	S298 A301 S305 D306	S298-T303 PolarHBondContact O-N 3.15Å; S298-T303 PolarHBondContact O-OG1 2.71Å; S298-T303 VanDerWaalsContact O-OG1 3.09Å; S298-T303 VanDerWaalsContact OG-C 3.27Å; S298-T303 PolarHBondContact OG-O 3.45Å; S298-T303 PolarHBondContact OG-OG1 2.78Å; A301-T303 VanDerWaalsContact C-N 3.29Å; A301-T303 PolarHBondContact O-N 3.14Å; T303-S305 PolarHBondContact O-N 3.4Å; T303-S305 VanDerWaalsContact O-N 3.14Å; T303-D306 PolarHBondContact O-N 2.76Å; T303-D306 VanDerWaalsContact O-N 3.07Å
304	A	68.4	Low	81.2	Confident	61 Å²	61	76.1 Å²	76.1	50%	0.504	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.7	-175.6	0	0	0	0	0	114.5	S298 E299 D306	S298-A304 PolarHBondContact O-N 3.19Å; E299-A304 HydrophobicContact CB-CB 4.43Å; E299-A304 HydrophobicContact CG-CB 3.72Å; A304-D306 VanDerWaalsContact C-N 3.27Å; A304-D306 PolarHBondContact O-N 2.96Å
305	S	65.9	Low	81.2	Confident	117 Å²	117	79.3 Å²	79.3	82%	0.818	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.9	-179.5	54.7	0	0	0	0	114.1	T303 P307	T303-S305 PolarHBondContact O-N 3.4Å; T303-S305 VanDerWaalsContact O-N 3.14Å; S305-P307 WeakPolarHBondContact O-CD 3.3Å
306	D	68.6	Low	81.3	Confident	48 Å²	48	79.7 Å²	79.7	26%	0.257	46%	0.459	S	S	.	.			trans	-110	99.6	-179.3	-175.1	-10	0	0	0	110.1	T303 A304 T308 R309	T303-D306 PolarHBondContact O-N 2.76Å; T303-D306 VanDerWaalsContact O-N 3.07Å; A304-D306 VanDerWaalsContact C-N 3.27Å; A304-D306 PolarHBondContact O-N 2.96Å; D306-T308 VanDerWaalsContact CG-OG1 3.27Å; D306-T308 PolarHBondContact O-N 3.08Å; D306-T308 VanDerWaalsContact O-N 3.07Å; D306-T308 VanDerWaalsContact OD1-CB 3.3Å; D306-T308 WeakPolarHBondContact OD1-CB 3.35Å; D306-T308 WeakPolarHBondContact OD1-CG2 2.94Å; D306-T308 PolarHBondContact OD1-N 3.34Å; D306-T308 PolarHBondContact OD1-OG1 3.14Å; D306-T308 PolarHBondContact OD2-OG1 3.21Å; D306-R309 HydrophobicContact CB-CB 4.38Å; D306-R309 HydrophobicContact CB-CG 4.08Å; D306-R309 PolarHBondContact O-N 3.35Å; D306-R309 WeakPolarHBondContact OD2-CD 3.37Å; D306-R309 WeakPolarHBondContact OD2-CG 3.46Å; D306-R309 IonicContact OD2-CZ 3.17Å; D306-R309 IonicContact OD2-NE 2.71Å; D306-R309 PolarHBondContact OD2-NE 3.27Å
307	P	66.1	Low	81.4	Confident	84 Å²	84	77.8 Å²	77.8	55%	0.545	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-58.2	-24.2	179.4	-21.7	32.1	0	0	0	113.2	S305 R309 I310	S305-P307 WeakPolarHBondContact O-CD 3.3Å; P307-R309 VanDerWaalsContact C-N 3.26Å; P307-R309 PolarHBondContact O-N 2.88Å; P307-I310 VanDerWaalsContact O-CG2 3.22Å; P307-I310 WeakPolarHBondContact O-CG2 3.45Å
308	T	68	Low	81.5	Confident	111 Å²	111	73.1 Å²	73.1	68%	0.681	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-71.8	-23.9	-179.1	75.4	0	0	0	0	112.2	D306	D306-T308 VanDerWaalsContact CG-OG1 3.27Å; D306-T308 PolarHBondContact O-N 3.08Å; D306-T308 VanDerWaalsContact O-N 3.07Å; D306-T308 VanDerWaalsContact OD1-CB 3.3Å; D306-T308 WeakPolarHBondContact OD1-CB 3.35Å; D306-T308 WeakPolarHBondContact OD1-CG2 2.94Å; D306-T308 PolarHBondContact OD1-N 3.34Å; D306-T308 PolarHBondContact OD1-OG1 3.14Å; D306-T308 PolarHBondContact OD2-OG1 3.21Å
309	R	75.9	Confident	81.7	Confident	116 Å²	116	78.8 Å²	78.8	44%	0.438	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-85.6	-9.1	-178.7	-68.6	-177.3	-171.6	-151.3	-0.9	114.5	D306 P307 F311 Q312	D306-R309 HydrophobicContact CB-CB 4.38Å; D306-R309 HydrophobicContact CB-CG 4.08Å; D306-R309 PolarHBondContact O-N 3.35Å; D306-R309 WeakPolarHBondContact OD2-CD 3.37Å; D306-R309 WeakPolarHBondContact OD2-CG 3.46Å; D306-R309 IonicContact OD2-CZ 3.17Å; D306-R309 IonicContact OD2-NE 2.71Å; D306-R309 PolarHBondContact OD2-NE 3.27Å; P307-R309 VanDerWaalsContact C-N 3.26Å; P307-R309 PolarHBondContact O-N 2.88Å; R309-F311 PolarHBondContact O-N 3.45Å; R309-Q312 HydrophobicContact CB-CB 4.48Å; R309-Q312 WeakPolarHBondContact O-CB 3.34Å; R309-Q312 PolarHBondContact O-N 3.08Å
310	I	83	Confident	82	Confident	15 Å²	15	74.9 Å²	74.9	8%	0.077	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-57.6	-25.9	178.1	-159.6	-178.1	0	0	0	112.8	L294 M295 P307 P377	L294-I310 HydrophobicContact CB-CD1 4.28Å; L294-I310 HydrophobicContact CB-CG1 3.92Å; M295-I310 HydrophobicContact CB-CD1 4.45Å; M295-I310 HydrophobicContact CG-CD1 3.5Å; M295-I310 VanDerWaalsContact CG-CD1 3.5Å; M295-I310 HydrophobicContact CG-CG1 4.47Å; P307-I310 VanDerWaalsContact O-CG2 3.22Å; P307-I310 WeakPolarHBondContact O-CG2 3.45Å; I310-P377 HydrophobicContact CD1-CB 3.85Å; I310-P377 HydrophobicContact CD1-CG 3.7Å
311	F	85.4	Confident	82.4	Confident	41 Å²	41	70.2 Å²	70.2	18%	0.18	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-100.6	5	177.6	-60.7	-65.3	0	0	0	113.7	F291 L294 R309 T314 R319 A322 M326	F291-F311 AromaticContact CE1-CE1 3.84Å; F291-F311 HydrophobicContact CE1-CE1 3.84Å; F291-F311 AromaticContact CE1-CZ 3.73Å; F291-F311 HydrophobicContact CE1-CZ 3.73Å; L294-F311 HydrophobicContact CD1-CD1 4.1Å; L294-F311 HydrophobicContact CD1-CE1 3.93Å; R309-F311 PolarHBondContact O-N 3.45Å; F311-T314 VanDerWaalsContact O-CB 3.22Å; F311-T314 WeakPolarHBondContact O-CB 3.14Å; F311-T314 PolarHBondContact O-N 3.2Å; F311-T314 PolarHBondContact O-OG1 3.05Å; F311-R319 HydrophobicContact CB-CG 4.1Å; F311-R319 HydrophobicContact CD1-CG 4.27Å; F311-R319 HydrophobicContact CG-CG 4.48Å; F311-A322 HydrophobicContact CD1-CB 4.43Å; F311-A322 HydrophobicContact CE1-CB 3.45Å; F311-A322 VanDerWaalsContact CE1-CB 3.45Å; F311-A322 HydrophobicContact CZ-CB 3.89Å; F311-M326 HydrophobicContact CE1-CE 4.42Å; F311-M326 HydrophobicContact CE2-CE 3.8Å; F311-M326 HydrophobicContact CZ-CE 3.42Å; F311-M326 VanDerWaalsContact CZ-CE 3.42Å
312	Q	84.4	Confident	82.8	Confident	104 Å²	104	66.9 Å²	66.9	49%	0.486	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	139.1	177.3	-167.4	172.5	3.5	0	0	109.5	R309 T314	R309-Q312 HydrophobicContact CB-CB 4.48Å; R309-Q312 WeakPolarHBondContact O-CB 3.34Å; R309-Q312 PolarHBondContact O-N 3.08Å; Q312-T314 PolarHBondContact O-N 3.15Å; Q312-T314 PolarHBondContact O-OG1 2.88Å
313	N	85.1	Confident	83.4	Confident	158 Å²	158	67.8 Å²	67.8	85%	0.845	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	17.3	-177.4	-55.1	-32.7	0	0	0	115
314	T	89.1	Confident	84.4	Confident	14 Å²	14	71.5 Å²	71.5	9%	0.086	40%	0.403	C	S	.	.			trans	-88.7	133.7	179.7	-62.1	0	0	0	0	110.5	L294 F311 Q312 V318 R319	L294-T314 HydrophobicContact CD2-CG2 3.99Å; L294-T314 WeakPolarHBondContact CD2-OG1 3.22Å; F311-T314 VanDerWaalsContact O-CB 3.22Å; F311-T314 WeakPolarHBondContact O-CB 3.14Å; F311-T314 PolarHBondContact O-N 3.2Å; F311-T314 PolarHBondContact O-OG1 3.05Å; Q312-T314 PolarHBondContact O-N 3.15Å; Q312-T314 PolarHBondContact O-OG1 2.88Å; T314-V318 HydrophobicContact CG2-CB 3.6Å; T314-V318 HydrophobicContact CG2-CG1 3.46Å; T314-V318 VanDerWaalsContact CG2-CG1 3.46Å; T314-R319 HydrophobicContact CG2-CG 3.86Å; T314-R319 PolarHBondContact O-NE 3.32Å
315	P	92.5	Very high	85.7	Confident	75 Å²	75	68.7 Å²	68.7	49%	0.487	38%	0.379	S	S	.	.			trans	-51.2	143.8	177.2	-27.7	34.7	0	0	0	112.6	S317 V318 R319	P315-S317 PolarHBondContact O-N 3.47Å; P315-V318 HydrophobicContact CB-CG2 4.26Å; P315-V318 HydrophobicContact CG-CG2 4.44Å; P315-V318 PolarHBondContact O-N 3.23Å; P315-V318 VanDerWaalsContact O-N 3.08Å; P315-R319 PolarHBondContact O-N 3.23Å; P315-R319 VanDerWaalsContact O-N 3.08Å
316	A	92.9	Very high	87.1	Confident	65 Å²	65	63.5 Å²	63.5	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-57.4	-35.5	-177.1	0	0	0	0	0	113.1	R319 A320	A316-R319 PolarHBondContact O-N 3.2Å; A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 3.19Å
317	S	92.9	Very high	88.4	Confident	76 Å²	76	62.3 Å²	62.3	53%	0.531	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-44	176	52.6	0	0	0	0	112.6	P315 A320 N321	P315-S317 PolarHBondContact O-N 3.47Å; S317-A320 PolarHBondContact O-N 3.16Å; S317-N321 PolarHBondContact O-N 3.41Å
318	V	92.3	Very high	89.9	Confident	43 Å²	43	58.3 Å²	58.3	26%	0.261	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-43.8	178.4	176.7	0	0	0	0	110.4	L294 T314 P315 A320 N321 A322	L294-V318 HydrophobicContact CD1-CG1 4.35Å; T314-V318 HydrophobicContact CG2-CB 3.6Å; T314-V318 HydrophobicContact CG2-CG1 3.46Å; T314-V318 VanDerWaalsContact CG2-CG1 3.46Å; P315-V318 HydrophobicContact CB-CG2 4.26Å; P315-V318 HydrophobicContact CG-CG2 4.44Å; P315-V318 PolarHBondContact O-N 3.23Å; P315-V318 VanDerWaalsContact O-N 3.08Å; V318-A320 VanDerWaalsContact C-N 3.32Å; V318-A320 PolarHBondContact O-N 2.89Å; V318-N321 PolarHBondContact O-N 3.08Å; V318-A322 WeakPolarHBondContact O-CB 3.03Å; V318-A322 PolarHBondContact O-N 2.94Å
319	R	91.8	Very high	91.3	Very high	130 Å²	130	53.2 Å²	53.2	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-59.4	-42.6	174.2	-66.9	-170.4	-70.6	147.9	1.4	111.9	F311 T314 P315 A316 A322 L323	F311-R319 HydrophobicContact CB-CG 4.1Å; F311-R319 HydrophobicContact CD1-CG 4.27Å; F311-R319 HydrophobicContact CG-CG 4.48Å; T314-R319 HydrophobicContact CG2-CG 3.86Å; T314-R319 PolarHBondContact O-NE 3.32Å; P315-R319 PolarHBondContact O-N 3.23Å; P315-R319 VanDerWaalsContact O-N 3.08Å; A316-R319 PolarHBondContact O-N 3.2Å; R319-A322 PolarHBondContact O-N 3.35Å; R319-L323 WeakPolarHBondContact O-CB 3.34Å; R319-L323 PolarHBondContact O-N 3.47Å
320	A	93.7	Very high	92.3	Very high	33 Å²	33	47.7 Å²	47.7	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-64.1	-42	177.2	0	0	0	0	0	112.3	A316 S317 V318 L323 R324	A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 3.19Å; S317-A320 PolarHBondContact O-N 3.16Å; V318-A320 VanDerWaalsContact C-N 3.32Å; V318-A320 PolarHBondContact O-N 2.89Å; A320-L323 PolarHBondContact O-N 2.91Å; A320-R324 VanDerWaalsContact O-CG 3.28Å; A320-R324 WeakPolarHBondContact O-CG 3.38Å; A320-R324 PolarHBondContact O-N 3.24Å
321	N	94.4	Very high	93	Very high	27 Å²	27	47 Å²	47	14%	0.144	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-42.5	176.8	-71.1	-4.9	0	0	0	111.5	E282 S317 V318 L323 R324 S325	E282-N321 HydrophobicContact CG-CB 4.19Å; E282-N321 PolarHBondContact OE1-ND2 3.4Å; S317-N321 PolarHBondContact O-N 3.41Å; V318-N321 PolarHBondContact O-N 3.08Å; N321-L323 PolarHBondContact O-N 3.41Å; N321-R324 PolarHBondContact O-N 3.37Å; N321-R324 PolarHBondContact OD1-NH1 3.38Å; N321-S325 PolarHBondContact O-N 3.47Å; N321-S325 PolarHBondContact O-OG 3.19Å
322	A	93.3	Very high	93.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-46.1	173.7	0	0	0	0	0	112.4	F291 F311 V318 R319 S325 M326	F291-A322 HydrophobicContact CE1-CB 3.78Å; F291-A322 HydrophobicContact CZ-CB 3.74Å; F311-A322 HydrophobicContact CD1-CB 4.43Å; F311-A322 HydrophobicContact CE1-CB 3.45Å; F311-A322 VanDerWaalsContact CE1-CB 3.45Å; F311-A322 HydrophobicContact CZ-CB 3.89Å; V318-A322 WeakPolarHBondContact O-CB 3.03Å; V318-A322 PolarHBondContact O-N 2.94Å; R319-A322 PolarHBondContact O-N 3.35Å; A322-S325 PolarHBondContact O-N 2.97Å; A322-M326 HydrophobicContact CB-CE 4.07Å; A322-M326 WeakPolarHBondContact O-CE 3.25Å; A322-M326 WeakPolarHBondContact O-CG 3.26Å; A322-M326 PolarHBondContact O-N 3.1Å
323	L	93.4	Very high	94	Very high	84 Å²	84	44.2 Å²	44.2	44%	0.44	24%	0.243	S	C	.	.	H	α-helix	trans	-61	-44.7	175.7	-179.1	60.4	0	0	0	112	R319 A320 N321 S325 M326 I327	R319-L323 WeakPolarHBondContact O-CB 3.34Å; R319-L323 PolarHBondContact O-N 3.47Å; A320-L323 PolarHBondContact O-N 2.91Å; N321-L323 PolarHBondContact O-N 3.41Å; L323-S325 VanDerWaalsContact C-N 3.35Å; L323-S325 PolarHBondContact O-N 2.89Å; L323-M326 PolarHBondContact O-N 2.96Å; L323-I327 HydrophobicContact CD1-CD1 4.3Å; L323-I327 HydrophobicContact CD1-CG1 4.4Å; L323-I327 HydrophobicContact CG-CD1 4.03Å; L323-I327 VanDerWaalsContact O-CG1 3.31Å; L323-I327 WeakPolarHBondContact O-CG1 3.39Å; L323-I327 PolarHBondContact O-N 3.09Å
324	R	95.7	Very high	94.6	Very high	100 Å²	100	36.7 Å²	36.7	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-59.6	-44.3	176.3	-71.4	166	-175.4	141.9	-1.8	111.6	R279 A320 N321 M326 I327 T328	R279-R324 HydrophobicContact CB-CG 4.26Å; R279-R324 WeakPolarHBondContact O-CD 3.38Å; A320-R324 VanDerWaalsContact O-CG 3.28Å; A320-R324 WeakPolarHBondContact O-CG 3.38Å; A320-R324 PolarHBondContact O-N 3.24Å; N321-R324 PolarHBondContact O-N 3.37Å; N321-R324 PolarHBondContact OD1-NH1 3.38Å; R324-M326 PolarHBondContact O-N 3.23Å; R324-I327 PolarHBondContact O-N 3.45Å; R324-T328 PolarHBondContact O-N 3.35Å; R324-T328 PolarHBondContact O-OG1 3.38Å
325	S	95.7	Very high	95	Very high	1 Å²	1	36 Å²	36	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-68.2	-33.4	177.7	-54.5	0	0	0	0	112.5	D280 I287 N321 A322 L323 T328 A329	D280-S325 PolarHBondContact OD1-OG 3.23Å; I287-S325 WeakPolarHBondContact CD1-OG 3.44Å; I287-S325 WeakPolarHBondContact CG1-OG 3.16Å; N321-S325 PolarHBondContact O-N 3.47Å; N321-S325 PolarHBondContact O-OG 3.19Å; A322-S325 PolarHBondContact O-N 2.97Å; L323-S325 VanDerWaalsContact C-N 3.35Å; L323-S325 PolarHBondContact O-N 2.89Å; S325-T328 PolarHBondContact O-N 2.84Å; S325-A329 VanDerWaalsContact O-CB 3.3Å; S325-A329 WeakPolarHBondContact O-CB 3.48Å; S325-A329 PolarHBondContact O-N 2.86Å
326	M	95.2	Very high	95.2	Very high	9 Å²	9	32.5 Å²	32.5	4%	0.044	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-43.1	172.7	-74.6	-175.3	-91.7	0	0	112.3	F291 F311 A322 L323 R324 A329 S330 Y374	F291-M326 HydrophobicContact CZ-CE 4.36Å; F291-M326 HydrophobicContact CZ-CG 4.4Å; F311-M326 HydrophobicContact CE1-CE 4.42Å; F311-M326 HydrophobicContact CE2-CE 3.8Å; F311-M326 HydrophobicContact CZ-CE 3.42Å; F311-M326 VanDerWaalsContact CZ-CE 3.42Å; A322-M326 HydrophobicContact CB-CE 4.07Å; A322-M326 WeakPolarHBondContact O-CE 3.25Å; A322-M326 WeakPolarHBondContact O-CG 3.26Å; A322-M326 PolarHBondContact O-N 3.1Å; L323-M326 PolarHBondContact O-N 2.96Å; R324-M326 PolarHBondContact O-N 3.23Å; M326-A329 PolarHBondContact O-N 3.3Å; M326-S330 PolarHBondContact O-N 3.31Å; M326-Y374 HydrophobicContact SD-CE2 3.63Å
327	I	96.2	Very high	95.5	Very high	23 Å²	23	30 Å²	30	12%	0.118	15%	0.154	C	C	.	.	H	α-helix	trans	-57.6	-50.1	171.7	-70.1	166.5	0	0	0	109.9	F59 M63 L66 L323 R324 A329 S330 L331	F59-I327 HydrophobicContact CZ-CG1 4.43Å; M63-I327 HydrophobicContact CE-CG2 4.07Å; M63-I327 HydrophobicContact SD-CB 4.37Å; M63-I327 HydrophobicContact SD-CG1 3.97Å; M63-I327 HydrophobicContact SD-CG2 4.1Å; L66-I327 HydrophobicContact CD1-CD1 3.97Å; L66-I327 HydrophobicContact CD1-CG1 4.36Å; L66-I327 HydrophobicContact CD1-CG2 4.14Å; L323-I327 HydrophobicContact CD1-CD1 4.3Å; L323-I327 HydrophobicContact CD1-CG1 4.4Å; L323-I327 HydrophobicContact CG-CD1 4.03Å; L323-I327 VanDerWaalsContact O-CG1 3.31Å; L323-I327 WeakPolarHBondContact O-CG1 3.39Å; L323-I327 PolarHBondContact O-N 3.09Å; R324-I327 PolarHBondContact O-N 3.45Å; I327-A329 VanDerWaalsContact C-N 3.32Å; I327-A329 PolarHBondContact O-N 2.84Å; I327-S330 PolarHBondContact O-N 2.96Å; I327-L331 HydrophobicContact CG2-CD1 3.93Å; I327-L331 HydrophobicContact CG2-CG 4.49Å; I327-L331 WeakPolarHBondContact O-CG 3.47Å; I327-L331 PolarHBondContact O-N 3.27Å
328	T	96.9	Very high	95.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.8	-42.2	176.7	-66.7	0	0	0	0	111.5	F140 Q277 D280 R324 S325 S330 L331 R332	F140-T328 HydrophobicContact CE1-CG2 4.31Å; Q277-T328 WeakPolarHBondContact CA-OG1 3.48Å; Q277-T328 HydrophobicContact CB-CG2 4.34Å; Q277-T328 HydrophobicContact CG-CG2 4.42Å; Q277-T328 PolarHBondContact O-OG1 3.43Å; D280-T328 HydrophobicContact CB-CG2 4.06Å; D280-T328 WeakPolarHBondContact CB-OG1 3.43Å; R324-T328 PolarHBondContact O-N 3.35Å; R324-T328 PolarHBondContact O-OG1 3.38Å; S325-T328 PolarHBondContact O-N 2.84Å; T328-S330 VanDerWaalsContact C-N 3.34Å; T328-S330 PolarHBondContact O-N 3.09Å; T328-L331 PolarHBondContact O-N 2.87Å; T328-R332 HydrophobicContact CG2-CG 4.42Å; T328-R332 WeakPolarHBondContact O-CG 3.41Å; T328-R332 PolarHBondContact O-N 2.9Å
329	A	96.9	Very high	95.9	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.033	12%	0.116	C	C	.	.	H	α-helix	trans	-61	-42.3	176.8	0	0	0	0	0	112.4	S325 M326 I327 R332 D333 K375 L380	S325-A329 VanDerWaalsContact O-CB 3.3Å; S325-A329 WeakPolarHBondContact O-CB 3.48Å; S325-A329 PolarHBondContact O-N 2.86Å; M326-A329 PolarHBondContact O-N 3.3Å; I327-A329 VanDerWaalsContact C-N 3.32Å; I327-A329 PolarHBondContact O-N 2.84Å; A329-R332 PolarHBondContact O-N 3.23Å; A329-D333 PolarHBondContact O-N 3.4Å; A329-K375 HydrophobicContact CB-CB 3.82Å; A329-K375 HydrophobicContact CB-CG 3.82Å; A329-L380 HydrophobicContact CB-CD1 3.8Å; A329-L380 HydrophobicContact CB-CD2 4.16Å; A329-L380 HydrophobicContact CB-CG 4.02Å
330	S	97.1	Very high	96	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.4	-47.8	176.1	-166.9	0	0	0	0	111.6	M326 I327 T328 R332 D333 C334 L372 D373	M326-S330 PolarHBondContact O-N 3.31Å; I327-S330 PolarHBondContact O-N 2.96Å; T328-S330 VanDerWaalsContact C-N 3.34Å; T328-S330 PolarHBondContact O-N 3.09Å; S330-R332 PolarHBondContact O-N 2.99Å; S330-D333 PolarHBondContact O-N 3.02Å; S330-C334 PolarHBondContact O-N 3.23Å; S330-L372 VanDerWaalsContact OG-CA 3.25Å; S330-L372 WeakPolarHBondContact OG-CA 3.47Å; S330-L372 PolarHBondContact OG-O 3.46Å; S330-D373 PolarHBondContact OG-N 2.94Å; S330-D373 PolarHBondContact OG-O 3.25Å
331	L	97.8	Very high	95.9	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64.3	-20.4	177.2	-67.6	173.1	0	0	0	114.6	M63 F67 M273 L276 Q277 I327 T328 C334 L372	M63-L331 HydrophobicContact CE-CD1 4.42Å; M63-L331 HydrophobicContact CE-CD2 3.74Å; M63-L331 HydrophobicContact CE-CG 3.8Å; F67-L331 HydrophobicContact CE2-CD2 4.16Å; F67-L331 HydrophobicContact CZ-CD2 3.66Å; M273-L331 HydrophobicContact CE-CD2 4.37Å; L276-L331 HydrophobicContact CB-CD1 3.56Å; L276-L331 HydrophobicContact CD1-CD1 4.19Å; Q277-L331 HydrophobicContact CG-CB 3.89Å; Q277-L331 HydrophobicContact CG-CD1 4.11Å; Q277-L331 PolarHBondContact NE2-O 3.46Å; I327-L331 HydrophobicContact CG2-CD1 3.93Å; I327-L331 HydrophobicContact CG2-CG 4.49Å; I327-L331 WeakPolarHBondContact O-CG 3.47Å; I327-L331 PolarHBondContact O-N 3.27Å; T328-L331 PolarHBondContact O-N 2.87Å; L331-C334 PolarHBondContact O-SG 3.26Å; L331-L372 HydrophobicContact CD2-CD2 3.74Å
332	R	96.1	Very high	95.7	Very high	16 Å²	16	16.3 Å²	16.3	6%	0.06	8%	0.078	C	C	.	.	H	α-helix	trans	-78.5	-28.3	173.7	-72.7	179.8	-50.3	-163	-1.2	112.5	K137 Q138 T328 A329 S330	K137-R332 VanDerWaalsContact CA-O 3.3Å; K137-R332 WeakPolarHBondContact CA-O 3.34Å; K137-R332 WeakPolarHBondContact CD-O 3.44Å; Q138-R332 HydrophobicContact CB-CG 3.74Å; Q138-R332 HydrophobicContact CG-CG 4.07Å; T328-R332 HydrophobicContact CG2-CG 4.42Å; T328-R332 WeakPolarHBondContact O-CG 3.41Å; T328-R332 PolarHBondContact O-N 2.9Å; A329-R332 PolarHBondContact O-N 3.23Å; S330-R332 PolarHBondContact O-N 2.99Å
333	D	94.9	Very high	95.4	Very high	70 Å²	70	18 Å²	18	37%	0.374	9%	0.085	S	C	.	.	H	α-helix	trans	-107.9	-3.7	-174.8	-78.3	-21.8	0	0	0	113.7	A329 S330	A329-D333 PolarHBondContact O-N 3.4Å; S330-D333 PolarHBondContact O-N 3.02Å
334	C	97.1	Very high	95.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.			trans	-66.9	168.8	173.8	77.6	0	0	0	0	112.4	P136 M273 S330 L331 I370 L372	P136-C334 WeakPolarHBondContact CD-O 3.23Å; M273-C334 VanDerWaalsContact CE-SG 3.51Å; S330-C334 PolarHBondContact O-N 3.23Å; L331-C334 PolarHBondContact O-SG 3.26Å; C334-I370 WeakPolarHBondContact CA-O 3.48Å; C334-I370 VanDerWaalsContact CB-O 3.25Å; C334-I370 WeakPolarHBondContact CB-O 3.39Å; C334-L372 HydrophobicContact CB-CD2 3.58Å; C334-L372 HydrophobicContact CB-CG 4.15Å
335	S	97.5	Very high	94.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.1	168.9	-60.8	0	0	0	0	110.7	E133 I134 K135 L369 I370	E133-S335 PolarHBondContact OE1-OG 3.32Å; I134-S335 CarbonylContact O-C 3.22Å; I134-S335 WeakPolarHBondContact O-CA 3.5Å; K135-S335 WeakPolarHBondContact CE-OG 3.46Å; K135-S335 WeakPolarHBondContact CG-OG 3.37Å; S335-L369 WeakPolarHBondContact O-CA 3.38Å; S335-I370 PolarHBondContact N-O 3.28Å; S335-I370 PolarHBondContact O-N 3.45Å
336	I	98.1	Very high	94	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.8	162.5	-60.7	162.8	0	0	0	106.5	E133 I134 P136 L269 L270 M273 I338 M367 R368 L369	E133-I336 CarbonylContact C-O 3.45Å; E133-I336 WeakPolarHBondContact CA-O 3.4Å; I134-I336 PolarHBondContact N-O 3.1Å; I134-I336 PolarHBondContact O-N 3.14Å; P136-I336 HydrophobicContact CB-CD1 4.11Å; P136-I336 HydrophobicContact CG-CD1 3.94Å; P136-I336 HydrophobicContact CG-CG1 4.29Å; L269-I336 HydrophobicContact CD2-CG2 4.49Å; L270-I336 HydrophobicContact CD2-CD1 3.4Å; L270-I336 HydrophobicContact CG-CD1 4.11Å; M273-I336 HydrophobicContact CE-CD1 4.38Å; M273-I336 HydrophobicContact CE-CG1 4.4Å; M273-I336 HydrophobicContact SD-CD1 3.89Å; M273-I336 HydrophobicContact SD-CG1 4.13Å; I336-I338 HydrophobicContact CG2-CG1 3.97Å; I336-M367 HydrophobicContact CG2-SD 4.45Å; I336-R368 CarbonylContact C-O 3.46Å; I336-R368 WeakPolarHBondContact CA-O 3.38Å; I336-L369 HydrophobicContact CB-CD2 4.43Å; I336-L369 HydrophobicContact CG1-CD2 3.54Å
337	M	98	Very high	93.5	Very high	14 Å²	14	31.3 Å²	31.3	7%	0.069	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.9	168.7	-69.4	-170.1	71.2	0	0	109.5	L115 T131 V132 E133 M367 R368 I370	L115-M337 HydrophobicContact CB-CE 3.77Å; L115-M337 HydrophobicContact CB-SD 3.82Å; L115-M337 HydrophobicContact CD1-SD 3.79Å; L115-M337 HydrophobicContact CG-SD 4.4Å; T131-M337 HydrophobicContact CG2-CE 3.49Å; T131-M337 VanDerWaalsContact CG2-CE 3.49Å; V132-M337 CarbonylContact O-C 3.58Å; V132-M337 WeakPolarHBondContact O-CA 3.07Å; E133-M337 HydrophobicContact CB-CG 4.33Å; E133-M337 HydrophobicContact CG-CG 4.16Å; M337-M367 CarbonylContact O-C 3.6Å; M337-M367 VanDerWaalsContact O-CA 3.3Å; M337-M367 WeakPolarHBondContact O-CA 3.34Å; M337-R368 PolarHBondContact N-O 3.22Å; M337-R368 PolarHBondContact O-N 2.83Å; M337-I370 HydrophobicContact CG-CD1 3.93Å; M337-I370 HydrophobicContact CG-CG1 4.14Å; M337-I370 HydrophobicContact SD-CD1 3.5Å; M337-I370 WeakPolarHBondContact SD-CD1 3.26Å; M337-I370 HydrophobicContact SD-CG1 4.18Å; M337-I370 HydrophobicContact SD-CG2 4.26Å
338	I	97.9	Very high	92.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	104.1	176.1	-48.6	175.7	0	0	0	107.7	T131 V132 I245 I248 L249 I336 M340 R366 M367	T131-I338 CarbonylContact C-O 3.56Å; T131-I338 VanDerWaalsContact CA-O 3.29Å; T131-I338 WeakPolarHBondContact CA-O 3.4Å; V132-I338 HydrophobicContact CB-CB 4.48Å; V132-I338 PolarHBondContact N-O 3Å; V132-I338 PolarHBondContact O-N 3.46Å; I245-I338 HydrophobicContact CD1-CD1 4.12Å; I245-I338 HydrophobicContact CG2-CD1 4.07Å; I248-I338 HydrophobicContact CD1-CG2 3.9Å; I248-I338 HydrophobicContact CG2-CD1 4.14Å; I248-I338 HydrophobicContact CG2-CG2 3.92Å; L249-I338 HydrophobicContact CD2-CD1 3.87Å; L249-I338 HydrophobicContact CG-CD1 4.16Å; I336-I338 HydrophobicContact CG2-CG1 3.97Å; I338-M340 HydrophobicContact CG2-CE 4.37Å; I338-M340 HydrophobicContact CG2-CG 3.89Å; I338-M340 HydrophobicContact CG2-SD 4.12Å; I338-R366 CarbonylContact C-O 3.6Å; I338-R366 WeakPolarHBondContact CA-O 3.13Å; I338-M367 HydrophobicContact CG1-CG 4.18Å; I338-M367 HydrophobicContact CG1-SD 4.43Å; I338-M367 HydrophobicContact CG2-CG 4.41Å
339	T	96.4	Very high	91.9	Very high	1 Å²	1	46 Å²	46	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.9	178.2	-47.4	0	0	0	0	108	L115 F118 T129 Y365 R366	L115-T339 PolarHBondContact O-OG1 3.35Å; F118-T339 HydrophobicContact CD2-CG2 4.12Å; F118-T339 HydrophobicContact CE2-CG2 3.85Å; F118-T339 HydrophobicContact CZ-CG2 4.09Å; F118-T339 VanDerWaalsContact CZ-O 3.31Å; F118-T339 WeakPolarHBondContact CZ-O 3.4Å; T129-T339 HydrophobicContact CG2-CG2 3.62Å; T339-Y365 CarbonylContact O-C 3.55Å; T339-Y365 WeakPolarHBondContact O-CA 3.49Å; T339-R366 PolarHBondContact N-O 3.04Å; T339-R366 PolarHBondContact O-N 2.97Å
340	M	94.6	Very high	91.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.3	-171.7	-62.4	168.3	-76.1	0	0	111.2	V130 V132 F227 L244 I245 I248 I338 V363 V364	V130-M340 HydrophobicContact CG1-CE 4.16Å; V130-M340 PolarHBondContact N-O 3.13Å; V130-M340 PolarHBondContact O-N 3.44Å; V132-M340 HydrophobicContact CB-CE 4.47Å; V132-M340 HydrophobicContact CG2-CE 3.52Å; F227-M340 HydrophobicContact CE1-CB 3.95Å; F227-M340 HydrophobicContact CE2-CE 4.41Å; F227-M340 HydrophobicContact CZ-CB 4Å; F227-M340 HydrophobicContact CZ-CE 3.71Å; F227-M340 HydrophobicContact CZ-SD 3.79Å; L244-M340 HydrophobicContact CD2-SD 4.16Å; L244-M340 HydrophobicContact CG-SD 4.5Å; I245-M340 HydrophobicContact CD1-CE 3.56Å; I245-M340 HydrophobicContact CD1-SD 3.82Å; I248-M340 HydrophobicContact CD1-CG 4.08Å; I248-M340 HydrophobicContact CD1-SD 3.6Å; I338-M340 HydrophobicContact CG2-CE 4.37Å; I338-M340 HydrophobicContact CG2-CG 3.89Å; I338-M340 HydrophobicContact CG2-SD 4.12Å; M340-V363 HydrophobicContact CB-CG1 3.96Å; M340-V363 HydrophobicContact CG-CG1 4.14Å; M340-V363 HydrophobicContact SD-CG1 4.41Å; M340-V364 CarbonylContact C-O 3.54Å; M340-V364 VanDerWaalsContact CA-O 3.3Å; M340-V364 WeakPolarHBondContact CA-O 3.24Å
341	K	91.3	Very high	90.6	Very high	7 Å²	7	53.5 Å²	53.5	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	138.2	172.7	-173.3	174.8	177.8	87.1	0	110	F118 F121 S125 S127 F343 V364	F118-K341 HydrophobicContact CD2-CB 4.09Å; F118-K341 HydrophobicContact CD2-CD 4.41Å; F118-K341 HydrophobicContact CE2-CB 3.63Å; F121-K341 HydrophobicContact CD2-CD 4.26Å; S125-K341 PolarHBondContact O-NZ 2.87Å; S125-K341 WeakPolarHBondContact OG-CE 3.44Å; S125-K341 PolarHBondContact OG-NZ 3.06Å; S127-K341 PolarHBondContact O-NZ 2.78Å; S127-K341 WeakPolarHBondContact OG-CE 3.18Å; S127-K341 VanDerWaalsContact OG-CG 3.29Å; S127-K341 WeakPolarHBondContact OG-CG 3.42Å; S127-K341 PolarHBondContact OG-NZ 3.02Å; K341-F343 HydrophobicContact CB-CE2 3.86Å; K341-F343 HydrophobicContact CB-CZ 4.46Å; K341-F343 HydrophobicContact CD-CE2 3.99Å; K341-F343 HydrophobicContact CD-CZ 3.75Å; K341-F343 HydrophobicContact CG-CD2 4.47Å; K341-F343 HydrophobicContact CG-CE2 3.8Å; K341-F343 HydrophobicContact CG-CZ 4.06Å; K341-F343 WeakPolarHBondContact O-CD2 3.41Å; K341-V364 PolarHBondContact N-O 3.22Å; K341-V364 PolarHBondContact O-N 3.32Å
342	I	88.8	Confident	90.2	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	139.9	179.5	-167.7	158.3	0	0	0	111.3	S127 F227 H229 L357 C361 F362	S127-I342 VanDerWaalsContact CB-O 3.27Å; S127-I342 WeakPolarHBondContact CB-O 3.48Å; S127-I342 PolarHBondContact OG-O 3.29Å; F227-I342 HydrophobicContact CB-CD1 4.44Å; F227-I342 HydrophobicContact CD1-CB 4.44Å; H229-I342 HydrophobicContact CB-CD1 4.06Å; H229-I342 HydrophobicContact CB-CG2 4.39Å; H229-I342 VanDerWaalsContact CG-CD1 3.48Å; H229-I342 WeakPolarHBondContact ND1-CD1 3.37Å; I342-L357 HydrophobicContact CD1-CD1 3.61Å; I342-L357 HydrophobicContact CG1-CD1 4.46Å; I342-C361 HydrophobicContact CD1-CB 4.38Å; I342-C361 HydrophobicContact CG1-CB 4.38Å; I342-F362 CarbonylContact C-O 3.55Å; I342-F362 WeakPolarHBondContact CA-O 3.23Å
343	F	87.9	Confident	90	Very high	36 Å²	36	54.5 Å²	54.5	16%	0.158	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.2	178.8	-66.2	-95.1	0	0	0	110.1	F121 K341 R345 P347 F362 V364	F121-F343 HydrophobicContact CD1-CZ 4.08Å; F121-F343 HydrophobicContact CD2-CE2 4.49Å; F121-F343 AromaticContact CD2-CZ 3.91Å; F121-F343 HydrophobicContact CD2-CZ 3.91Å; F121-F343 HydrophobicContact CE1-CZ 4.07Å; F121-F343 HydrophobicContact CE2-CE2 4.19Å; F121-F343 AromaticContact CE2-CZ 3.92Å; F121-F343 HydrophobicContact CE2-CZ 3.92Å; F121-F343 HydrophobicContact CG-CZ 4.02Å; F121-F343 HydrophobicContact CZ-CE2 4.38Å; F121-F343 HydrophobicContact CZ-CZ 4Å; K341-F343 HydrophobicContact CB-CE2 3.86Å; K341-F343 HydrophobicContact CB-CZ 4.46Å; K341-F343 HydrophobicContact CD-CE2 3.99Å; K341-F343 HydrophobicContact CD-CZ 3.75Å; K341-F343 HydrophobicContact CG-CD2 4.47Å; K341-F343 HydrophobicContact CG-CE2 3.8Å; K341-F343 HydrophobicContact CG-CZ 4.06Å; K341-F343 WeakPolarHBondContact O-CD2 3.41Å; F343-R345 VanDerWaalsContact CB-O 3.3Å; F343-R345 WeakPolarHBondContact CB-O 3.48Å; F343-R345 PolarHBondContact O-N 3.33Å; F343-P347 HydrophobicContact CD2-CG 4.46Å; F343-P347 HydrophobicContact CG-CG 4.42Å; F343-F362 PolarHBondContact N-O 3.34Å; F343-F362 PolarHBondContact O-N 3.14Å; F343-V364 HydrophobicContact CD2-CB 4.07Å; F343-V364 HydrophobicContact CD2-CG2 3.57Å; F343-V364 HydrophobicContact CE2-CB 3.8Å; F343-V364 HydrophobicContact CE2-CG2 3.64Å
344	L	86.1	Confident	89.9	Confident	96 Å²	96	52.9 Å²	52.9	50%	0.503	26%	0.26	S	S	.	.	S	Bend	trans	-71.2	-21.3	177	-62	178	0	0	0	113	R230	R230-L344 WeakPolarHBondContact O-CD2 3.42Å
345	R	85.4	Confident	89.7	Confident	211 Å²	211	54.4 Å²	54.4	80%	0.796	27%	0.268	S	S	*	.	S	Bend	trans	-139	150	177	-64	-176.9	179.6	173.6	0.3	108.5	F343 P347	F343-R345 VanDerWaalsContact CB-O 3.3Å; F343-R345 WeakPolarHBondContact CB-O 3.48Å; F343-R345 PolarHBondContact O-N 3.33Å; R345-P347 WeakPolarHBondContact O-CD 3.4Å
346	K	84.2	Confident	89.3	Confident	140 Å²	140	60.6 Å²	60.6	61%	0.609	30%	0.297	S	S	*	.			trans	-59.6	121.7	176.3	-171.2	175.9	179.6	179.8	0	109.5	Q348 F362	K346-Q348 PolarHBondContact O-N 2.88Å; K346-F362 HydrophobicContact CB-CD1 4Å; K346-F362 HydrophobicContact CB-CD2 3.95Å; K346-F362 HydrophobicContact CB-CE1 3.93Å; K346-F362 HydrophobicContact CB-CE2 3.88Å; K346-F362 HydrophobicContact CB-CG 4.01Å; K346-F362 HydrophobicContact CB-CZ 3.87Å; K346-F362 HydrophobicContact CD-CD1 4.5Å; K346-F362 HydrophobicContact CD-CE1 4.18Å; K346-F362 HydrophobicContact CG-CD1 4.18Å; K346-F362 HydrophobicContact CG-CE1 4.25Å
347	P	83.7	Confident	88.9	Confident	25 Å²	25	60.9 Å²	60.9	16%	0.162	30%	0.298	C	S	.	.			trans	-66.9	120.4	178.2	20.6	-25	0	0	0	109.9	F343 R345 T349 V364	F343-P347 HydrophobicContact CD2-CG 4.46Å; F343-P347 HydrophobicContact CG-CG 4.42Å; R345-P347 WeakPolarHBondContact O-CD 3.4Å; P347-T349 VanDerWaalsContact C-N 3.33Å; P347-T349 PolarHBondContact O-N 3.47Å; P347-V364 HydrophobicContact CG-CG2 3.55Å
348	Q	81.2	Confident	88.2	Confident	196 Å²	196	65.5 Å²	65.5	92%	0.916	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-29.7	-173.4	-67.4	-171.5	-10.2	0	0	113.5	K346	K346-Q348 PolarHBondContact O-N 2.88Å
349	T	78.8	Confident	87.6	Confident	135 Å²	135	66.9 Å²	66.9	83%	0.828	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.1	-174.8	53.9	0	0	0	0	113.9	P347 K351	P347-T349 VanDerWaalsContact C-N 3.33Å; P347-T349 PolarHBondContact O-N 3.47Å; T349-K351 PolarHBondContact O-N 3.23Å
350	S	82.3	Confident	87.2	Confident	30 Å²	30	68.3 Å²	68.3	21%	0.21	35%	0.353	C	S	.	.			trans	-80.5	120	-175.9	175.1	0	0	0	0	111	L352	S350-L352 PolarHBondContact O-N 3.48Å; S350-L352 WeakPolarHBondContact OG-CB 3.48Å; S350-L352 PolarHBondContact OG-N 3.07Å
351	K	85.2	Confident	86.9	Confident	133 Å²	133	68.4 Å²	68.4	58%	0.578	35%	0.354	S	S	*	.			trans	-74	-14.1	168	-63.1	-169.4	172.6	-161.7	0	113.4	E255 T349	E255-K351 WeakPolarHBondContact O-CB 3.46Å; T349-K351 PolarHBondContact O-N 3.23Å
352	L	89.9	Confident	86.8	Confident	15 Å²	15	69.6 Å²	69.6	8%	0.079	36%	0.359	C	S	.	.	S	Bend	trans	-69.3	147	-179.1	-67.6	164.4	0	0	0	112	F118 F121 E255 S350 V364 R366	F118-L352 HydrophobicContact CD1-CD1 3.64Å; F118-L352 HydrophobicContact CE1-CD1 3.46Å; F118-L352 VanDerWaalsContact CE1-CD1 3.46Å; F121-L352 HydrophobicContact CE2-CD1 3.94Å; F121-L352 HydrophobicContact CZ-CD1 4.04Å; E255-L352 HydrophobicContact CG-CD2 3.81Å; E255-L352 VanDerWaalsContact OE1-CD2 3.27Å; E255-L352 WeakPolarHBondContact OE1-CD2 3.11Å; S350-L352 PolarHBondContact O-N 3.48Å; S350-L352 WeakPolarHBondContact OG-CB 3.48Å; S350-L352 PolarHBondContact OG-N 3.07Å; L352-V364 HydrophobicContact CB-CG1 3.56Å; L352-V364 HydrophobicContact CD1-CG1 3.93Å; L352-V364 HydrophobicContact CG-CG1 4.41Å; L352-R366 HydrophobicContact CD2-CB 4.04Å
353	P	91.5	Very high	86.9	Confident	21 Å²	21	69 Å²	69	14%	0.136	36%	0.356	C	S	.	.			trans	-66.3	149.3	176.1	29.9	-35.1	0	0	0	111.1	Y253 V254 V364 Y365	Y253-P353 HydrophobicContact CD2-CG 3.82Å; Y253-P353 HydrophobicContact CE2-CG 3.55Å; V254-P353 WeakPolarHBondContact O-CD 3.24Å; P353-V364 WeakPolarHBondContact O-CA 3.49Å; P353-Y365 HydrophobicContact CB-CD1 4.46Å; P353-Y365 HydrophobicContact CB-CE1 3.69Å; P353-Y365 HydrophobicContact CB-CE2 4.28Å; P353-Y365 WeakPolarHBondContact CB-OH 3.23Å; P353-Y365 WeakPolarHBondContact CD-O 3.33Å; P353-Y365 HydrophobicContact CG-CD1 4.28Å; P353-Y365 HydrophobicContact CG-CD2 4.13Å; P353-Y365 HydrophobicContact CG-CE1 3.83Å; P353-Y365 HydrophobicContact CG-CE2 3.68Å; P353-Y365 HydrophobicContact CG-CG 4.41Å; P353-Y365 WeakPolarHBondContact CG-O 3.45Å; P353-Y365 WeakPolarHBondContact O-CD1 3.38Å; P353-Y365 PolarHBondContact O-N 2.95Å
354	A	92.2	Very high	87.1	Confident	37 Å²	37	67.3 Å²	67.3	31%	0.306	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.3	180	0	0	0	0	0	110.8	V363 V364	A354-V363 CarbonylContact C-O 3.57Å; A354-V363 VanDerWaalsContact CA-O 3.25Å; A354-V363 WeakPolarHBondContact CA-O 3.03Å; A354-V364 HydrophobicContact CB-CG2 4.12Å
355	L	92.2	Very high	87.5	Confident	32 Å²	32	63 Å²	63	17%	0.168	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.6	169.3	-64.5	179.1	0	0	0	109.5	L244 K247 I248 F362 V363 Y365	L244-L355 HydrophobicContact CD1-CD1 3.81Å; K247-L355 HydrophobicContact CB-CD1 3.95Å; I248-L355 HydrophobicContact CD1-CD1 4.36Å; I248-L355 HydrophobicContact CG1-CD1 3.51Å; L355-F362 CarbonylContact O-C 3.53Å; L355-F362 WeakPolarHBondContact O-CA 3.43Å; L355-V363 PolarHBondContact N-O 3.45Å; L355-V363 PolarHBondContact O-N 3.27Å; L355-Y365 HydrophobicContact CD1-CE1 4.5Å; L355-Y365 HydrophobicContact CD2-CE1 4.45Å; L355-Y365 HydrophobicContact CG-CD1 4.39Å; L355-Y365 HydrophobicContact CG-CE1 3.91Å
356	E	90.7	Very high	88	Confident	129 Å²	129	53.9 Å²	53.9	60%	0.603	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.8	169.7	-170.1	171.8	177.3	0	0	109.9	F362	E356-F362 HydrophobicContact CB-CD1 4.23Å; E356-F362 HydrophobicContact CB-CE1 3.9Å; E356-F362 HydrophobicContact CG-CD1 4.5Å; E356-F362 HydrophobicContact CG-CE1 3.93Å; E356-F362 HydrophobicContact CG-CZ 4.11Å
357	L	87.7	Confident	88.6	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-87.3	156.9	175.2	-62.2	179.8	0	0	0	110.3	E239 L244 I342 C359 G360 C361 V363	E239-L357 HydrophobicContact CG-CD1 3.95Å; E239-L357 HydrophobicContact CG-CD2 4.19Å; L244-L357 HydrophobicContact CD1-CD2 4.38Å; I342-L357 HydrophobicContact CD1-CD1 3.61Å; I342-L357 HydrophobicContact CG1-CD1 4.46Å; L357-C359 PolarHBondContact O-N 3.35Å; L357-G360 PolarHBondContact O-N 3.19Å; L357-C361 WeakPolarHBondContact CB-O 3.36Å; L357-C361 HydrophobicContact CD1-CB 4.27Å; L357-C361 PolarHBondContact N-O 3.19Å; L357-V363 HydrophobicContact CD1-CG2 3.8Å; L357-V363 HydrophobicContact CD2-CG2 3.87Å; L357-V363 HydrophobicContact CG-CG2 3.93Å
358	P	84.9	Confident	89.2	Confident	111 Å²	111	47.2 Å²	47.2	72%	0.721	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-26.8	178.4	-25.8	35.6	0	0	0	114.6	G360	P358-G360 VanDerWaalsContact C-N 3.25Å; P358-G360 PolarHBondContact O-N 3.15Å
359	C	84.8	Confident	89.9	Confident	29 Å²	29	37.9 Å²	37.9	20%	0.196	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	0	176.2	65.8	0	0	0	0	114.4	H229 C231 L357 C361	H229-C359 PolarHBondContact NE2-SG 3.33Å; C231-C359 HydrophobicContact CB-CB 4.48Å; L357-C359 PolarHBondContact O-N 3.35Å; C359-C361 VanDerWaalsContact C-N 3.32Å; C359-C361 VanDerWaalsContact SG-CB 3.59Å
360	G	87	Confident	90.8	Very high	31 Å²	31	32.6 Å²	32.6	32%	0.32	18%	0.182	S	C	.	.	S	Bend	trans	82.2	0.7	-176	0	0	0	0	0	114.9	L357 P358 F362	L357-G360 PolarHBondContact O-N 3.19Å; P358-G360 VanDerWaalsContact C-N 3.25Å; P358-G360 PolarHBondContact O-N 3.15Å; G360-F362 WeakPolarHBondContact O-CE2 3.43Å
361	C	88.2	Confident	91.3	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.014	18%	0.18	C	C	.	.			trans	-79.5	164.6	171.6	-64.7	0	0	0	0	111.2	H229 I342 L357 C359	H229-C361 PolarHBondContact CD2-SG 3.41Å; H229-C361 PolarHBondContact NE2-SG 3.15Å; I342-C361 HydrophobicContact CD1-CB 4.38Å; I342-C361 HydrophobicContact CG1-CB 4.38Å; L357-C361 WeakPolarHBondContact CB-O 3.36Å; L357-C361 HydrophobicContact CD1-CB 4.27Å; L357-C361 PolarHBondContact N-O 3.19Å; C359-C361 VanDerWaalsContact C-N 3.32Å; C359-C361 VanDerWaalsContact SG-CB 3.59Å
362	F	89.8	Confident	91.7	Very high	33 Å²	33	26.4 Å²	26.4	15%	0.145	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.9	-174.7	-65.2	-92.4	0	0	0	111.1	I342 F343 K346 L355 E356 G360	I342-F362 CarbonylContact C-O 3.55Å; I342-F362 WeakPolarHBondContact CA-O 3.23Å; F343-F362 PolarHBondContact N-O 3.34Å; F343-F362 PolarHBondContact O-N 3.14Å; K346-F362 HydrophobicContact CB-CD1 4Å; K346-F362 HydrophobicContact CB-CD2 3.95Å; K346-F362 HydrophobicContact CB-CE1 3.93Å; K346-F362 HydrophobicContact CB-CE2 3.88Å; K346-F362 HydrophobicContact CB-CG 4.01Å; K346-F362 HydrophobicContact CB-CZ 3.87Å; K346-F362 HydrophobicContact CD-CD1 4.5Å; K346-F362 HydrophobicContact CD-CE1 4.18Å; K346-F362 HydrophobicContact CG-CD1 4.18Å; K346-F362 HydrophobicContact CG-CE1 4.25Å; L355-F362 CarbonylContact O-C 3.53Å; L355-F362 WeakPolarHBondContact O-CA 3.43Å; E356-F362 HydrophobicContact CB-CD1 4.23Å; E356-F362 HydrophobicContact CB-CE1 3.9Å; E356-F362 HydrophobicContact CG-CD1 4.5Å; E356-F362 HydrophobicContact CG-CE1 3.93Å; E356-F362 HydrophobicContact CG-CZ 4.11Å; G360-F362 WeakPolarHBondContact O-CE2 3.43Å
363	V	91.4	Very high	91.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	106.7	167	179.5	0	0	0	0	108.1	L244 M340 A354 L355 L357	L244-V363 HydrophobicContact CD1-CB 4.37Å; L244-V363 HydrophobicContact CD1-CG1 4.43Å; L244-V363 HydrophobicContact CD1-CG2 4.25Å; L244-V363 HydrophobicContact CD2-CG1 4.27Å; L244-V363 HydrophobicContact CD2-CG2 4.16Å; M340-V363 HydrophobicContact CB-CG1 3.96Å; M340-V363 HydrophobicContact CG-CG1 4.14Å; M340-V363 HydrophobicContact SD-CG1 4.41Å; A354-V363 CarbonylContact C-O 3.57Å; A354-V363 VanDerWaalsContact CA-O 3.25Å; A354-V363 WeakPolarHBondContact CA-O 3.03Å; L355-V363 PolarHBondContact N-O 3.45Å; L355-V363 PolarHBondContact O-N 3.27Å; L357-V363 HydrophobicContact CD1-CG2 3.8Å; L357-V363 HydrophobicContact CD2-CG2 3.87Å; L357-V363 HydrophobicContact CG-CG2 3.93Å
364	V	92.9	Very high	91.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	138.1	168.2	179.1	0	0	0	0	108.3	F121 M340 K341 F343 P347 L352 P353 A354	F121-V364 HydrophobicContact CE2-CG1 4Å; F121-V364 HydrophobicContact CZ-CG1 4Å; M340-V364 CarbonylContact C-O 3.54Å; M340-V364 VanDerWaalsContact CA-O 3.3Å; M340-V364 WeakPolarHBondContact CA-O 3.24Å; K341-V364 PolarHBondContact N-O 3.22Å; K341-V364 PolarHBondContact O-N 3.32Å; F343-V364 HydrophobicContact CD2-CB 4.07Å; F343-V364 HydrophobicContact CD2-CG2 3.57Å; F343-V364 HydrophobicContact CE2-CB 3.8Å; F343-V364 HydrophobicContact CE2-CG2 3.64Å; P347-V364 HydrophobicContact CG-CG2 3.55Å; L352-V364 HydrophobicContact CB-CG1 3.56Å; L352-V364 HydrophobicContact CD1-CG1 3.93Å; L352-V364 HydrophobicContact CG-CG1 4.41Å; P353-V364 WeakPolarHBondContact O-CA 3.49Å; A354-V364 HydrophobicContact CB-CG2 4.12Å
365	Y	94.5	Very high	92	Very high	7 Å²	7	27 Å²	27	3%	0.027	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.4	-178.5	68.7	-81.1	0	0	0	113.6	I248 C251 Y253 T339 P353 L355 M367	I248-Y365 HydrophobicContact CB-CD2 4.47Å; I248-Y365 HydrophobicContact CB-CE2 4.38Å; I248-Y365 HydrophobicContact CD1-CD1 4.26Å; I248-Y365 HydrophobicContact CD1-CD2 4.19Å; I248-Y365 HydrophobicContact CD1-CG 3.9Å; I248-Y365 HydrophobicContact CG1-CD1 4.21Å; I248-Y365 HydrophobicContact CG1-CD2 4.14Å; I248-Y365 HydrophobicContact CG1-CE1 4.34Å; I248-Y365 HydrophobicContact CG1-CE2 4.26Å; I248-Y365 HydrophobicContact CG1-CG 4.11Å; I248-Y365 HydrophobicContact CG2-CD2 3.58Å; I248-Y365 HydrophobicContact CG2-CE2 3.56Å; I248-Y365 HydrophobicContact CG2-CG 4.36Å; C251-Y365 PolarHBondContact SG-OH 3.23Å; Y253-Y365 AromaticContact CD2-CE2 3.86Å; Y253-Y365 HydrophobicContact CD2-CE2 3.86Å; Y253-Y365 HydrophobicContact CE2-CD2 4.34Å; Y253-Y365 HydrophobicContact CE2-CE2 4.06Å; T339-Y365 CarbonylContact O-C 3.55Å; T339-Y365 WeakPolarHBondContact O-CA 3.49Å; P353-Y365 HydrophobicContact CB-CD1 4.46Å; P353-Y365 HydrophobicContact CB-CE1 3.69Å; P353-Y365 HydrophobicContact CB-CE2 4.28Å; P353-Y365 WeakPolarHBondContact CB-OH 3.23Å; P353-Y365 WeakPolarHBondContact CD-O 3.33Å; P353-Y365 HydrophobicContact CG-CD1 4.28Å; P353-Y365 HydrophobicContact CG-CD2 4.13Å; P353-Y365 HydrophobicContact CG-CE1 3.83Å; P353-Y365 HydrophobicContact CG-CE2 3.68Å; P353-Y365 HydrophobicContact CG-CG 4.41Å; P353-Y365 WeakPolarHBondContact CG-O 3.45Å; P353-Y365 WeakPolarHBondContact O-CD1 3.38Å; P353-Y365 PolarHBondContact O-N 2.95Å; L355-Y365 HydrophobicContact CD1-CE1 4.5Å; L355-Y365 HydrophobicContact CD2-CE1 4.45Å; L355-Y365 HydrophobicContact CG-CD1 4.39Å; L355-Y365 HydrophobicContact CG-CE1 3.91Å; Y365-M367 HydrophobicContact CD2-CG 4.31Å
366	R	94.8	Very high	91.9	Very high	18 Å²	18	27 Å²	27	7%	0.068	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.2	174.7	169.2	176.3	-76.7	156.1	-2.1	109	F118 E120 E255 I338 T339 L352 R368	F118-R366 HydrophobicContact CE1-CB 3.71Å; F118-R366 HydrophobicContact CZ-CB 4.37Å; E120-R366 IonicContact OE1-CZ 3.83Å; E120-R366 IonicContact OE1-NH1 2.87Å; E120-R366 PolarHBondContact OE1-NH1 3.03Å; E120-R366 IonicContact OE1-NH2 3.14Å; E120-R366 PolarHBondContact OE1-NH2 3.43Å; E120-R366 IonicContact OE2-CZ 3.89Å; E120-R366 IonicContact OE2-NH1 3.47Å; E120-R366 PolarHBondContact OE2-NH1 3.38Å; E120-R366 IonicContact OE2-NH2 2.86Å; E120-R366 PolarHBondContact OE2-NH2 3.02Å; E120-R366 VanDerWaalsContact OE2-NH2 3.11Å; E255-R366 IonicContact OE1-CZ 2.71Å; E255-R366 IonicContact OE1-NE 3.15Å; E255-R366 PolarHBondContact OE1-NE 3.35Å; E255-R366 VanDerWaalsContact OE1-NE 3.14Å; E255-R366 IonicContact OE1-NH2 3.81Å; E255-R366 PolarHBondContact OE1-NH2 3.37Å; I338-R366 CarbonylContact C-O 3.6Å; I338-R366 WeakPolarHBondContact CA-O 3.13Å; T339-R366 PolarHBondContact N-O 3.04Å; T339-R366 PolarHBondContact O-N 2.97Å; L352-R366 HydrophobicContact CD2-CB 4.04Å; R366-R368 VanDerWaalsContact CD-CZ 3.47Å; R366-R368 HydrophobicContact CG-CG 4.15Å; R366-R368 VanDerWaalsContact NE-NH2 3.13Å
367	M	96.2	Very high	92	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.8	172.6	-67.5	-163.2	-71.1	0	0	110.5	I248 L249 Y253 L269 I336 M337 I338 Y365	I248-M367 HydrophobicContact CG2-CE 4.46Å; I248-M367 HydrophobicContact CG2-CG 4.2Å; I248-M367 HydrophobicContact CG2-SD 3.74Å; L249-M367 HydrophobicContact CD2-SD 4.47Å; Y253-M367 VanDerWaalsContact CB-CE 3.43Å; Y253-M367 HydrophobicContact CD1-CB 4.47Å; Y253-M367 HydrophobicContact CD1-CE 4.21Å; Y253-M367 HydrophobicContact CD2-CB 4.34Å; Y253-M367 HydrophobicContact CD2-CE 3.46Å; Y253-M367 VanDerWaalsContact CD2-CE 3.46Å; Y253-M367 HydrophobicContact CD2-CG 4.34Å; Y253-M367 HydrophobicContact CE1-CB 4.19Å; Y253-M367 HydrophobicContact CE2-CB 4.08Å; Y253-M367 HydrophobicContact CE2-CE 4.28Å; Y253-M367 HydrophobicContact CE2-CG 4.26Å; Y253-M367 HydrophobicContact CG-CE 3.42Å; Y253-M367 VanDerWaalsContact CG-CE 3.42Å; Y253-M367 PolarHBondContact OH-N 3.33Å; L269-M367 HydrophobicContact CB-CE 4.05Å; L269-M367 HydrophobicContact CD2-CB 4.2Å; L269-M367 HydrophobicContact CD2-CE 4.37Å; L269-M367 HydrophobicContact CD2-SD 4.35Å; I336-M367 HydrophobicContact CG2-SD 4.45Å; M337-M367 CarbonylContact O-C 3.6Å; M337-M367 VanDerWaalsContact O-CA 3.3Å; M337-M367 WeakPolarHBondContact O-CA 3.34Å; I338-M367 HydrophobicContact CG1-CG 4.18Å; I338-M367 HydrophobicContact CG1-SD 4.43Å; I338-M367 HydrophobicContact CG2-CG 4.41Å; Y365-M367 HydrophobicContact CD2-CG 4.31Å
368	R	96.4	Very high	92.2	Very high	25 Å²	25	23.5 Å²	23.5	9%	0.094	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.9	174.2	-66.1	-67.7	-180	-99	9.2	110.8	H70 V71 L115 Y253 E255 I336 M337 R366	H70-R368 WeakPolarHBondContact O-CD 3.38Å; H70-R368 PolarHBondContact O-NE 3.36Å; H70-R368 PolarHBondContact O-NH1 3.07Å; V71-R368 CarbonylContact O-C 3.55Å; V71-R368 WeakPolarHBondContact O-CA 3.28Å; L115-R368 HydrophobicContact CD1-CB 3.77Å; L115-R368 HydrophobicContact CD1-CG 4.2Å; L115-R368 HydrophobicContact CD2-CG 4.07Å; Y253-R368 PolarHBondContact OH-NH1 3.35Å; E255-R368 VanDerWaalsContact CD-NH2 3.26Å; E255-R368 IonicContact OE1-CZ 2.85Å; E255-R368 IonicContact OE1-NH1 3.21Å; E255-R368 IonicContact OE1-NH2 3.27Å; E255-R368 PolarHBondContact OE1-NH2 3.13Å; E255-R368 IonicContact OE2-CZ 2.59Å; E255-R368 IonicContact OE2-NH1 3.11Å; E255-R368 PolarHBondContact OE2-NH1 3.02Å; E255-R368 IonicContact OE2-NH2 2.96Å; E255-R368 PolarHBondContact OE2-NH2 3.08Å; I336-R368 CarbonylContact C-O 3.46Å; I336-R368 WeakPolarHBondContact CA-O 3.38Å; M337-R368 PolarHBondContact N-O 3.22Å; M337-R368 PolarHBondContact O-N 2.83Å; R366-R368 VanDerWaalsContact CD-CZ 3.47Å; R366-R368 HydrophobicContact CG-CG 4.15Å; R366-R368 VanDerWaalsContact NE-NH2 3.13Å
369	L	97.3	Very high	92.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.6	167.2	-66.7	178.2	0	0	0	109.3	F67 V71 V72 A73 L269 M273 S335 I336 L372	F67-L369 HydrophobicContact CD1-CD1 3.9Å; F67-L369 HydrophobicContact CD2-CD1 4.36Å; F67-L369 HydrophobicContact CE1-CD1 3.51Å; F67-L369 HydrophobicContact CE2-CD1 4.03Å; F67-L369 HydrophobicContact CG-CD1 4.33Å; F67-L369 HydrophobicContact CZ-CD1 3.59Å; V71-L369 HydrophobicContact CG1-CD1 3.97Å; V71-L369 HydrophobicContact CG1-CG 3.9Å; V71-L369 PolarHBondContact O-N 3.42Å; V72-L369 HydrophobicContact CG2-CB 4.3Å; V72-L369 HydrophobicContact CG2-CD1 4.39Å; A73-L369 PolarHBondContact N-O 2.61Å; L269-L369 HydrophobicContact CD1-CD1 4.33Å; L269-L369 HydrophobicContact CD2-CD2 4.32Å; L269-L369 HydrophobicContact CD2-CG 4.38Å; M273-L369 HydrophobicContact CE-CD2 3.87Å; M273-L369 HydrophobicContact CG-CD1 4.43Å; M273-L369 HydrophobicContact SD-CD1 4.31Å; M273-L369 HydrophobicContact SD-CD2 3.74Å; S335-L369 WeakPolarHBondContact O-CA 3.38Å; I336-L369 HydrophobicContact CB-CD2 4.43Å; I336-L369 HydrophobicContact CG1-CD2 3.54Å; L369-L372 HydrophobicContact CB-CD1 3.82Å; L369-L372 HydrophobicContact CB-CG 4.41Å; L369-L372 HydrophobicContact CD1-CD1 4.34Å
370	I	95.8	Very high	93.2	Very high	24 Å²	24	21.8 Å²	21.8	12%	0.123	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	174.8	172.8	63	161.5	0	0	0	110.1	A73 L115 C334 S335 M337 L372	A73-I370 HydrophobicContact CB-CG2 4.07Å; L115-I370 HydrophobicContact CD1-CG2 3.33Å; C334-I370 WeakPolarHBondContact CA-O 3.48Å; C334-I370 VanDerWaalsContact CB-O 3.25Å; C334-I370 WeakPolarHBondContact CB-O 3.39Å; S335-I370 PolarHBondContact N-O 3.28Å; S335-I370 PolarHBondContact O-N 3.45Å; M337-I370 HydrophobicContact CG-CD1 3.93Å; M337-I370 HydrophobicContact CG-CG1 4.14Å; M337-I370 HydrophobicContact SD-CD1 3.5Å; M337-I370 WeakPolarHBondContact SD-CD1 3.26Å; M337-I370 HydrophobicContact SD-CG1 4.18Å; M337-I370 HydrophobicContact SD-CG2 4.26Å; I370-L372 PolarHBondContact O-N 3.2Å
371	D	93.2	Very high	93.7	Very high	31 Å²	31	21.6 Å²	21.6	17%	0.166	11%	0.112	C	C	.	.			trans	58.2	29.7	179.1	-64.8	-7	0	0	0	112.8	R37 K135 D373	R37-D371 IonicContact CZ-OD1 2.79Å; R37-D371 IonicContact NH1-OD1 3.29Å; R37-D371 PolarHBondContact NH1-OD1 3.03Å; K135-D371 IonicContact NZ-OD2 3.86Å; D371-D373 PolarHBondContact O-N 3.28Å
372	L	95.2	Very high	94.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.131	C	C	.	.			trans	-77.6	44.6	171.1	-67.3	170.6	0	0	0	110.8	F59 C60 M63 V72 S330 L331 C334 L369 I370	F59-L372 WeakPolarHBondContact CD1-O 3.45Å; C60-L372 PolarHBondContact SG-O 3.17Å; M63-L372 HydrophobicContact CB-CB 4.34Å; M63-L372 HydrophobicContact CB-CD1 4.15Å; M63-L372 HydrophobicContact CE-CD2 3.81Å; M63-L372 HydrophobicContact CG-CB 4.34Å; V72-L372 HydrophobicContact CB-CD1 4.27Å; V72-L372 HydrophobicContact CG1-CD1 3.71Å; V72-L372 HydrophobicContact CG2-CD1 3.61Å; S330-L372 VanDerWaalsContact OG-CA 3.25Å; S330-L372 WeakPolarHBondContact OG-CA 3.47Å; S330-L372 PolarHBondContact OG-O 3.46Å; L331-L372 HydrophobicContact CD2-CD2 3.74Å; C334-L372 HydrophobicContact CB-CD2 3.58Å; C334-L372 HydrophobicContact CB-CG 4.15Å; L369-L372 HydrophobicContact CB-CD1 3.82Å; L369-L372 HydrophobicContact CB-CG 4.41Å; L369-L372 HydrophobicContact CD1-CD1 4.34Å; I370-L372 PolarHBondContact O-N 3.2Å
373	D	92.3	Very high	94.5	Very high	18 Å²	18	23.9 Å²	23.9	10%	0.096	13%	0.129	C	C	.	.			trans	-69	154.4	-176.2	-63.9	-8.1	0	0	0	110.6	R37 N56 S330 D371	R37-D373 IonicContact NH1-OD1 3.66Å; R37-D373 IonicContact NH2-OD1 3.78Å; R37-D373 IonicContact NH2-OD2 3.43Å; R37-D373 PolarHBondContact NH2-OD2 3.49Å; N56-D373 WeakPolarHBondContact OD1-CB 3.5Å; S330-D373 PolarHBondContact OG-N 2.94Å; S330-D373 PolarHBondContact OG-O 3.25Å; D371-D373 PolarHBondContact O-N 3.28Å
374	Y	92.9	Very high	94.8	Very high	45 Å²	45	23.9 Å²	23.9	18%	0.176	13%	0.129	C	C	.	.			trans	-64.3	134.9	173.8	172.7	-115.5	0	0	0	110.6	D55 N56 F59 M326	D55-Y374 HydrophobicContact CB-CD1 4.37Å; N56-Y374 PolarHBondContact OD1-N 3.47Å; F59-Y374 AromaticContact CD2-CD2 3.87Å; F59-Y374 HydrophobicContact CD2-CD2 3.87Å; F59-Y374 HydrophobicContact CE2-CD2 4.16Å; F59-Y374 HydrophobicContact CG-CD2 4.31Å; M326-Y374 HydrophobicContact SD-CE2 3.63Å
375	K	92.8	Very high	95	Very high	23 Å²	23	26.3 Å²	26.3	10%	0.1	15%	0.146	C	C	.	.			trans	-112.5	103.2	177.2	-54.2	-56.3	176.3	-169.9	0	108.8	A329 K379 L380	A329-K375 HydrophobicContact CB-CB 3.82Å; A329-K375 HydrophobicContact CB-CG 3.82Å; K375-K379 HydrophobicContact CD-CD 4.42Å; K375-L380 HydrophobicContact CB-CD1 3.68Å; K375-L380 WeakPolarHBondContact O-CD1 3.25Å
376	S	90.8	Very high	95.1	Very high	32 Å²	32	30.9 Å²	30.9	22%	0.224	16%	0.163	C	C	.	.			trans	-60	155.2	-179.6	65.9	0	0	0	0	112.6	A378 K379 L380	S376-A378 PolarHBondContact O-N 2.86Å; S376-K379 WeakPolarHBondContact O-CB 3.49Å; S376-K379 PolarHBondContact O-N 3.23Å; S376-K379 PolarHBondContact OG-N 3.2Å; S376-L380 VanDerWaalsContact O-CD1 3.3Å; S376-L380 WeakPolarHBondContact O-CD1 3.29Å; S376-L380 PolarHBondContact O-N 2.87Å
377	P	92.8	Very high	95.2	Very high	11 Å²	11	30 Å²	30	7%	0.071	16%	0.16	C	C	.	.	H	α-helix	trans	-46	-44.6	171.8	-32.8	37.4	0	0	0	113.4	F291 M295 I310 K379 L380 V381	F291-P377 HydrophobicContact CB-CB 4.15Å; F291-P377 HydrophobicContact CD1-CB 3.66Å; F291-P377 HydrophobicContact CD1-CG 3.98Å; F291-P377 HydrophobicContact CD2-CB 4.42Å; F291-P377 HydrophobicContact CE1-CB 4.15Å; F291-P377 HydrophobicContact CE1-CG 4.02Å; F291-P377 HydrophobicContact CG-CB 3.83Å; M295-P377 HydrophobicContact SD-CB 4.27Å; I310-P377 HydrophobicContact CD1-CB 3.85Å; I310-P377 HydrophobicContact CD1-CG 3.7Å; P377-K379 VanDerWaalsContact C-N 3.34Å; P377-K379 PolarHBondContact O-N 2.95Å; P377-L380 PolarHBondContact O-N 2.89Å; P377-L380 VanDerWaalsContact O-N 3.09Å; P377-V381 WeakPolarHBondContact O-CG2 3.49Å; P377-V381 PolarHBondContact O-N 3.25Å
378	A	92.7	Very high	95.2	Very high	52 Å²	52	33.8 Å²	33.8	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-59.7	-39.3	177	0	0	0	0	0	113.2	S376 L380 V381 S382	S376-A378 PolarHBondContact O-N 2.86Å; A378-L380 VanDerWaalsContact C-N 3.33Å; A378-L380 PolarHBondContact O-N 3.24Å; A378-V381 PolarHBondContact O-N 3.45Å; A378-S382 WeakPolarHBondContact O-CB 3.45Å; A378-S382 PolarHBondContact O-N 3.32Å
379	K	93.6	Very high	95.1	Very high	99 Å²	99	36.5 Å²	36.5	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-65	-35.9	175.4	-74	178.2	-178.8	169.8	0	111.8	K375 S376 P377 Y383	K375-K379 HydrophobicContact CD-CD 4.42Å; S376-K379 WeakPolarHBondContact O-CB 3.49Å; S376-K379 PolarHBondContact O-N 3.23Å; S376-K379 PolarHBondContact OG-N 3.2Å; P377-K379 VanDerWaalsContact C-N 3.34Å; P377-K379 PolarHBondContact O-N 2.95Å; K379-Y383 WeakPolarHBondContact O-CB 3.21Å; K379-Y383 PolarHBondContact O-N 3.19Å
380	L	95.9	Very high	95	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-71.8	-38.9	176.8	-82.6	78.8	0	0	0	111.8	I287 F291 A329 K375 S376 P377 A378 Y383 A384	I287-L380 HydrophobicContact CG2-CD2 4.5Å; F291-L380 HydrophobicContact CD2-CB 4.02Å; F291-L380 HydrophobicContact CD2-CD2 4.36Å; F291-L380 HydrophobicContact CE2-CB 4.06Å; F291-L380 HydrophobicContact CE2-CD2 3.58Å; F291-L380 HydrophobicContact CE2-CG 4.33Å; F291-L380 HydrophobicContact CZ-CD2 4.45Å; A329-L380 HydrophobicContact CB-CD1 3.8Å; A329-L380 HydrophobicContact CB-CD2 4.16Å; A329-L380 HydrophobicContact CB-CG 4.02Å; K375-L380 HydrophobicContact CB-CD1 3.68Å; K375-L380 WeakPolarHBondContact O-CD1 3.25Å; S376-L380 VanDerWaalsContact O-CD1 3.3Å; S376-L380 WeakPolarHBondContact O-CD1 3.29Å; S376-L380 PolarHBondContact O-N 2.87Å; P377-L380 PolarHBondContact O-N 2.89Å; P377-L380 VanDerWaalsContact O-N 3.09Å; A378-L380 VanDerWaalsContact C-N 3.33Å; A378-L380 PolarHBondContact O-N 3.24Å; L380-Y383 WeakPolarHBondContact O-CB 3.49Å; L380-Y383 PolarHBondContact O-N 3.29Å; L380-A384 PolarHBondContact O-N 2.96Å; L380-A384 VanDerWaalsContact O-N 3.15Å
381	V	97.5	Very high	95	Very high	26 Å²	26	36.4 Å²	36.4	16%	0.158	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-48.2	172.5	171.6	0	0	0	0	111.1	F291 K292 P377 A378 Y383 A384 S385	F291-V381 HydrophobicContact CB-CG2 3.85Å; K292-V381 HydrophobicContact CD-CG1 4.4Å; K292-V381 VanDerWaalsContact CE-CG1 3.43Å; K292-V381 HydrophobicContact CG-CG1 4.08Å; K292-V381 HydrophobicContact CG-CG2 4.02Å; P377-V381 WeakPolarHBondContact O-CG2 3.49Å; P377-V381 PolarHBondContact O-N 3.25Å; A378-V381 PolarHBondContact O-N 3.45Å; V381-Y383 VanDerWaalsContact C-N 3.28Å; V381-Y383 PolarHBondContact O-N 3.43Å; V381-A384 PolarHBondContact O-N 3.25Å; V381-S385 PolarHBondContact O-N 3.36Å
382	S	97.1	Very high	94.9	Very high	59 Å²	59	40.8 Å²	40.8	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-38.7	175.5	173.5	0	0	0	0	112.2	A378 S385 R386	A378-S382 WeakPolarHBondContact O-CB 3.45Å; A378-S382 PolarHBondContact O-N 3.32Å; S382-S385 PolarHBondContact O-N 3.33Å; S382-R386 WeakPolarHBondContact O-CG 3.13Å; S382-R386 PolarHBondContact O-N 3.04Å
383	Y	97.4	Very high	94.5	Very high	24 Å²	24	41.4 Å²	41.4	9%	0.094	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-44.2	176.1	174.7	-104.2	0	0	0	112.7	Q138 S153 L157 P284 K379 L380 V381 R386 L387	Q138-Y383 PolarHBondContact OE1-OH 3.26Å; S153-Y383 WeakPolarHBondContact CB-OH 3.33Å; S153-Y383 PolarHBondContact OG-OH 3.27Å; S153-Y383 VanDerWaalsContact OG-OH 3.14Å; L157-Y383 HydrophobicContact CD1-CD2 4.27Å; L157-Y383 HydrophobicContact CD1-CE2 3.74Å; P284-Y383 HydrophobicContact CB-CD1 4.08Å; P284-Y383 HydrophobicContact CB-CE1 3.82Å; K379-Y383 WeakPolarHBondContact O-CB 3.21Å; K379-Y383 PolarHBondContact O-N 3.19Å; L380-Y383 WeakPolarHBondContact O-CB 3.49Å; L380-Y383 PolarHBondContact O-N 3.29Å; V381-Y383 VanDerWaalsContact C-N 3.28Å; V381-Y383 PolarHBondContact O-N 3.43Å; Y383-R386 PolarHBondContact O-N 3.03Å; Y383-L387 HydrophobicContact CD1-CD1 4.13Å; Y383-L387 HydrophobicContact CE1-CD1 3.53Å; Y383-L387 HydrophobicContact CE1-CG 4.4Å; Y383-L387 HydrophobicContact CE2-CD1 4.41Å; Y383-L387 PolarHBondContact O-N 3.32Å; Y383-L387 VanDerWaalsContact O-N 3.15Å
384	A	97.7	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-44	176.5	0	0	0	0	0	111.9	P284 F285 L380 V381 R386 L387 E388	P284-A384 WeakPolarHBondContact O-CB 3.33Å; F285-A384 HydrophobicContact CD1-CB 4.36Å; L380-A384 PolarHBondContact O-N 2.96Å; L380-A384 VanDerWaalsContact O-N 3.15Å; V381-A384 PolarHBondContact O-N 3.25Å; A384-R386 VanDerWaalsContact C-N 3.32Å; A384-R386 PolarHBondContact O-N 3.44Å; A384-L387 WeakPolarHBondContact O-CB 3.36Å; A384-L387 PolarHBondContact O-N 2.93Å; A384-E388 WeakPolarHBondContact O-CG 3.44Å; A384-E388 PolarHBondContact O-N 3.42Å
385	S	97.8	Very high	93.6	Very high	52 Å²	52	45.2 Å²	45.2	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-46.2	175.5	-169.5	0	0	0	0	111.6	V381 S382 L387 E388 D389	V381-S385 PolarHBondContact O-N 3.36Å; S382-S385 PolarHBondContact O-N 3.33Å; S385-L387 PolarHBondContact O-N 2.98Å; S385-E388 WeakPolarHBondContact O-CB 3.48Å; S385-E388 PolarHBondContact O-N 2.94Å; S385-E388 VanDerWaalsContact O-N 3.11Å; S385-D389 PolarHBondContact O-N 3.16Å
386	R	97.3	Very high	93.2	Very high	103 Å²	103	51 Å²	51	39%	0.389	27%	0.266	S	S	.	.	H	α-helix	trans	-62.7	-31.2	177.3	-72.3	-176.6	-67.9	126.3	-9.3	113.1	L157 S382 Y383 A384 A390	L157-R386 HydrophobicContact CD2-CB 3.79Å; S382-R386 WeakPolarHBondContact O-CG 3.13Å; S382-R386 PolarHBondContact O-N 3.04Å; Y383-R386 PolarHBondContact O-N 3.03Å; A384-R386 VanDerWaalsContact C-N 3.32Å; A384-R386 PolarHBondContact O-N 3.44Å; R386-A390 WeakPolarHBondContact O-CB 3.26Å; R386-A390 PolarHBondContact O-N 3.38Å; R386-A390 VanDerWaalsContact O-N 3.08Å
387	L	97.2	Very high	92.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-72.1	-41.4	173.2	-71	176.6	0	0	0	111.4	L156 L157 P284 F285 Y383 A384 S385 D389 A390 L391	L156-L387 HydrophobicContact CB-CD2 4.49Å; L156-L387 HydrophobicContact CD1-CD2 4.39Å; L157-L387 HydrophobicContact CD1-CD2 4.17Å; L157-L387 HydrophobicContact CD2-CD2 4.05Å; L157-L387 HydrophobicContact CG-CD2 3.87Å; P284-L387 HydrophobicContact CB-CD1 3.84Å; P284-L387 HydrophobicContact CG-CD1 3.85Å; F285-L387 HydrophobicContact CE1-CB 4.04Å; F285-L387 HydrophobicContact CZ-CB 4.19Å; Y383-L387 HydrophobicContact CD1-CD1 4.13Å; Y383-L387 HydrophobicContact CE1-CD1 3.53Å; Y383-L387 HydrophobicContact CE1-CG 4.4Å; Y383-L387 HydrophobicContact CE2-CD1 4.41Å; Y383-L387 PolarHBondContact O-N 3.32Å; Y383-L387 VanDerWaalsContact O-N 3.15Å; A384-L387 WeakPolarHBondContact O-CB 3.36Å; A384-L387 PolarHBondContact O-N 2.93Å; S385-L387 PolarHBondContact O-N 2.98Å; L387-D389 VanDerWaalsContact C-N 3.33Å; L387-D389 PolarHBondContact O-N 2.87Å; L387-A390 PolarHBondContact O-N 3.16Å; L387-L391 VanDerWaalsContact O-CG 3.26Å; L387-L391 WeakPolarHBondContact O-CG 3.33Å; L387-L391 PolarHBondContact O-N 3.46Å
388	E	96.4	Very high	91.8	Very high	79 Å²	79	56.8 Å²	56.8	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-59.3	-44.3	174.9	-68.5	170.8	175.7	0	0	111.3	F285 A384 S385 A390 L391 K392	F285-E388 HydrophobicContact CD1-CG 4.12Å; F285-E388 HydrophobicContact CE1-CG 3.77Å; A384-E388 WeakPolarHBondContact O-CG 3.44Å; A384-E388 PolarHBondContact O-N 3.42Å; S385-E388 WeakPolarHBondContact O-CB 3.48Å; S385-E388 PolarHBondContact O-N 2.94Å; S385-E388 VanDerWaalsContact O-N 3.11Å; E388-A390 PolarHBondContact O-N 3.04Å; E388-L391 PolarHBondContact O-N 3.24Å; E388-K392 WeakPolarHBondContact O-CG 3.46Å; E388-K392 PolarHBondContact O-N 2.88Å; E388-K392 VanDerWaalsContact O-N 3.11Å
389	D	94.2	Very high	90.9	Very high	82 Å²	82	55.1 Å²	55.1	44%	0.439	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-41.2	175.9	-63.3	-29.1	0	0	0	111.8	S385 L387 L391 K392 L393	S385-D389 PolarHBondContact O-N 3.16Å; L387-D389 VanDerWaalsContact C-N 3.33Å; L387-D389 PolarHBondContact O-N 2.87Å; D389-L391 VanDerWaalsContact C-N 3.33Å; D389-L391 PolarHBondContact O-N 3.48Å; D389-K392 PolarHBondContact O-N 2.94Å; D389-L393 WeakPolarHBondContact O-CB 3.5Å; D389-L393 PolarHBondContact O-N 3.11Å; D389-L393 VanDerWaalsContact O-N 3.1Å
390	A	94.9	Very high	89.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-36.9	175.4	0	0	0	0	0	112.5	L156 V160 R386 L387 E388 L393 V394	L156-A390 HydrophobicContact CB-CB 3.98Å; V160-A390 HydrophobicContact CG2-CB 3.48Å; V160-A390 VanDerWaalsContact CG2-CB 3.48Å; R386-A390 WeakPolarHBondContact O-CB 3.26Å; R386-A390 PolarHBondContact O-N 3.38Å; R386-A390 VanDerWaalsContact O-N 3.08Å; L387-A390 PolarHBondContact O-N 3.16Å; E388-A390 PolarHBondContact O-N 3.04Å; A390-L393 PolarHBondContact O-N 2.88Å; A390-V394 WeakPolarHBondContact O-CG2 3.49Å; A390-V394 PolarHBondContact O-N 3.25Å
391	L	94.7	Very high	88.8	Confident	22 Å²	22	62.7 Å²	62.7	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-46.2	177	-72.3	171.1	0	0	0	111.7	L145 V148 L156 F285 L387 E388 D389 L393 V394 N395	L145-L391 HydrophobicContact CD1-CD1 4.15Å; L145-L391 HydrophobicContact CD1-CD2 4.16Å; L145-L391 HydrophobicContact CD1-CG 4.47Å; V148-L391 HydrophobicContact CG2-CD1 3.79Å; V148-L391 HydrophobicContact CG2-CD2 4.16Å; L156-L391 HydrophobicContact CD1-CD2 3.86Å; L156-L391 HydrophobicContact CD1-CG 4.38Å; F285-L391 HydrophobicContact CZ-CD1 3.89Å; L387-L391 VanDerWaalsContact O-CG 3.26Å; L387-L391 WeakPolarHBondContact O-CG 3.33Å; L387-L391 PolarHBondContact O-N 3.46Å; E388-L391 PolarHBondContact O-N 3.24Å; D389-L391 VanDerWaalsContact C-N 3.33Å; D389-L391 PolarHBondContact O-N 3.48Å; L391-L393 VanDerWaalsContact C-N 3.32Å; L391-L393 PolarHBondContact O-N 2.97Å; L391-V394 PolarHBondContact O-N 3.1Å; L391-N395 VanDerWaalsContact O-CG 3.29Å; L391-N395 PolarHBondContact O-N 3.1Å; L391-N395 PolarHBondContact O-ND2 3.48Å
392	K	92.6	Very high	88	Confident	124 Å²	124	68.3 Å²	68.3	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-56.3	-49.6	175.3	-68.2	173.3	-174.5	170.3	0	110.8	E388 D389 V394 N395 E396	E388-K392 WeakPolarHBondContact O-CG 3.46Å; E388-K392 PolarHBondContact O-N 2.88Å; E388-K392 VanDerWaalsContact O-N 3.11Å; D389-K392 PolarHBondContact O-N 2.94Å; K392-V394 VanDerWaalsContact C-N 3.34Å; K392-V394 PolarHBondContact O-N 3.03Å; K392-N395 PolarHBondContact O-N 3.34Å; K392-N395 VanDerWaalsContact O-N 3.16Å; K392-E396 WeakPolarHBondContact O-CG 3.36Å; K392-E396 PolarHBondContact O-N 3.11Å; K392-E396 VanDerWaalsContact O-N 3.08Å
393	L	85.8	Confident	87.5	Confident	13 Å²	13	66 Å²	66	7%	0.068	33%	0.327	C	S	.	.	H	α-helix	trans	-59.3	-41.4	179.3	176.9	152.4	0	0	0	113.3	V160 R163 D389 A390 L391 N395 E396 S397 W399	V160-L393 HydrophobicContact CB-CD1 4.48Å; V160-L393 HydrophobicContact CG1-CD1 4.37Å; V160-L393 HydrophobicContact CG2-CD1 4.05Å; V160-L393 HydrophobicContact CG2-CD2 4.43Å; R163-L393 VanDerWaalsContact NH1-CG 3.29Å; D389-L393 WeakPolarHBondContact O-CB 3.5Å; D389-L393 PolarHBondContact O-N 3.11Å; D389-L393 VanDerWaalsContact O-N 3.1Å; A390-L393 PolarHBondContact O-N 2.88Å; L391-L393 VanDerWaalsContact C-N 3.32Å; L391-L393 PolarHBondContact O-N 2.97Å; L393-N395 VanDerWaalsContact C-N 3.35Å; L393-E396 PolarHBondContact O-N 3.43Å; L393-S397 WeakPolarHBondContact O-CB 3.39Å; L393-S397 PolarHBondContact O-N 3.08Å; L393-S397 PolarHBondContact O-OG 3.5Å; L393-W399 HydrophobicContact CD2-CZ2 4.25Å; L393-W399 VanDerWaalsContact CD2-NE1 3.29Å
394	V	83.3	Confident	87.1	Confident	15 Å²	15	69.1 Å²	69.1	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-71	-32.7	179.4	168	0	0	0	0	111.8	Y151 L156 M159 A390 L391 K392 E396 S397 W399	Y151-V394 HydrophobicContact CD2-CG1 3.92Å; Y151-V394 HydrophobicContact CE2-CG1 3.71Å; L156-V394 HydrophobicContact CD2-CB 4.3Å; L156-V394 HydrophobicContact CD2-CG2 3.71Å; M159-V394 HydrophobicContact CE-CG2 4.27Å; A390-V394 WeakPolarHBondContact O-CG2 3.49Å; A390-V394 PolarHBondContact O-N 3.25Å; L391-V394 PolarHBondContact O-N 3.1Å; K392-V394 VanDerWaalsContact C-N 3.34Å; K392-V394 PolarHBondContact O-N 3.03Å; V394-E396 VanDerWaalsContact C-N 3.35Å; V394-S397 VanDerWaalsContact O-O 3.05Å; V394-W399 HydrophobicContact CG2-CG 4.49Å
395	N	83.5	Confident	86.8	Confident	129 Å²	129	71.7 Å²	71.7	69%	0.69	37%	0.366	S	S	*	.	H	α-helix	trans	-71.4	-30	176	-69.7	-19.6	0	0	0	112.7	L391 K392 L393	L391-N395 VanDerWaalsContact O-CG 3.29Å; L391-N395 PolarHBondContact O-N 3.1Å; L391-N395 PolarHBondContact O-ND2 3.48Å; K392-N395 PolarHBondContact O-N 3.34Å; K392-N395 VanDerWaalsContact O-N 3.16Å; L393-N395 VanDerWaalsContact C-N 3.35Å
396	E	83.5	Confident	86.7	Confident	145 Å²	145	70 Å²	70	68%	0.678	35%	0.354	S	S	*	.	H	α-helix	trans	-83.4	-11.3	179.4	-69.7	166.1	-170.8	0	0	114	K392 L393 V394	K392-E396 WeakPolarHBondContact O-CG 3.36Å; K392-E396 PolarHBondContact O-N 3.11Å; K392-E396 VanDerWaalsContact O-N 3.08Å; L393-E396 PolarHBondContact O-N 3.43Å; V394-E396 VanDerWaalsContact C-N 3.35Å
397	S	77.1	Confident	86.1	Confident	48 Å²	48	67.3 Å²	67.3	34%	0.336	35%	0.349	S	S	.	.	S	Bend	trans	-127.2	147	-168.5	-66.4	0	0	0	0	112.4	L393 V394 W399	L393-S397 WeakPolarHBondContact O-CB 3.39Å; L393-S397 PolarHBondContact O-N 3.08Å; L393-S397 PolarHBondContact O-OG 3.5Å; V394-S397 VanDerWaalsContact O-O 3.05Å; S397-W399 PolarHBondContact O-N 3.05Å
398	N	77.1	Confident	84.6	Confident	116 Å²	116	76.1 Å²	76.1	62%	0.62	41%	0.406	S	S	*	.			trans	-79	59.1	177	-165.5	10.3	0	0	0	112.6	K400 T401	N398-K400 VanDerWaalsContact C-N 3.26Å; N398-K400 PolarHBondContact O-N 3.16Å; N398-T401 PolarHBondContact O-OG1 3.35Å
399	W	74.7	Confident	84	Confident	16 Å²	16	76 Å²	76	6%	0.061	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-70.3	-19.4	-177	-83.4	102.9	0	0	0	114.7	M159 R163 L393 V394 S397 T401 K402 R403	M159-W399 HydrophobicContact CB-CD2 4.25Å; M159-W399 HydrophobicContact CB-CE3 4.16Å; M159-W399 HydrophobicContact CB-CH2 4.04Å; M159-W399 HydrophobicContact CB-CZ2 4.11Å; M159-W399 HydrophobicContact CB-CZ3 4.06Å; M159-W399 HydrophobicContact CE-CB 3.32Å; M159-W399 HydrophobicContact CE-CD2 3.48Å; M159-W399 VanDerWaalsContact CE-CD2 3.48Å; M159-W399 HydrophobicContact CE-CE3 3.5Å; M159-W399 VanDerWaalsContact CE-CE3 3.5Å; M159-W399 HydrophobicContact CE-CG 3.41Å; M159-W399 VanDerWaalsContact CE-CG 3.41Å; M159-W399 HydrophobicContact CE-CZ3 4.47Å; M159-W399 HydrophobicContact CG-CD2 4.39Å; M159-W399 HydrophobicContact CG-CE3 3.98Å; M159-W399 HydrophobicContact CG-CZ3 4.07Å; M159-W399 WeakPolarHBondContact O-CH2 3.38Å; M159-W399 WeakPolarHBondContact O-CZ2 3.48Å; R163-W399 HydrophobicContact CB-CZ2 4.08Å; L393-W399 HydrophobicContact CD2-CZ2 4.25Å; L393-W399 VanDerWaalsContact CD2-NE1 3.29Å; V394-W399 HydrophobicContact CG2-CG 4.49Å; S397-W399 PolarHBondContact O-N 3.05Å; W399-T401 PolarHBondContact O-N 3.29Å; W399-T401 VanDerWaalsContact O-N 3.1Å; W399-K402 HydrophobicContact CD2-CD 4.47Å; W399-K402 HydrophobicContact CE3-CB 3.74Å; W399-K402 HydrophobicContact CE3-CD 3.76Å; W399-K402 HydrophobicContact CE3-CG 4.31Å; W399-K402 HydrophobicContact CH2-CD 4.31Å; W399-K402 HydrophobicContact CZ3-CB 4.09Å; W399-K402 HydrophobicContact CZ3-CD 3.66Å; W399-K402 PolarHBondContact O-N 3.44Å; W399-R403 PolarHBondContact O-N 3.37Å
400	K	70.3	Confident	83.5	Confident	154 Å²	154	75.6 Å²	75.6	67%	0.67	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-58	-25.3	179.8	-67.7	-177.7	179.6	179.1	0	112.5	Y151 N398	Y151-K400 WeakPolarHBondContact OH-CA 3.26Å; N398-K400 VanDerWaalsContact C-N 3.26Å; N398-K400 PolarHBondContact O-N 3.16Å
401	T	74.2	Confident	82.9	Confident	109 Å²	109	79.8 Å²	79.8	67%	0.669	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-80.7	-22.1	175.3	61.1	0	0	0	0	113.4	N398 W399	N398-T401 PolarHBondContact O-OG1 3.35Å; W399-T401 PolarHBondContact O-N 3.29Å; W399-T401 VanDerWaalsContact O-N 3.1Å
402	K	80.8	Confident	82.2	Confident	144 Å²	144	83.2 Å²	83.2	63%	0.626	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-25.2	-178.2	-65.4	-174.1	178.9	-175.1	0	113.1	W399	W399-K402 HydrophobicContact CD2-CD 4.47Å; W399-K402 HydrophobicContact CE3-CB 3.74Å; W399-K402 HydrophobicContact CE3-CD 3.76Å; W399-K402 HydrophobicContact CE3-CG 4.31Å; W399-K402 HydrophobicContact CH2-CD 4.31Å; W399-K402 HydrophobicContact CZ3-CB 4.09Å; W399-K402 HydrophobicContact CZ3-CD 3.66Å; W399-K402 PolarHBondContact O-N 3.44Å
403	R	87.3	Confident	81.5	Confident	12 Å²	12	80.7 Å²	80.7	5%	0.045	44%	0.442	C	S	.	.	S	Bend	trans	-152.7	129.3	177.9	-178.9	169.9	-177	73.8	7.7	110.1	Y151 C155 M159 Y171 D172 F173 W399	Y151-R403 HydrophobicContact CD1-CG 4.49Å; Y151-R403 HydrophobicContact CE1-CB 4.36Å; Y151-R403 HydrophobicContact CE1-CG 4.14Å; Y151-R403 WeakPolarHBondContact CE1-O 3.22Å; Y151-R403 PolarHBondContact OH-O 3.33Å; Y151-R403 VanDerWaalsContact OH-O 3.04Å; C155-R403 VanDerWaalsContact SG-CZ 3.52Å; C155-R403 PolarHBondContact SG-NE 2.85Å; C155-R403 PolarHBondContact SG-NH2 3.19Å; M159-R403 HydrophobicContact CE-CB 4.32Å; Y171-R403 PolarHBondContact O-NH1 2.96Å; D172-R403 PolarHBondContact O-NH1 3.03Å; D172-R403 VanDerWaalsContact O-NH1 3.16Å; D172-R403 PolarHBondContact O-NH2 3.46Å; F173-R403 PolarHBondContact O-NH2 3.25Å; W399-R403 PolarHBondContact O-N 3.37Å
404	P	89	Confident	81.2	Confident	88 Å²	88	85.2 Å²	85.2	57%	0.571	47%	0.467	S	S	*	.			trans	-68.6	153.5	173.1	28.5	-34.4	0	0	0	111.7	Y151	Y151-P404 WeakPolarHBondContact CE1-O 3.32Å
405	P	91.8	Very high	81.1	Confident	54 Å²	54	90.2 Å²	90.2	35%	0.351	49%	0.494	S	S	.	.			trans	-45.8	143.9	169	-32.8	39.5	0	0	0	113.3	P150 V407	P150-P405 HydrophobicContact CB-CB 3.95Å; P150-P405 HydrophobicContact CB-CG 4.19Å; P405-V407 VanDerWaalsContact C-N 3.27Å; P405-V407 VanDerWaalsContact CB-O 3.25Å; P405-V407 WeakPolarHBondContact CB-O 3.36Å; P405-V407 PolarHBondContact O-N 3.08Å
406	C	94.4	Very high	80.9	Confident	16 Å²	16	87.2 Å²	87.2	11%	0.108	48%	0.478	C	S	.	.	S	Bend	trans	-73.6	-23.1	179.6	-66.7	0	0	0	0	113	P150 C152 C155 L176	P150-C406 PolarHBondContact O-N 3.35Å; C152-C406 HydrophobicContact CB-CB 4.44Å; C152-C406 PolarHBondContact N-SG 3.5Å; C152-C406 VanDerWaalsContact N-SG 3.35Å; C155-C406 PolarHBondContact SG-SG 3.46Å; L176-C406 HydrophobicContact CD1-CB 4.06Å
407	V	84.5	Confident	80.7	Confident	47 Å²	47	82.4 Å²	82.4	29%	0.285	46%	0.462	S	S	.	.			trans	-125.6	128.9	169.5	-176.7	0	0	0	0	105.2	F141 L176 P405	F141-V407 HydrophobicContact CD1-CG2 3.81Å; F141-V407 HydrophobicContact CE1-CG2 4.27Å; L176-V407 HydrophobicContact CD1-CG2 4.19Å; P405-V407 VanDerWaalsContact C-N 3.27Å; P405-V407 VanDerWaalsContact CB-O 3.25Å; P405-V407 WeakPolarHBondContact CB-O 3.36Å; P405-V407 PolarHBondContact O-N 3.08Å
408	P	66.9	Low	81	Confident	185 Å²	185	85.5 Å²	85.5	100%	1.201	47%	0.473	S	S	*	.			trans	-59.9	0	180	24	-32.8	0	0	0	112.9

Retrieved 408 of 408 residues in 1213.5 ms (Link to these results)

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