G4VH79_SCHMA Loading...

Calponin-homology (CH) domain-containing protein

AlphaFold DB , UniProt , Accession G4VH79, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 238 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	41.5	Very low	79.8	Confident	194 Å²	194	88.7 Å²	88.7	96%	0.956	42%	0.422	S	S	*	.				0	143.1	0	-67	-166.7	-174.3	0	0	106.5	E3	M1-E3 PolarHBondContact O-N 3.29Å; M1-E3 VanDerWaalsContact O-N 3.07Å
2	A	57.2	Low	80.8	Confident	43 Å²	43	81.3 Å²	81.3	36%	0.355	39%	0.387	S	S	.	.			trans	-63.8	115.4	172.8	0	0	0	0	0	107.8	N92 I95	A2-N92 WeakPolarHBondContact CB-OD1 3.42Å; A2-I95 HydrophobicContact CB-CD1 3.74Å; A2-I95 WeakPolarHBondContact O-CD1 3.48Å
3	E	73.7	Confident	81.4	Confident	171 Å²	171	83.9 Å²	83.9	80%	0.799	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-85	140.2	177.9	-71	171.1	-167.9	0	0	108.1	M1	M1-E3 PolarHBondContact O-N 3.29Å; M1-E3 VanDerWaalsContact O-N 3.07Å
4	I	82.3	Confident	82.1	Confident	26 Å²	26	85.9 Å²	85.9	13%	0.133	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-64.2	131.7	178	-66.8	164.6	0	0	0	107.6	R6 V8 L9 L24 I95 L98	I4-R6 PolarHBondContact O-N 3.14Å; I4-V8 HydrophobicContact CG2-CB 3.88Å; I4-V8 HydrophobicContact CG2-CG1 3.89Å; I4-L9 HydrophobicContact CB-CD1 4.48Å; I4-L9 HydrophobicContact CB-CD2 4.08Å; I4-L9 HydrophobicContact CB-CG 4.1Å; I4-L9 HydrophobicContact CD1-CD2 4.38Å; I4-L9 HydrophobicContact CG2-CD2 3.86Å; I4-L9 HydrophobicContact CG2-CG 3.79Å; I4-L24 HydrophobicContact CD1-CB 3.67Å; I4-L24 HydrophobicContact CD1-CD1 3.31Å; I4-L24 HydrophobicContact CD1-CG 4.09Å; I4-I95 HydrophobicContact CG1-CD1 4.28Å; I4-I95 HydrophobicContact CG1-CG1 3.92Å; I4-I95 HydrophobicContact CG1-CG2 4.29Å; I4-L98 HydrophobicContact CD1-CD1 4.43Å
5	P	86.7	Confident	82.7	Confident	58 Å²	58	80.8 Å²	80.8	38%	0.377	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-53.4	135	179	-25.7	33.3	0	0	0	111	E7 V8 L9	P5-E7 PolarHBondContact O-N 3.13Å; P5-E7 VanDerWaalsContact O-N 3.08Å; P5-V8 HydrophobicContact CB-CG2 4.18Å; P5-V8 HydrophobicContact CG-CG2 4.39Å; P5-V8 WeakPolarHBondContact O-CB 3.32Å; P5-V8 PolarHBondContact O-N 3.43Å; P5-L9 PolarHBondContact O-N 3.05Å; P5-L9 VanDerWaalsContact O-N 3.16Å
6	R	87.8	Confident	82.8	Confident	167 Å²	167	85.4 Å²	85.4	63%	0.63	43%	0.425	S	S	*	.	H	α-helix	trans	-56.5	-30.7	-176.6	-178.6	168.7	177.2	-113.6	3.3	113.4	I4 L9 R10	I4-R6 PolarHBondContact O-N 3.14Å; R6-L9 PolarHBondContact O-N 2.94Å; R6-R10 WeakPolarHBondContact O-CG 3.32Å; R6-R10 PolarHBondContact O-N 3.27Å
7	E	89.3	Confident	82.9	Confident	112 Å²	112	81.4 Å²	81.4	52%	0.523	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-43.8	174.4	-63.5	-172.6	-159.7	0	0	112.2	P5 R10 W11 K108	P5-E7 PolarHBondContact O-N 3.13Å; P5-E7 VanDerWaalsContact O-N 3.08Å; E7-R10 PolarHBondContact O-N 3.36Å; E7-W11 PolarHBondContact O-N 3.06Å; E7-K108 IonicContact OE2-NZ 3.29Å; E7-K108 PolarHBondContact OE2-NZ 2.93Å
8	V	89.7	Confident	82.8	Confident	2 Å²	2	82.1 Å²	82.1	1%	0.012	41%	0.411	C	S	.	.	H	α-helix	trans	-67.2	-41.9	178.6	179	0	0	0	0	110.2	I4 P5 R10 W11 L12 L98 T99 H102	I4-V8 HydrophobicContact CG2-CB 3.88Å; I4-V8 HydrophobicContact CG2-CG1 3.89Å; P5-V8 HydrophobicContact CB-CG2 4.18Å; P5-V8 HydrophobicContact CG-CG2 4.39Å; P5-V8 WeakPolarHBondContact O-CB 3.32Å; P5-V8 PolarHBondContact O-N 3.43Å; V8-R10 VanDerWaalsContact C-N 3.35Å; V8-R10 PolarHBondContact O-N 3.25Å; V8-W11 HydrophobicContact CG1-CE3 4.1Å; V8-W11 HydrophobicContact CG1-CZ3 4.4Å; V8-W11 PolarHBondContact O-N 3.23Å; V8-L12 HydrophobicContact CG1-CD1 4.38Å; V8-L12 WeakPolarHBondContact O-CG 3.06Å; V8-L12 PolarHBondContact O-N 3.21Å; V8-L98 HydrophobicContact CG1-CB 3.92Å; V8-T99 HydrophobicContact CG2-CG2 4.48Å; V8-H102 HydrophobicContact CG2-CB 4.19Å
9	L	88.2	Confident	82.7	Confident	62 Å²	62	79.3 Å²	79.3	33%	0.325	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-44	175.4	-70.4	175.5	0	0	0	112.1	I4 P5 R6 L12 L13 L24	I4-L9 HydrophobicContact CB-CD1 4.48Å; I4-L9 HydrophobicContact CB-CD2 4.08Å; I4-L9 HydrophobicContact CB-CG 4.1Å; I4-L9 HydrophobicContact CD1-CD2 4.38Å; I4-L9 HydrophobicContact CG2-CD2 3.86Å; I4-L9 HydrophobicContact CG2-CG 3.79Å; P5-L9 PolarHBondContact O-N 3.05Å; P5-L9 VanDerWaalsContact O-N 3.16Å; R6-L9 PolarHBondContact O-N 2.94Å; L9-L12 PolarHBondContact O-N 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 3.18Å; L9-L13 VanDerWaalsContact O-N 3.07Å; L9-L24 HydrophobicContact CD2-CD1 3.65Å
10	R	89.1	Confident	81.9	Confident	127 Å²	127	82.6 Å²	82.6	48%	0.479	41%	0.411	S	S	.	.	H	α-helix	trans	-62.6	-43.4	175.4	-76.1	166.8	167.6	176.3	-23.2	112	R6 E7 V8 L13 T14	R6-R10 WeakPolarHBondContact O-CG 3.32Å; R6-R10 PolarHBondContact O-N 3.27Å; E7-R10 PolarHBondContact O-N 3.36Å; V8-R10 VanDerWaalsContact C-N 3.35Å; V8-R10 PolarHBondContact O-N 3.25Å; R10-L13 WeakPolarHBondContact O-CB 3.43Å; R10-L13 PolarHBondContact O-N 3.42Å; R10-T14 WeakPolarHBondContact O-CG2 3.5Å; R10-T14 PolarHBondContact O-N 2.81Å
11	W	92.2	Very high	81.1	Confident	14 Å²	14	87.8 Å²	87.8	5%	0.053	43%	0.434	C	S	.	.	H	α-helix	trans	-59.6	-45.7	176.2	165.1	67.4	0	0	0	111.8	E7 V8 L13 T14 L15 I37 Y41 L101 H102 F105	E7-W11 PolarHBondContact O-N 3.06Å; V8-W11 HydrophobicContact CG1-CE3 4.1Å; V8-W11 HydrophobicContact CG1-CZ3 4.4Å; V8-W11 PolarHBondContact O-N 3.23Å; W11-L13 VanDerWaalsContact C-N 3.28Å; W11-L13 PolarHBondContact O-N 3.45Å; W11-T14 PolarHBondContact O-N 3.49Å; W11-T14 PolarHBondContact O-OG1 3.24Å; W11-L15 HydrophobicContact CD2-CD1 4.41Å; W11-L15 HydrophobicContact CH2-CD1 4.45Å; W11-L15 HydrophobicContact CZ2-CD1 3.9Å; W11-L15 PolarHBondContact O-N 3.21Å; W11-I37 HydrophobicContact CH2-CD1 4.08Å; W11-I37 HydrophobicContact CH2-CG1 4.43Å; W11-I37 HydrophobicContact CH2-CG2 3.68Å; W11-I37 HydrophobicContact CZ2-CG2 3.84Å; W11-I37 HydrophobicContact CZ3-CD1 4.3Å; W11-Y41 HydrophobicContact CZ2-CE2 4.04Å; W11-Y41 AromaticContact NE1-CZ 3.96Å; W11-Y41 PolarHBondContact NE1-OH 2.79Å; W11-L101 HydrophobicContact CH2-CB 3.92Å; W11-H102 WeakPolarHBondContact CB-CD2 3.41Å; W11-H102 AromaticContact CD1-CD2 3.77Å; W11-H102 HydrophobicContact CD2-CB 3.89Å; W11-H102 AromaticContact CD2-CD2 3.58Å; W11-H102 HydrophobicContact CE3-CB 3.6Å; W11-H102 AromaticContact CG-CD2 3.26Å; W11-H102 HydrophobicContact CH2-CB 4.28Å; W11-H102 HydrophobicContact CZ3-CB 3.81Å; W11-F105 HydrophobicContact CZ2-CB 4.36Å; W11-F105 HydrophobicContact CZ2-CD2 4.04Å
12	L	91.4	Very high	82.7	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-59.7	-39.3	175.9	-68.3	172.6	0	0	0	112.3	V8 L9 T14 L15 I17 L19 I37 L98	V8-L12 HydrophobicContact CG1-CD1 4.38Å; V8-L12 WeakPolarHBondContact O-CG 3.06Å; V8-L12 PolarHBondContact O-N 3.21Å; L9-L12 PolarHBondContact O-N 3.24Å; L12-T14 VanDerWaalsContact C-N 3.29Å; L12-T14 PolarHBondContact O-N 3.02Å; L12-L15 HydrophobicContact CD2-CD1 4.47Å; L12-L15 PolarHBondContact O-N 3.04Å; L12-I17 HydrophobicContact CD2-CD1 4.44Å; L12-L19 HydrophobicContact CB-CD1 3.77Å; L12-I37 HydrophobicContact CD2-CD1 3.54Å; L12-I37 HydrophobicContact CD2-CG1 3.89Å; L12-L98 HydrophobicContact CD1-CD1 4.35Å; L12-L98 HydrophobicContact CD2-CD2 4.37Å
13	L	89	Confident	83.7	Confident	115 Å²	115	83.8 Å²	83.8	60%	0.602	40%	0.404	S	S	*	.	H	α-helix	trans	-65.4	-29.5	175.1	-68.8	169.8	0	0	0	112.9	L9 R10 W11 L15 D16 L19	L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 3.18Å; L9-L13 VanDerWaalsContact O-N 3.07Å; R10-L13 WeakPolarHBondContact O-CB 3.43Å; R10-L13 PolarHBondContact O-N 3.42Å; W11-L13 VanDerWaalsContact C-N 3.28Å; W11-L13 PolarHBondContact O-N 3.45Å; L13-L15 PolarHBondContact O-N 3.44Å; L13-D16 PolarHBondContact O-N 3.48Å; L13-L19 HydrophobicContact CD2-CD1 3.94Å; L13-L19 HydrophobicContact CG-CD1 4.24Å
14	T	91.5	Very high	84.2	Confident	111 Å²	111	76.9 Å²	76.9	68%	0.681	37%	0.372	S	S	*	.	H	α-helix	trans	-72	-17	174.9	59.9	0	0	0	0	113.9	R10 W11 L12 D16	R10-T14 WeakPolarHBondContact O-CG2 3.5Å; R10-T14 PolarHBondContact O-N 2.81Å; W11-T14 PolarHBondContact O-N 3.49Å; W11-T14 PolarHBondContact O-OG1 3.24Å; L12-T14 VanDerWaalsContact C-N 3.29Å; L12-T14 PolarHBondContact O-N 3.02Å; T14-D16 VanDerWaalsContact C-N 3.26Å; T14-D16 PolarHBondContact O-N 3.41Å
15	L	90.9	Very high	84	Confident	10 Å²	10	79.2 Å²	79.2	5%	0.052	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	3.2	178.1	-60.4	175.2	0	0	0	112.9	W11 L12 L13 I17 I37 N40 Y41	W11-L15 HydrophobicContact CD2-CD1 4.41Å; W11-L15 HydrophobicContact CH2-CD1 4.45Å; W11-L15 HydrophobicContact CZ2-CD1 3.9Å; W11-L15 PolarHBondContact O-N 3.21Å; L12-L15 HydrophobicContact CD2-CD1 4.47Å; L12-L15 PolarHBondContact O-N 3.04Å; L13-L15 PolarHBondContact O-N 3.44Å; L15-I17 HydrophobicContact CB-CD1 3.72Å; L15-I17 HydrophobicContact CB-CG1 3.77Å; L15-I17 HydrophobicContact CD1-CD1 3.81Å; L15-I17 HydrophobicContact CG-CD1 4.43Å; L15-I17 PolarHBondContact O-N 3.05Å; L15-I17 VanDerWaalsContact O-N 3.13Å; L15-I37 HydrophobicContact CD1-CB 4.43Å; L15-I37 HydrophobicContact CD1-CG1 4.06Å; L15-I37 HydrophobicContact CD1-CG2 4.15Å; L15-N40 HydrophobicContact CD2-CB 4.19Å; L15-N40 WeakPolarHBondContact CD2-OD1 3.35Å; L15-N40 PolarHBondContact O-ND2 2.92Å; L15-Y41 HydrophobicContact CD1-CE2 4.24Å; L15-Y41 HydrophobicContact CD2-CE2 3.75Å
16	D	83.5	Confident	83.7	Confident	155 Å²	155	83.4 Å²	83.4	83%	0.829	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	30.6	-176.7	-157.5	27.2	0	0	0	113.4	L13 T14	L13-D16 PolarHBondContact O-N 3.48Å; T14-D16 VanDerWaalsContact C-N 3.26Å; T14-D16 PolarHBondContact O-N 3.41Å
17	I	84.8	Confident	83.6	Confident	17 Å²	17	76.3 Å²	76.3	9%	0.087	37%	0.366	C	S	.	.			trans	-79.7	131.8	175.8	-60.2	169.4	0	0	0	107.9	L12 L15 L19 L33 E36 I37	L12-I17 HydrophobicContact CD2-CD1 4.44Å; L15-I17 HydrophobicContact CB-CD1 3.72Å; L15-I17 HydrophobicContact CB-CG1 3.77Å; L15-I17 HydrophobicContact CD1-CD1 3.81Å; L15-I17 HydrophobicContact CG-CD1 4.43Å; L15-I17 PolarHBondContact O-N 3.05Å; L15-I17 VanDerWaalsContact O-N 3.13Å; I17-L19 HydrophobicContact CB-CD2 4.33Å; I17-L19 HydrophobicContact CG2-CD2 3.89Å; I17-L19 PolarHBondContact O-N 3.23Å; I17-L33 HydrophobicContact CD1-CD1 4.41Å; I17-L33 HydrophobicContact CG2-CD1 3.81Å; I17-E36 HydrophobicContact CD1-CB 4.35Å; I17-E36 HydrophobicContact CG1-CB 4.42Å; I17-E36 HydrophobicContact CG2-CB 4.47Å; I17-E36 VanDerWaalsContact CG2-OE2 3.27Å; I17-E36 WeakPolarHBondContact CG2-OE2 3.47Å; I17-I37 HydrophobicContact CD1-CB 4.47Å; I17-I37 HydrophobicContact CD1-CG1 3.56Å
18	N	81.2	Confident	83.8	Confident	93 Å²	93	71 Å²	71	50%	0.497	34%	0.341	S	S	.	.			trans	-70.5	96.2	175.4	-175.1	-9.7	0	0	0	110.6	E20 R22	N18-E20 WeakPolarHBondContact OD1-CB 3.5Å; N18-E20 PolarHBondContact OD1-N 2.82Å; N18-R22 WeakPolarHBondContact O-CD 3.44Å; N18-R22 PolarHBondContact O-NE 2.78Å
19	L	80.3	Confident	84	Confident	30 Å²	30	71 Å²	71	16%	0.157	34%	0.341	C	S	.	.			trans	-90	-3	176.4	-55.8	179.6	0	0	0	113.1	L12 L13 I17 H21 R22 L24 L33	L12-L19 HydrophobicContact CB-CD1 3.77Å; L13-L19 HydrophobicContact CD2-CD1 3.94Å; L13-L19 HydrophobicContact CG-CD1 4.24Å; I17-L19 HydrophobicContact CB-CD2 4.33Å; I17-L19 HydrophobicContact CG2-CD2 3.89Å; I17-L19 PolarHBondContact O-N 3.23Å; L19-H21 PolarHBondContact O-N 2.82Å; L19-R22 PolarHBondContact O-N 3.44Å; L19-L24 HydrophobicContact CD2-CD2 3.8Å; L19-L33 HydrophobicContact CD2-CD1 4.03Å
20	E	68	Low	84.2	Confident	144 Å²	144	68.3 Å²	68.3	67%	0.673	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	130.2	-175.1	-60.6	-171	168.2	0	0	110.5	N18 R22	N18-E20 WeakPolarHBondContact OD1-CB 3.5Å; N18-E20 PolarHBondContact OD1-N 2.82Å; E20-R22 PolarHBondContact O-N 3.21Å
21	H	63.8	Low	84.4	Confident	192 Å²	192	62.3 Å²	62.3	89%	0.889	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	10.7	-179.9	-47.7	91.5	0	0	0	115.6	L19	L19-H21 PolarHBondContact O-N 2.82Å
22	R	75.2	Confident	84.4	Confident	86 Å²	86	62.8 Å²	62.8	33%	0.325	31%	0.308	S	S	.	.			trans	-90.4	124.6	179.5	-69.4	-165.6	-168.5	-105	11.4	111.7	N18 L19 E20 L24	N18-R22 WeakPolarHBondContact O-CD 3.44Å; N18-R22 PolarHBondContact O-NE 2.78Å; L19-R22 PolarHBondContact O-N 3.44Å; E20-R22 PolarHBondContact O-N 3.21Å; R22-L24 PolarHBondContact O-N 3.38Å; R22-L24 VanDerWaalsContact O-N 3.11Å
23	N	80	Confident	84.5	Confident	67 Å²	67	62.9 Å²	62.9	36%	0.358	31%	0.308	S	S	.	.			trans	-75.2	100.1	165.6	-174.5	-13	0	0	0	108.9	K25 W26 C27	N23-K25 PolarHBondContact O-N 3.18Å; N23-K25 PolarHBondContact OD1-N 2.99Å; N23-W26 HydrophobicContact CB-CB 4.35Å; N23-W26 HydrophobicContact CB-CD2 3.89Å; N23-W26 HydrophobicContact CB-CE3 3.55Å; N23-W26 HydrophobicContact CB-CG 4.25Å; N23-W26 HydrophobicContact CB-CZ3 4.15Å; N23-W26 VanDerWaalsContact ND2-CD2 3.28Å; N23-W26 PolarHBondContact O-N 3.13Å; N23-C27 PolarHBondContact O-N 2.85Å; N23-C27 PolarHBondContact O-SG 3.29Å
24	L	82.6	Confident	84.8	Confident	26 Å²	26	57.5 Å²	57.5	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-52.2	-34.9	-173.8	-65.7	169	0	0	0	113.1	I4 L9 L19 R22 W26 C27 V28 L33	I4-L24 HydrophobicContact CD1-CB 3.67Å; I4-L24 HydrophobicContact CD1-CD1 3.31Å; I4-L24 HydrophobicContact CD1-CG 4.09Å; L9-L24 HydrophobicContact CD2-CD1 3.65Å; L19-L24 HydrophobicContact CD2-CD2 3.8Å; R22-L24 PolarHBondContact O-N 3.38Å; R22-L24 VanDerWaalsContact O-N 3.11Å; L24-W26 PolarHBondContact O-N 3.33Å; L24-C27 PolarHBondContact O-N 3.44Å; L24-V28 VanDerWaalsContact O-CG2 3.25Å; L24-V28 WeakPolarHBondContact O-CG2 3.42Å; L24-V28 PolarHBondContact O-N 3.28Å; L24-L33 HydrophobicContact CD2-CD2 3.87Å
25	K	78.9	Confident	85	Confident	76 Å²	76	52.2 Å²	52.2	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-45	176.9	-65.4	-179.6	179.5	173.7	0	112.1	N23 S29 N89	N23-K25 PolarHBondContact O-N 3.18Å; N23-K25 PolarHBondContact OD1-N 2.99Å; K25-S29 PolarHBondContact O-N 2.95Å; K25-N89 PolarHBondContact O-OD1 2.91Å
26	W	81.3	Confident	85.1	Confident	145 Å²	145	53.7 Å²	53.7	55%	0.549	25%	0.254	S	S	.	.	H	α-helix	trans	-71.8	-38.7	178.2	-64	-21.8	0	0	0	112.1	N23 L24 V28 S29 N30	N23-W26 HydrophobicContact CB-CB 4.35Å; N23-W26 HydrophobicContact CB-CD2 3.89Å; N23-W26 HydrophobicContact CB-CE3 3.55Å; N23-W26 HydrophobicContact CB-CG 4.25Å; N23-W26 HydrophobicContact CB-CZ3 4.15Å; N23-W26 VanDerWaalsContact ND2-CD2 3.28Å; N23-W26 PolarHBondContact O-N 3.13Å; L24-W26 PolarHBondContact O-N 3.33Å; W26-V28 VanDerWaalsContact C-N 3.31Å; W26-V28 PolarHBondContact O-N 3.15Å; W26-S29 PolarHBondContact O-N 2.61Å; W26-N30 WeakPolarHBondContact O-CB 3.44Å; W26-N30 PolarHBondContact O-N 3.27Å
27	C	85.7	Confident	85.7	Confident	19 Å²	19	46.3 Å²	46.3	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-35.1	177.9	-61.9	0	0	0	0	112.1	N23 L24 G31 L33	N23-C27 PolarHBondContact O-N 2.85Å; N23-C27 PolarHBondContact O-SG 3.29Å; L24-C27 PolarHBondContact O-N 3.44Å; C27-G31 PolarHBondContact O-N 3.02Å; C27-L33 HydrophobicContact CB-CB 3.92Å; C27-L33 HydrophobicContact CB-CD2 4.23Å; C27-L33 PolarHBondContact O-N 3.18Å
28	V	92.1	Very high	86.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-50.4	169.4	176.4	0	0	0	0	110.2	L24 W26 N30 G31 L33 V34 W64 A86 L97 L98	L24-V28 VanDerWaalsContact O-CG2 3.25Å; L24-V28 WeakPolarHBondContact O-CG2 3.42Å; L24-V28 PolarHBondContact O-N 3.28Å; W26-V28 VanDerWaalsContact C-N 3.31Å; W26-V28 PolarHBondContact O-N 3.15Å; V28-N30 PolarHBondContact O-N 3.12Å; V28-G31 WeakPolarHBondContact O-CA 3.44Å; V28-G31 PolarHBondContact O-N 3.47Å; V28-L33 HydrophobicContact CG2-CD2 3.84Å; V28-V34 HydrophobicContact CG1-CG2 4.39Å; V28-W64 HydrophobicContact CG1-CZ2 4.31Å; V28-W64 WeakPolarHBondContact O-CZ2 3.47Å; V28-A86 HydrophobicContact CG1-CB 4.19Å; V28-L97 HydrophobicContact CG1-CD2 3.9Å; V28-L98 HydrophobicContact CG2-CD1 3.66Å; V28-L98 HydrophobicContact CG2-CD2 4.1Å; V28-L98 HydrophobicContact CG2-CG 3.81Å
29	S	93.4	Very high	86.8	Confident	1 Å²	1	44 Å²	44	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-33.5	179.8	166.6	0	0	0	0	113.8	K25 W26 G31 K60 W64 A86 A87	K25-S29 PolarHBondContact O-N 2.95Å; W26-S29 PolarHBondContact O-N 2.61Å; S29-G31 VanDerWaalsContact C-N 3.27Å; S29-G31 PolarHBondContact O-N 3.36Å; S29-K60 PolarHBondContact OG-NZ 3.06Å; S29-W64 PolarHBondContact O-NE1 3.47Å; S29-A86 VanDerWaalsContact CA-O 3.24Å; S29-A86 WeakPolarHBondContact CA-O 3.49Å; S29-A86 WeakPolarHBondContact CB-O 3.21Å; S29-A87 PolarHBondContact OG-O 3.31Å
30	N	92.9	Very high	87.4	Confident	7 Å²	7	46.3 Å²	46.3	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-70.5	-21.4	174.9	-162	2	0	0	0	113.7	W26 V28 I32 D53 G54 N63	W26-N30 WeakPolarHBondContact O-CB 3.44Å; W26-N30 PolarHBondContact O-N 3.27Å; V28-N30 PolarHBondContact O-N 3.12Å; N30-I32 PolarHBondContact O-N 2.94Å; N30-D53 PolarHBondContact ND2-OD1 3.4Å; N30-G54 PolarHBondContact OD1-O 3.3Å; N30-N63 WeakPolarHBondContact O-CB 3.35Å; N30-N63 PolarHBondContact O-ND2 3.37Å; N30-N63 PolarHBondContact OD1-ND2 3.12Å
31	G	93.7	Very high	88.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	84.2	-21.6	-176.7	0	0	0	0	0	114.1	C27 V28 S29 L33 V34 A35 I67	C27-G31 PolarHBondContact O-N 3.02Å; V28-G31 WeakPolarHBondContact O-CA 3.44Å; V28-G31 PolarHBondContact O-N 3.47Å; S29-G31 VanDerWaalsContact C-N 3.27Å; S29-G31 PolarHBondContact O-N 3.36Å; G31-L33 PolarHBondContact O-N 3.26Å; G31-V34 WeakPolarHBondContact O-CA 3.43Å; G31-V34 WeakPolarHBondContact O-CB 3.26Å; G31-V34 PolarHBondContact O-N 3.41Å; G31-A35 PolarHBondContact O-N 3.13Å; G31-I67 VanDerWaalsContact O-CD1 3.29Å; G31-I67 WeakPolarHBondContact O-CD1 3.47Å
32	I	93	Very high	90	Very high	24 Å²	24	37.7 Å²	37.7	12%	0.123	17%	0.17	C	C	.	.	H	α-helix	trans	-57.6	-45.1	-177.2	-66.8	-176.9	0	0	0	112.5	N30 V34 A35 E36 D53	N30-I32 PolarHBondContact O-N 2.94Å; I32-V34 PolarHBondContact O-N 3.5Å; I32-A35 CarbonylContact O-C 3.29Å; I32-A35 WeakPolarHBondContact O-CB 3.26Å; I32-A35 PolarHBondContact O-N 2.88Å; I32-A35 VanDerWaalsContact O-N 3.1Å; I32-E36 HydrophobicContact CG2-CG 4.27Å; I32-E36 WeakPolarHBondContact O-CG 3.22Å; I32-E36 PolarHBondContact O-N 3.43Å; I32-D53 HydrophobicContact CD1-CB 3.42Å; I32-D53 VanDerWaalsContact CD1-CB 3.42Å
33	L	93.5	Very high	90.8	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-38.5	178.7	178.7	63.3	0	0	0	111.4	I17 L19 L24 C27 V28 G31 E36 I37 L98	I17-L33 HydrophobicContact CD1-CD1 4.41Å; I17-L33 HydrophobicContact CG2-CD1 3.81Å; L19-L33 HydrophobicContact CD2-CD1 4.03Å; L24-L33 HydrophobicContact CD2-CD2 3.87Å; C27-L33 HydrophobicContact CB-CB 3.92Å; C27-L33 HydrophobicContact CB-CD2 4.23Å; C27-L33 PolarHBondContact O-N 3.18Å; V28-L33 HydrophobicContact CG2-CD2 3.84Å; G31-L33 PolarHBondContact O-N 3.26Å; L33-E36 PolarHBondContact O-N 3.25Å; L33-I37 HydrophobicContact CG-CD1 4.23Å; L33-I37 WeakPolarHBondContact O-CD1 3.23Å; L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 3.23Å; L33-L98 HydrophobicContact CD2-CD1 4.42Å; L33-L98 HydrophobicContact CD2-CD2 4.24Å
34	V	94.8	Very high	91.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-69.8	-39.5	177.6	177.6	0	0	0	0	110.3	V28 G31 I32 I37 L38 W64 I67 L97 L101	V28-V34 HydrophobicContact CG1-CG2 4.39Å; G31-V34 WeakPolarHBondContact O-CA 3.43Å; G31-V34 WeakPolarHBondContact O-CB 3.26Å; G31-V34 PolarHBondContact O-N 3.41Å; I32-V34 PolarHBondContact O-N 3.5Å; V34-I37 PolarHBondContact O-N 2.98Å; V34-L38 HydrophobicContact CG1-CD1 4.12Å; V34-L38 HydrophobicContact CG1-CG 4.4Å; V34-L38 VanDerWaalsContact O-CG 3.24Å; V34-L38 WeakPolarHBondContact O-CG 3.23Å; V34-L38 PolarHBondContact O-N 2.87Å; V34-W64 HydrophobicContact CB-CH2 4.46Å; V34-W64 HydrophobicContact CG2-CH2 3.94Å; V34-I67 HydrophobicContact CB-CD1 4.18Å; V34-I67 HydrophobicContact CG1-CD1 4.3Å; V34-I67 HydrophobicContact CG1-CG2 4Å; V34-L97 HydrophobicContact CG2-CD2 3.92Å; V34-L101 HydrophobicContact CG1-CD1 4.06Å; V34-L101 HydrophobicContact CG2-CD1 4.38Å
35	A	94.8	Very high	92	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-42.6	173.2	0	0	0	0	0	112.2	G31 I32 L38 H39 L48 F51	G31-A35 PolarHBondContact O-N 3.13Å; I32-A35 CarbonylContact O-C 3.29Å; I32-A35 WeakPolarHBondContact O-CB 3.26Å; I32-A35 PolarHBondContact O-N 2.88Å; I32-A35 VanDerWaalsContact O-N 3.1Å; A35-L38 PolarHBondContact O-N 2.91Å; A35-H39 VanDerWaalsContact O-CB 3.27Å; A35-H39 WeakPolarHBondContact O-CB 3.39Å; A35-H39 PolarHBondContact O-N 3.23Å; A35-L48 HydrophobicContact CB-CD2 4.05Å; A35-F51 HydrophobicContact CB-CD1 4.01Å; A35-F51 HydrophobicContact CB-CD2 3.89Å; A35-F51 HydrophobicContact CB-CE1 3.91Å; A35-F51 HydrophobicContact CB-CE2 3.75Å; A35-F51 HydrophobicContact CB-CG 4Å; A35-F51 HydrophobicContact CB-CZ 3.76Å
36	E	94.2	Very high	92.7	Very high	41 Å²	41	41 Å²	41	19%	0.192	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-45.3	174.8	-72.5	173.4	157.8	0	0	111.6	I17 I32 L33 L38 H39 N40 L48	I17-E36 HydrophobicContact CD1-CB 4.35Å; I17-E36 HydrophobicContact CG1-CB 4.42Å; I17-E36 HydrophobicContact CG2-CB 4.47Å; I17-E36 VanDerWaalsContact CG2-OE2 3.27Å; I17-E36 WeakPolarHBondContact CG2-OE2 3.47Å; I32-E36 HydrophobicContact CG2-CG 4.27Å; I32-E36 WeakPolarHBondContact O-CG 3.22Å; I32-E36 PolarHBondContact O-N 3.43Å; L33-E36 PolarHBondContact O-N 3.25Å; E36-L38 PolarHBondContact O-N 3.15Å; E36-H39 PolarHBondContact O-N 2.87Å; E36-N40 PolarHBondContact O-N 3.05Å; E36-L48 HydrophobicContact CG-CD2 4.27Å
37	I	94.8	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-51	174.1	-68	163.9	0	0	0	110.1	W11 L12 L15 I17 L33 V34 H39 N40 Y41 L98 F105	W11-I37 HydrophobicContact CH2-CD1 4.08Å; W11-I37 HydrophobicContact CH2-CG1 4.43Å; W11-I37 HydrophobicContact CH2-CG2 3.68Å; W11-I37 HydrophobicContact CZ2-CG2 3.84Å; W11-I37 HydrophobicContact CZ3-CD1 4.3Å; L12-I37 HydrophobicContact CD2-CD1 3.54Å; L12-I37 HydrophobicContact CD2-CG1 3.89Å; L15-I37 HydrophobicContact CD1-CB 4.43Å; L15-I37 HydrophobicContact CD1-CG1 4.06Å; L15-I37 HydrophobicContact CD1-CG2 4.15Å; I17-I37 HydrophobicContact CD1-CB 4.47Å; I17-I37 HydrophobicContact CD1-CG1 3.56Å; L33-I37 HydrophobicContact CG-CD1 4.23Å; L33-I37 WeakPolarHBondContact O-CD1 3.23Å; L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 3.23Å; V34-I37 PolarHBondContact O-N 2.98Å; I37-H39 VanDerWaalsContact C-N 3.31Å; I37-H39 PolarHBondContact O-N 3.35Å; I37-N40 PolarHBondContact O-N 3.38Å; I37-Y41 HydrophobicContact CG2-CD2 4.37Å; I37-Y41 HydrophobicContact CG2-CE2 4.29Å; I37-Y41 VanDerWaalsContact O-CD2 3.28Å; I37-Y41 WeakPolarHBondContact O-CD2 3.29Å; I37-Y41 PolarHBondContact O-N 2.92Å; I37-L98 HydrophobicContact CD1-CD2 3.6Å; I37-F105 HydrophobicContact CG2-CD2 4.46Å; I37-F105 HydrophobicContact CG2-CE2 4.2Å
38	L	94.8	Very high	93.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-35.6	-179.2	-65.9	173.1	0	0	0	112	V34 A35 E36 Y41 Q42 V46 I67 I70 L71 L74 I76 F105	V34-L38 HydrophobicContact CG1-CD1 4.12Å; V34-L38 HydrophobicContact CG1-CG 4.4Å; V34-L38 VanDerWaalsContact O-CG 3.24Å; V34-L38 WeakPolarHBondContact O-CG 3.23Å; V34-L38 PolarHBondContact O-N 2.87Å; A35-L38 PolarHBondContact O-N 2.91Å; E36-L38 PolarHBondContact O-N 3.15Å; L38-Y41 PolarHBondContact O-N 3.01Å; L38-Q42 PolarHBondContact O-N 3.41Å; L38-V46 HydrophobicContact CB-CG2 3.82Å; L38-I67 HydrophobicContact CD1-CG2 4.07Å; L38-I70 HydrophobicContact CD1-CG2 4.05Å; L38-L71 HydrophobicContact CD1-CD2 4.25Å; L38-L71 HydrophobicContact CD1-CG 4.5Å; L38-L71 HydrophobicContact CD2-CD2 4.09Å; L38-L74 HydrophobicContact CD2-CD1 4.11Å; L38-I76 HydrophobicContact CD2-CD1 4.38Å; L38-F105 HydrophobicContact CD2-CE2 4.18Å; L38-F105 HydrophobicContact CD2-CZ 3.88Å
39	H	94.5	Very high	93.8	Very high	62 Å²	62	43.6 Å²	43.6	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-65.4	-38.2	176	-179.6	80.9	0	0	0	112.3	A35 E36 I37 Y41 Q42 P43 V46 L48	A35-H39 VanDerWaalsContact O-CB 3.27Å; A35-H39 WeakPolarHBondContact O-CB 3.39Å; A35-H39 PolarHBondContact O-N 3.23Å; E36-H39 PolarHBondContact O-N 2.87Å; I37-H39 VanDerWaalsContact C-N 3.31Å; I37-H39 PolarHBondContact O-N 3.35Å; H39-Y41 VanDerWaalsContact C-N 3.3Å; H39-Y41 PolarHBondContact O-N 3.3Å; H39-Q42 CarbonylContact O-C 3.56Å; H39-Q42 PolarHBondContact O-N 3.5Å; H39-P43 WeakPolarHBondContact O-CA 3.29Å; H39-P43 WeakPolarHBondContact O-CB 3.49Å; H39-P43 VanDerWaalsContact O-CD 3.23Å; H39-P43 WeakPolarHBondContact O-CD 3.28Å; H39-V46 HydrophobicContact CB-CB 4.04Å; H39-V46 HydrophobicContact CB-CG1 3.98Å; H39-V46 PolarHBondContact ND1-O 3.29Å; H39-L48 HydrophobicContact CB-CD1 4.04Å; H39-L48 HydrophobicContact CB-CD2 3.87Å; H39-L48 HydrophobicContact CB-CG 3.88Å
40	N	93.6	Very high	93.9	Very high	78 Å²	78	49.9 Å²	49.9	42%	0.417	26%	0.262	S	S	.	.	H	α-helix	trans	-60.4	-41.5	176.4	-168.6	-70.9	0	0	0	111.7	L15 E36 I37	L15-N40 HydrophobicContact CD2-CB 4.19Å; L15-N40 WeakPolarHBondContact CD2-OD1 3.35Å; L15-N40 PolarHBondContact O-ND2 2.92Å; E36-N40 PolarHBondContact O-N 3.05Å; I37-N40 PolarHBondContact O-N 3.38Å
41	Y	92.8	Very high	93.9	Very high	81 Å²	81	50.6 Å²	50.6	32%	0.318	27%	0.265	S	S	.	.	H	α-helix	trans	-79.3	-36.3	178.1	-72.9	-75.3	0	0	0	113.9	W11 L15 I37 L38 H39 F105	W11-Y41 HydrophobicContact CZ2-CE2 4.04Å; W11-Y41 AromaticContact NE1-CZ 3.96Å; W11-Y41 PolarHBondContact NE1-OH 2.79Å; L15-Y41 HydrophobicContact CD1-CE2 4.24Å; L15-Y41 HydrophobicContact CD2-CE2 3.75Å; I37-Y41 HydrophobicContact CG2-CD2 4.37Å; I37-Y41 HydrophobicContact CG2-CE2 4.29Å; I37-Y41 VanDerWaalsContact O-CD2 3.28Å; I37-Y41 WeakPolarHBondContact O-CD2 3.29Å; I37-Y41 PolarHBondContact O-N 2.92Å; L38-Y41 PolarHBondContact O-N 3.01Å; H39-Y41 VanDerWaalsContact C-N 3.3Å; H39-Y41 PolarHBondContact O-N 3.3Å; Y41-F105 AromaticContact CD1-CD1 3.57Å; Y41-F105 HydrophobicContact CD1-CD1 3.57Å; Y41-F105 AromaticContact CD1-CE1 3.97Å; Y41-F105 HydrophobicContact CD1-CE1 3.97Å; Y41-F105 HydrophobicContact CD1-CG 4.24Å; Y41-F105 HydrophobicContact CD2-CB 4.5Å; Y41-F105 AromaticContact CD2-CD1 3.54Å; Y41-F105 HydrophobicContact CD2-CD1 3.54Å; Y41-F105 AromaticContact CD2-CD2 3.89Å; Y41-F105 HydrophobicContact CD2-CD2 3.89Å; Y41-F105 AromaticContact CD2-CE1 3.58Å; Y41-F105 HydrophobicContact CD2-CE1 3.58Å; Y41-F105 AromaticContact CD2-CE2 3.92Å; Y41-F105 HydrophobicContact CD2-CE2 3.92Å; Y41-F105 AromaticContact CD2-CG 3.72Å; Y41-F105 HydrophobicContact CD2-CG 3.72Å; Y41-F105 AromaticContact CD2-CZ 3.78Å; Y41-F105 HydrophobicContact CD2-CZ 3.78Å; Y41-F105 HydrophobicContact CE1-CB 3.93Å; Y41-F105 AromaticContact CE1-CD1 3.73Å; Y41-F105 HydrophobicContact CE1-CD1 3.73Å; Y41-F105 AromaticContact CE1-CG 4Å; Y41-F105 HydrophobicContact CE1-CG 4Å; Y41-F105 HydrophobicContact CE2-CB 3.81Å; Y41-F105 AromaticContact CE2-CD1 3.73Å; Y41-F105 HydrophobicContact CE2-CD1 3.73Å; Y41-F105 AromaticContact CE2-CD2 3.7Å; Y41-F105 HydrophobicContact CE2-CD2 3.7Å; Y41-F105 HydrophobicContact CE2-CE1 4.22Å; Y41-F105 HydrophobicContact CE2-CE2 4.19Å; Y41-F105 AromaticContact CE2-CG 3.46Å; Y41-F105 HydrophobicContact CE2-CG 3.46Å; Y41-F105 VanDerWaalsContact CE2-CG 3.46Å; Y41-F105 HydrophobicContact CE2-CZ 4.43Å; Y41-F105 AromaticContact CG-CD1 3.48Å; Y41-F105 HydrophobicContact CG-CD1 3.48Å; Y41-F105 VanDerWaalsContact CG-CD1 3.48Å; Y41-F105 AromaticContact CG-CE1 3.45Å; Y41-F105 HydrophobicContact CG-CE1 3.45Å; Y41-F105 VanDerWaalsContact CG-CE1 3.45Å; Y41-F105 HydrophobicContact CG-CG 4.12Å; Y41-F105 HydrophobicContact CG-CZ 4.07Å; Y41-F105 VanDerWaalsContact CZ-CB 3.48Å; Y41-F105 AromaticContact CZ-CD1 3.82Å; Y41-F105 AromaticContact CZ-CG 3.62Å; Y41-F105 WeakPolarHBondContact OH-CB 3.48Å
42	Q	92.6	Very high	93.9	Very high	73 Å²	73	54.6 Å²	54.6	34%	0.341	29%	0.285	S	S	.	.			trans	-138.1	73.9	-176.8	-169	69.8	9.1	0	0	111.7	L38 H39 K44 T45 V46 L74	L38-Q42 PolarHBondContact O-N 3.41Å; H39-Q42 CarbonylContact O-C 3.56Å; H39-Q42 PolarHBondContact O-N 3.5Å; Q42-K44 PolarHBondContact O-N 2.99Å; Q42-K44 VanDerWaalsContact O-N 3.15Å; Q42-T45 VanDerWaalsContact CG-CB 3.41Å; Q42-T45 WeakPolarHBondContact CG-OG1 3.49Å; Q42-T45 PolarHBondContact NE2-OG1 3.29Å; Q42-T45 PolarHBondContact O-N 3.45Å; Q42-T45 VanDerWaalsContact O-N 3.13Å; Q42-V46 PolarHBondContact O-N 3.27Å; Q42-L74 HydrophobicContact CB-CD2 4.04Å; Q42-L74 HydrophobicContact CG-CD2 3.83Å
43	P	93.5	Very high	93.8	Very high	76 Å²	76	58.6 Å²	58.6	49%	0.494	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.5	-176	24.8	-34.1	0	0	0	112.9	H39	H39-P43 WeakPolarHBondContact O-CA 3.29Å; H39-P43 WeakPolarHBondContact O-CB 3.49Å; H39-P43 VanDerWaalsContact O-CD 3.23Å; H39-P43 WeakPolarHBondContact O-CD 3.28Å
44	K	93.4	Very high	93.7	Very high	201 Å²	201	59.2 Å²	59.2	87%	0.874	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-25.9	177.9	-63.1	-174.5	-179.3	-179.4	0	113.7	Q42	Q42-K44 PolarHBondContact O-N 2.99Å; Q42-K44 VanDerWaalsContact O-N 3.15Å
45	T	93.6	Very high	93.4	Very high	46 Å²	46	65.1 Å²	65.1	28%	0.282	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-33.1	-175.4	-56.7	0	0	0	0	111.2	Q42 I70	Q42-T45 VanDerWaalsContact CG-CB 3.41Å; Q42-T45 WeakPolarHBondContact CG-OG1 3.49Å; Q42-T45 PolarHBondContact NE2-OG1 3.29Å; Q42-T45 PolarHBondContact O-N 3.45Å; Q42-T45 VanDerWaalsContact O-N 3.13Å; T45-I70 HydrophobicContact CG2-CG2 4.5Å
46	V	94.5	Very high	93.3	Very high	1 Å²	1	68 Å²	68	1%	0.006	36%	0.361	C	S	.	.			trans	-102.4	108.6	-176.3	-172.3	0	0	0	0	109.8	L38 H39 Q42 L48 F51 I70	L38-V46 HydrophobicContact CB-CG2 3.82Å; H39-V46 HydrophobicContact CB-CB 4.04Å; H39-V46 HydrophobicContact CB-CG1 3.98Å; H39-V46 PolarHBondContact ND1-O 3.29Å; Q42-V46 PolarHBondContact O-N 3.27Å; V46-L48 HydrophobicContact CG1-CD2 4.43Å; V46-F51 HydrophobicContact CG1-CE2 4.02Å; V46-I70 HydrophobicContact CG1-CD1 4.15Å; V46-I70 HydrophobicContact CG2-CD1 4.17Å; V46-I70 HydrophobicContact CG2-CG2 3.65Å
47	D	94.3	Very high	93.2	Very high	84 Å²	84	67.3 Å²	67.3	45%	0.449	36%	0.359	S	S	.	.			trans	-93.2	105.8	172.4	179.3	5.8	0	0	0	109.5	G49 K50 F51	D47-G49 PolarHBondContact O-N 3.08Å; D47-G49 PolarHBondContact OD1-N 3.49Å; D47-K50 HydrophobicContact CB-CD 4.11Å; D47-K50 HydrophobicContact CB-CG 4.17Å; D47-K50 PolarHBondContact O-N 3.14Å; D47-K50 VanDerWaalsContact OD2-CE 3.32Å; D47-K50 WeakPolarHBondContact OD2-CE 3.29Å; D47-F51 WeakPolarHBondContact O-CD2 3.44Å
48	L	93.6	Very high	93.2	Very high	64 Å²	64	75.5 Å²	75.5	34%	0.335	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-62.1	-24.9	-179.7	-69.1	177.1	0	0	0	112.7	A35 E36 H39 V46 K50 F51	A35-L48 HydrophobicContact CB-CD2 4.05Å; E36-L48 HydrophobicContact CG-CD2 4.27Å; H39-L48 HydrophobicContact CB-CD1 4.04Å; H39-L48 HydrophobicContact CB-CD2 3.87Å; H39-L48 HydrophobicContact CB-CG 3.88Å; V46-L48 HydrophobicContact CG1-CD2 4.43Å; L48-K50 PolarHBondContact O-N 3.38Å; L48-F51 PolarHBondContact O-N 3.43Å
49	G	93.8	Very high	93.2	Very high	71 Å²	71	76.7 Å²	76.7	73%	0.732	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-67.8	-15	179.4	0	0	0	0	0	114.3	D47	D47-G49 PolarHBondContact O-N 3.08Å; D47-G49 PolarHBondContact OD1-N 3.49Å
50	K	94.3	Very high	93.2	Very high	133 Å²	133	75 Å²	75	58%	0.578	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-82.8	-20.3	177.1	-64.2	-177.7	-177.8	176.9	0	113.4	D47 L48 M66	D47-K50 HydrophobicContact CB-CD 4.11Å; D47-K50 HydrophobicContact CB-CG 4.17Å; D47-K50 PolarHBondContact O-N 3.14Å; D47-K50 VanDerWaalsContact OD2-CE 3.32Å; D47-K50 WeakPolarHBondContact OD2-CE 3.29Å; L48-K50 PolarHBondContact O-N 3.38Å; K50-M66 HydrophobicContact CB-SD 4.17Å; K50-M66 WeakPolarHBondContact O-CE 3.48Å
51	F	94.7	Very high	93.2	Very high	23 Å²	23	73.6 Å²	73.6	10%	0.101	39%	0.385	C	S	.	.			trans	-83.8	136.5	-178.4	-67.4	-86.2	0	0	0	110.5	A35 V46 D47 L48 N63 M66 I67 I70	A35-F51 HydrophobicContact CB-CD1 4.01Å; A35-F51 HydrophobicContact CB-CD2 3.89Å; A35-F51 HydrophobicContact CB-CE1 3.91Å; A35-F51 HydrophobicContact CB-CE2 3.75Å; A35-F51 HydrophobicContact CB-CG 4Å; A35-F51 HydrophobicContact CB-CZ 3.76Å; V46-F51 HydrophobicContact CG1-CE2 4.02Å; D47-F51 WeakPolarHBondContact O-CD2 3.44Å; L48-F51 PolarHBondContact O-N 3.43Å; F51-N63 HydrophobicContact CD1-CB 4.06Å; F51-M66 HydrophobicContact CD1-CE 3.88Å; F51-M66 HydrophobicContact CE1-CB 3.96Å; F51-M66 HydrophobicContact CE1-CE 4.01Å; F51-M66 HydrophobicContact CG-CE 4.42Å; F51-M66 HydrophobicContact CZ-CB 4.12Å; F51-I67 HydrophobicContact CE1-CD1 4.24Å; F51-I67 HydrophobicContact CE1-CG1 3.74Å; F51-I67 HydrophobicContact CZ-CG1 4.12Å; F51-I70 HydrophobicContact CE2-CD1 4.3Å; F51-I70 HydrophobicContact CZ-CD1 3.84Å
52	I	93.9	Very high	93.4	Very high	84 Å²	84	74.4 Å²	74.4	43%	0.431	39%	0.392	S	S	.	.			trans	-106.3	125.9	-179.2	-60.3	174	0	0	0	108.7	G54 V59 N63	I52-G54 PolarHBondContact O-N 3.27Å; I52-G54 VanDerWaalsContact O-N 3.15Å; I52-V59 HydrophobicContact CB-CG1 3.9Å; I52-V59 HydrophobicContact CG2-CG1 3.96Å; I52-V59 VanDerWaalsContact O-CG1 3.29Å; I52-V59 WeakPolarHBondContact O-CG1 3.28Å; I52-N63 PolarHBondContact N-OD1 2.7Å; I52-N63 PolarHBondContact O-ND2 3.18Å
53	D	90.8	Very high	93.6	Very high	108 Å²	108	70.9 Å²	70.9	58%	0.578	38%	0.376	S	S	*	.			trans	-77.2	98.9	170.7	-164.3	-1.4	0	0	0	110.1	N30 I32	N30-D53 PolarHBondContact ND2-OD1 3.4Å; I32-D53 HydrophobicContact CD1-CB 3.42Å; I32-D53 VanDerWaalsContact CD1-CB 3.42Å
54	G	90.1	Very high	93.7	Very high	15 Å²	15	67.5 Å²	67.5	16%	0.155	35%	0.353	C	S	.	.			trans	-143.5	147.9	-178.3	0	0	0	0	0	112.5	N30 I52	N30-G54 PolarHBondContact OD1-O 3.3Å; I52-G54 PolarHBondContact O-N 3.27Å; I52-G54 VanDerWaalsContact O-N 3.15Å
55	Q	88.5	Confident	93.8	Very high	126 Å²	126	62.2 Å²	62.2	59%	0.589	33%	0.334	S	S	*	.			trans	-89.8	-14.6	178.5	-64.1	-57.3	-35.9	0	0	113.5	K60	Q55-K60 WeakPolarHBondContact O-CE 3.24Å
56	S	92.5	Very high	93.9	Very high	60 Å²	60	62 Å²	62	42%	0.42	33%	0.33	S	S	.	.	S	Bend	trans	-68.1	143	-179.5	79.4	0	0	0	0	111.6	K58 V59 K60	S56-K58 PolarHBondContact O-N 3.4Å; S56-V59 PolarHBondContact O-N 3.34Å; S56-V59 VanDerWaalsContact OG-CG2 3.26Å; S56-V59 WeakPolarHBondContact OG-CG2 3.43Å; S56-V59 PolarHBondContact OG-N 3.46Å; S56-K60 WeakPolarHBondContact O-CG 3.27Å; S56-K60 PolarHBondContact O-N 2.76Å; S56-K60 VanDerWaalsContact O-N 3.13Å
57	I	93.1	Very high	94	Very high	27 Å²	27	62 Å²	62	14%	0.138	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-36.5	178.8	-173.6	54	0	0	0	112.3	V59 K60 L61	I57-V59 PolarHBondContact O-N 3.49Å; I57-K60 PolarHBondContact O-N 2.87Å; I57-L61 HydrophobicContact CD1-CD1 4.43Å; I57-L61 HydrophobicContact CD1-CD2 4.42Å; I57-L61 HydrophobicContact CD1-CG 4.07Å; I57-L61 HydrophobicContact CG1-CD1 4.08Å; I57-L61 HydrophobicContact CG1-CG 4.21Å; I57-L61 WeakPolarHBondContact O-CG 3.22Å; I57-L61 PolarHBondContact O-N 3.33Å
58	K	94	Very high	94	Very high	172 Å²	172	61.1 Å²	61.1	75%	0.748	32%	0.324	S	S	*	.	H	α-helix	trans	-58.8	-46.1	177.3	-66	-175.8	178	-177.1	0	112.3	S56 L61 Q62	S56-K58 PolarHBondContact O-N 3.4Å; K58-L61 PolarHBondContact O-N 3.02Å; K58-Q62 WeakPolarHBondContact O-CB 3.47Å; K58-Q62 PolarHBondContact O-N 3.2Å
59	V	94.7	Very high	94.1	Very high	25 Å²	25	62.9 Å²	62.9	15%	0.152	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-42.6	177.5	171.1	0	0	0	0	110.8	I52 S56 I57 Q62 N63	I52-V59 HydrophobicContact CB-CG1 3.9Å; I52-V59 HydrophobicContact CG2-CG1 3.96Å; I52-V59 VanDerWaalsContact O-CG1 3.29Å; I52-V59 WeakPolarHBondContact O-CG1 3.28Å; S56-V59 PolarHBondContact O-N 3.34Å; S56-V59 VanDerWaalsContact OG-CG2 3.26Å; S56-V59 WeakPolarHBondContact OG-CG2 3.43Å; S56-V59 PolarHBondContact OG-N 3.46Å; I57-V59 PolarHBondContact O-N 3.49Å; V59-Q62 PolarHBondContact O-N 3.44Å; V59-N63 VanDerWaalsContact O-CG 3.31Å; V59-N63 PolarHBondContact O-N 3.29Å
60	K	94.8	Very high	94.1	Very high	28 Å²	28	60.1 Å²	60.1	12%	0.122	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-49	177.7	-63	-177.3	178.3	-178.6	0	111.4	S29 Q55 S56 I57 Q62 N63 W64	S29-K60 PolarHBondContact OG-NZ 3.06Å; Q55-K60 WeakPolarHBondContact O-CE 3.24Å; S56-K60 WeakPolarHBondContact O-CG 3.27Å; S56-K60 PolarHBondContact O-N 2.76Å; S56-K60 VanDerWaalsContact O-N 3.13Å; I57-K60 PolarHBondContact O-N 2.87Å; K60-Q62 VanDerWaalsContact C-N 3.35Å; K60-Q62 PolarHBondContact O-N 2.86Å; K60-N63 WeakPolarHBondContact O-CB 3.22Å; K60-N63 PolarHBondContact O-N 3.28Å; K60-W64 PolarHBondContact O-N 3.02Å
61	L	94.9	Very high	94.1	Very high	47 Å²	47	54.1 Å²	54.1	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-45.8	178.1	-68.9	175.8	0	0	0	111.2	I57 K58 N63 W64 D65 A87 T151	I57-L61 HydrophobicContact CD1-CD1 4.43Å; I57-L61 HydrophobicContact CD1-CD2 4.42Å; I57-L61 HydrophobicContact CD1-CG 4.07Å; I57-L61 HydrophobicContact CG1-CD1 4.08Å; I57-L61 HydrophobicContact CG1-CG 4.21Å; I57-L61 WeakPolarHBondContact O-CG 3.22Å; I57-L61 PolarHBondContact O-N 3.33Å; K58-L61 PolarHBondContact O-N 3.02Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 3Å; L61-W64 CarbonylContact O-C 3.41Å; L61-W64 WeakPolarHBondContact O-CA 3.36Å; L61-W64 PolarHBondContact O-N 3.48Å; L61-D65 PolarHBondContact O-N 3.28Å; L61-A87 HydrophobicContact CD2-CB 4.46Å; L61-T151 HydrophobicContact CD1-CG2 3.67Å
62	Q	95.9	Very high	94.1	Very high	98 Å²	98	60 Å²	60	46%	0.458	30%	0.3	S	S	.	.	H	α-helix	trans	-59.3	-42.9	175.9	-175.3	-178.8	-5.6	0	0	112.6	K58 V59 K60 W64 D65 M66	K58-Q62 WeakPolarHBondContact O-CB 3.47Å; K58-Q62 PolarHBondContact O-N 3.2Å; V59-Q62 PolarHBondContact O-N 3.44Å; K60-Q62 VanDerWaalsContact C-N 3.35Å; K60-Q62 PolarHBondContact O-N 2.86Å; Q62-W64 VanDerWaalsContact C-N 3.32Å; Q62-W64 PolarHBondContact O-N 2.72Å; Q62-D65 PolarHBondContact O-N 3.3Å; Q62-M66 HydrophobicContact CG-CE 4.45Å; Q62-M66 WeakPolarHBondContact O-CG 3.49Å; Q62-M66 PolarHBondContact O-N 2.95Å
63	N	96.5	Very high	94	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-42.5	174.1	-72.3	-16.8	0	0	0	111	N30 F51 I52 V59 K60 L61 M66 I67	N30-N63 WeakPolarHBondContact O-CB 3.35Å; N30-N63 PolarHBondContact O-ND2 3.37Å; N30-N63 PolarHBondContact OD1-ND2 3.12Å; F51-N63 HydrophobicContact CD1-CB 4.06Å; I52-N63 PolarHBondContact N-OD1 2.7Å; I52-N63 PolarHBondContact O-ND2 3.18Å; V59-N63 VanDerWaalsContact O-CG 3.31Å; V59-N63 PolarHBondContact O-N 3.29Å; K60-N63 WeakPolarHBondContact O-CB 3.22Å; K60-N63 PolarHBondContact O-N 3.28Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 3Å; N63-M66 PolarHBondContact O-N 3.47Å; N63-I67 VanDerWaalsContact O-CG1 3.28Å; N63-I67 WeakPolarHBondContact O-CG1 3.37Å; N63-I67 PolarHBondContact O-N 3.34Å
64	W	95.9	Very high	94.1	Very high	5 Å²	5	61.1 Å²	61.1	2%	0.019	29%	0.294	C	S	.	.	H	α-helix	trans	-69	-36.1	178.7	-81.2	108.8	0	0	0	113.8	V28 S29 V34 K60 L61 Q62 M66 I67 Q68 I83 A86 A87 L97	V28-W64 HydrophobicContact CG1-CZ2 4.31Å; V28-W64 WeakPolarHBondContact O-CZ2 3.47Å; S29-W64 PolarHBondContact O-NE1 3.47Å; V34-W64 HydrophobicContact CB-CH2 4.46Å; V34-W64 HydrophobicContact CG2-CH2 3.94Å; K60-W64 PolarHBondContact O-N 3.02Å; L61-W64 CarbonylContact O-C 3.41Å; L61-W64 WeakPolarHBondContact O-CA 3.36Å; L61-W64 PolarHBondContact O-N 3.48Å; Q62-W64 VanDerWaalsContact C-N 3.32Å; Q62-W64 PolarHBondContact O-N 2.72Å; W64-M66 VanDerWaalsContact C-N 3.34Å; W64-I67 HydrophobicContact CD2-CD1 4.28Å; W64-I67 HydrophobicContact CE3-CB 4.15Å; W64-I67 HydrophobicContact CE3-CD1 3.99Å; W64-I67 HydrophobicContact CE3-CG2 4Å; W64-I67 HydrophobicContact CZ3-CD1 4.25Å; W64-I67 HydrophobicContact CZ3-CG2 3.99Å; W64-I67 PolarHBondContact O-N 3.33Å; W64-Q68 WeakPolarHBondContact O-CG 3.43Å; W64-Q68 PolarHBondContact O-N 3.09Å; W64-I83 HydrophobicContact CD2-CG2 4.2Å; W64-I83 HydrophobicContact CE3-CG2 3.57Å; W64-I83 HydrophobicContact CZ3-CG2 4.01Å; W64-A86 HydrophobicContact CH2-CB 3.97Å; W64-A86 HydrophobicContact CZ2-CB 3.75Å; W64-A87 HydrophobicContact CD2-CB 4.41Å; W64-A87 HydrophobicContact CG-CB 3.89Å; W64-L97 HydrophobicContact CH2-CD2 3.41Å; W64-L97 VanDerWaalsContact CH2-CD2 3.41Å; W64-L97 HydrophobicContact CZ2-CD2 4.33Å; W64-L97 HydrophobicContact CZ3-CD2 4.15Å
65	D	95.3	Very high	94.2	Very high	90 Å²	90	65.7 Å²	65.7	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-45.8	173.5	-65.6	-23.8	0	0	0	110.1	L61 Q62 I67 Q68 E69	L61-D65 PolarHBondContact O-N 3.28Å; Q62-D65 PolarHBondContact O-N 3.3Å; D65-I67 PolarHBondContact O-N 3.46Å; D65-Q68 WeakPolarHBondContact O-CB 3.45Å; D65-Q68 PolarHBondContact O-N 3.32Å; D65-E69 PolarHBondContact O-N 3.11Å
66	M	95.8	Very high	94.3	Very high	41 Å²	41	61 Å²	61	20%	0.202	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-40.6	174.6	-69.8	-173	-69.6	0	0	112.3	K50 F51 Q62 N63 W64 Q68 E69 I70	K50-M66 HydrophobicContact CB-SD 4.17Å; K50-M66 WeakPolarHBondContact O-CE 3.48Å; F51-M66 HydrophobicContact CD1-CE 3.88Å; F51-M66 HydrophobicContact CE1-CB 3.96Å; F51-M66 HydrophobicContact CE1-CE 4.01Å; F51-M66 HydrophobicContact CG-CE 4.42Å; F51-M66 HydrophobicContact CZ-CB 4.12Å; Q62-M66 HydrophobicContact CG-CE 4.45Å; Q62-M66 WeakPolarHBondContact O-CG 3.49Å; Q62-M66 PolarHBondContact O-N 2.95Å; N63-M66 PolarHBondContact O-N 3.47Å; W64-M66 VanDerWaalsContact C-N 3.34Å; M66-Q68 VanDerWaalsContact C-N 3.35Å; M66-E69 PolarHBondContact O-N 3.33Å; M66-I70 WeakPolarHBondContact O-CD1 3.44Å; M66-I70 VanDerWaalsContact O-CG1 3.26Å; M66-I70 WeakPolarHBondContact O-CG1 3.42Å; M66-I70 PolarHBondContact O-N 2.87Å
67	I	96.1	Very high	93.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.7	-70.2	164.9	0	0	0	110.5	G31 V34 L38 F51 N63 W64 D65 E69 I70 L71	G31-I67 VanDerWaalsContact O-CD1 3.29Å; G31-I67 WeakPolarHBondContact O-CD1 3.47Å; V34-I67 HydrophobicContact CB-CD1 4.18Å; V34-I67 HydrophobicContact CG1-CD1 4.3Å; V34-I67 HydrophobicContact CG1-CG2 4Å; L38-I67 HydrophobicContact CD1-CG2 4.07Å; F51-I67 HydrophobicContact CE1-CD1 4.24Å; F51-I67 HydrophobicContact CE1-CG1 3.74Å; F51-I67 HydrophobicContact CZ-CG1 4.12Å; N63-I67 VanDerWaalsContact O-CG1 3.28Å; N63-I67 WeakPolarHBondContact O-CG1 3.37Å; N63-I67 PolarHBondContact O-N 3.34Å; W64-I67 HydrophobicContact CD2-CD1 4.28Å; W64-I67 HydrophobicContact CE3-CB 4.15Å; W64-I67 HydrophobicContact CE3-CD1 3.99Å; W64-I67 HydrophobicContact CE3-CG2 4Å; W64-I67 HydrophobicContact CZ3-CD1 4.25Å; W64-I67 HydrophobicContact CZ3-CG2 3.99Å; W64-I67 PolarHBondContact O-N 3.33Å; D65-I67 PolarHBondContact O-N 3.46Å; I67-E69 PolarHBondContact O-N 2.85Å; I67-I70 PolarHBondContact O-N 3.42Å; I67-L71 HydrophobicContact CG2-CD1 3.73Å; I67-L71 HydrophobicContact CG2-CG 4.08Å; I67-L71 WeakPolarHBondContact O-CB 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.35Å; I67-L71 PolarHBondContact O-N 2.95Å
68	Q	95	Very high	93.7	Very high	67 Å²	67	63.5 Å²	63.5	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-60.1	-44.7	176.9	-78.4	-175.9	-28.9	0	0	111.8	W64 D65 M66 I70 L71 Q72 I83	W64-Q68 WeakPolarHBondContact O-CG 3.43Å; W64-Q68 PolarHBondContact O-N 3.09Å; D65-Q68 WeakPolarHBondContact O-CB 3.45Å; D65-Q68 PolarHBondContact O-N 3.32Å; M66-Q68 VanDerWaalsContact C-N 3.35Å; Q68-I70 VanDerWaalsContact C-N 3.33Å; Q68-I70 PolarHBondContact O-N 3.3Å; Q68-L71 PolarHBondContact O-N 2.92Å; Q68-Q72 WeakPolarHBondContact O-CG 3.36Å; Q68-Q72 PolarHBondContact O-N 3.32Å; Q68-I83 HydrophobicContact CG-CD1 3.96Å; Q68-I83 HydrophobicContact CG-CG2 4.09Å
69	E	94.8	Very high	93.4	Very high	101 Å²	101	57.5 Å²	57.5	47%	0.472	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-42.6	174.4	-70.6	-173	-168.9	0	0	112.3	D65 M66 I67 Q72 R73	D65-E69 PolarHBondContact O-N 3.11Å; M66-E69 PolarHBondContact O-N 3.33Å; I67-E69 PolarHBondContact O-N 2.85Å; E69-Q72 PolarHBondContact O-N 2.92Å; E69-R73 WeakPolarHBondContact O-CG 3.41Å; E69-R73 PolarHBondContact O-N 3.1Å; E69-R73 IonicContact OE2-NH2 2.69Å; E69-R73 PolarHBondContact OE2-NH2 3.45Å
70	I	95.4	Very high	93.1	Very high	13 Å²	13	60.5 Å²	60.5	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-46.3	177.6	-70.5	163.9	0	0	0	110.5	L38 T45 V46 F51 M66 I67 Q68 Q72 R73 L74	L38-I70 HydrophobicContact CD1-CG2 4.05Å; T45-I70 HydrophobicContact CG2-CG2 4.5Å; V46-I70 HydrophobicContact CG1-CD1 4.15Å; V46-I70 HydrophobicContact CG2-CD1 4.17Å; V46-I70 HydrophobicContact CG2-CG2 3.65Å; F51-I70 HydrophobicContact CE2-CD1 4.3Å; F51-I70 HydrophobicContact CZ-CD1 3.84Å; M66-I70 WeakPolarHBondContact O-CD1 3.44Å; M66-I70 VanDerWaalsContact O-CG1 3.26Å; M66-I70 WeakPolarHBondContact O-CG1 3.42Å; M66-I70 PolarHBondContact O-N 2.87Å; I67-I70 PolarHBondContact O-N 3.42Å; Q68-I70 VanDerWaalsContact C-N 3.33Å; Q68-I70 PolarHBondContact O-N 3.3Å; I70-Q72 VanDerWaalsContact C-N 3.29Å; I70-Q72 PolarHBondContact O-N 3.28Å; I70-R73 PolarHBondContact O-N 2.82Å; I70-R73 VanDerWaalsContact O-N 3.14Å; I70-L74 HydrophobicContact CG2-CD1 3.79Å; I70-L74 HydrophobicContact CG2-CG 4.3Å; I70-L74 VanDerWaalsContact O-CG 3.29Å; I70-L74 WeakPolarHBondContact O-CG 3.2Å; I70-L74 PolarHBondContact O-N 2.96Å
71	L	94.5	Very high	92.9	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-41.6	178.5	-71.9	168.6	0	0	0	111.5	L38 I67 Q68 L74 C75 I76 L78 I83	L38-L71 HydrophobicContact CD1-CD2 4.25Å; L38-L71 HydrophobicContact CD1-CG 4.5Å; L38-L71 HydrophobicContact CD2-CD2 4.09Å; I67-L71 HydrophobicContact CG2-CD1 3.73Å; I67-L71 HydrophobicContact CG2-CG 4.08Å; I67-L71 WeakPolarHBondContact O-CB 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.35Å; I67-L71 PolarHBondContact O-N 2.95Å; Q68-L71 PolarHBondContact O-N 2.92Å; L71-L74 CarbonylContact O-C 3.57Å; L71-L74 PolarHBondContact O-N 3.02Å; L71-C75 PolarHBondContact O-N 3.18Å; L71-C75 VanDerWaalsContact O-N 3.13Å; L71-I76 HydrophobicContact CD2-CB 3.9Å; L71-I76 HydrophobicContact CD2-CD1 4.23Å; L71-I76 HydrophobicContact CD2-CG2 3.84Å; L71-I76 PolarHBondContact O-N 3.49Å; L71-L78 HydrophobicContact CD1-CD1 3.83Å; L71-L78 HydrophobicContact CD2-CD1 4.18Å; L71-I83 HydrophobicContact CD1-CD1 4.14Å
72	Q	93.3	Very high	92.7	Very high	147 Å²	147	61 Å²	61	69%	0.687	32%	0.321	S	S	*	.	H	α-helix	trans	-61.4	-45.3	174.3	-72.3	174.9	6.3	0	0	111.8	Q68 E69 I70 L74 C75	Q68-Q72 WeakPolarHBondContact O-CG 3.36Å; Q68-Q72 PolarHBondContact O-N 3.32Å; E69-Q72 PolarHBondContact O-N 2.92Å; I70-Q72 VanDerWaalsContact C-N 3.29Å; I70-Q72 PolarHBondContact O-N 3.28Å; Q72-L74 VanDerWaalsContact C-N 3.26Å; Q72-L74 PolarHBondContact O-N 2.91Å; Q72-C75 PolarHBondContact O-N 3.44Å
73	R	93.3	Very high	92.5	Very high	166 Å²	166	56.8 Å²	56.8	63%	0.626	30%	0.301	S	S	*	.	H	α-helix	trans	-64.1	-30.5	176.9	-69.7	176	-166.2	172.1	11.5	113.1	E69 I70 C75	E69-R73 WeakPolarHBondContact O-CG 3.41Å; E69-R73 PolarHBondContact O-N 3.1Å; E69-R73 IonicContact OE2-NH2 2.69Å; E69-R73 PolarHBondContact OE2-NH2 3.45Å; I70-R73 PolarHBondContact O-N 2.82Å; I70-R73 VanDerWaalsContact O-N 3.14Å; R73-C75 VanDerWaalsContact C-N 3.28Å
74	L	92	Very high	92.3	Very high	49 Å²	49	61 Å²	61	26%	0.257	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.4	175.9	-64.6	176.9	0	0	0	113.2	L38 Q42 I70 L71 Q72 I76	L38-L74 HydrophobicContact CD2-CD1 4.11Å; Q42-L74 HydrophobicContact CB-CD2 4.04Å; Q42-L74 HydrophobicContact CG-CD2 3.83Å; I70-L74 HydrophobicContact CG2-CD1 3.79Å; I70-L74 HydrophobicContact CG2-CG 4.3Å; I70-L74 VanDerWaalsContact O-CG 3.29Å; I70-L74 WeakPolarHBondContact O-CG 3.2Å; I70-L74 PolarHBondContact O-N 2.96Å; L71-L74 CarbonylContact O-C 3.57Å; L71-L74 PolarHBondContact O-N 3.02Å; Q72-L74 VanDerWaalsContact C-N 3.26Å; Q72-L74 PolarHBondContact O-N 2.91Å; L74-I76 HydrophobicContact CB-CD1 3.84Å; L74-I76 HydrophobicContact CB-CG1 3.86Å; L74-I76 HydrophobicContact CD1-CD1 3.99Å; L74-I76 PolarHBondContact O-N 3.31Å
75	C	91.2	Very high	92.2	Very high	112 Å²	112	61 Å²	61	76%	0.757	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	34.3	-172.8	-58.3	0	0	0	0	113.1	L71 Q72 R73	L71-C75 PolarHBondContact O-N 3.18Å; L71-C75 VanDerWaalsContact O-N 3.13Å; Q72-C75 PolarHBondContact O-N 3.44Å; R73-C75 VanDerWaalsContact C-N 3.28Å
76	I	90.6	Very high	92.1	Very high	27 Å²	27	56.7 Å²	56.7	14%	0.138	30%	0.299	C	S	.	.			trans	-94.5	111.8	176.3	-62	174.2	0	0	0	108.7	L38 L71 L74 L78 I104 F105	L38-I76 HydrophobicContact CD2-CD1 4.38Å; L71-I76 HydrophobicContact CD2-CB 3.9Å; L71-I76 HydrophobicContact CD2-CD1 4.23Å; L71-I76 HydrophobicContact CD2-CG2 3.84Å; L71-I76 PolarHBondContact O-N 3.49Å; L74-I76 HydrophobicContact CB-CD1 3.84Å; L74-I76 HydrophobicContact CB-CG1 3.86Å; L74-I76 HydrophobicContact CD1-CD1 3.99Å; L74-I76 PolarHBondContact O-N 3.31Å; I76-L78 HydrophobicContact CG2-CG 4.28Å; I76-I104 HydrophobicContact CG2-CD1 3.96Å; I76-I104 HydrophobicContact CG2-CG2 4.4Å; I76-F105 HydrophobicContact CD1-CE1 4.31Å; I76-F105 HydrophobicContact CD1-CZ 3.82Å
77	C	85.8	Confident	92	Very high	117 Å²	117	54.9 Å²	54.9	79%	0.791	29%	0.291	S	S	*	.			trans	-88.2	112.9	178.4	-60.7	0	0	0	0	110.7
78	L	88.4	Confident	91.8	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	29%	0.292	C	S	.	.			trans	-117.9	141.4	169.3	-70.4	175.2	0	0	0	109.7	L71 I76 I83 L97 L101 I104	L71-L78 HydrophobicContact CD1-CD1 3.83Å; L71-L78 HydrophobicContact CD2-CD1 4.18Å; I76-L78 HydrophobicContact CG2-CG 4.28Å; L78-I83 HydrophobicContact CB-CD1 4.13Å; L78-I83 HydrophobicContact CB-CG1 4.39Å; L78-L97 HydrophobicContact CD1-CD1 3.72Å; L78-L101 HydrophobicContact CD1-CD2 4.1Å; L78-I104 HydrophobicContact CD2-CD1 3.81Å
79	P	87.3	Confident	91.6	Very high	46 Å²	46	55 Å²	55	30%	0.299	29%	0.293	S	S	.	.			trans	-57.6	132.6	173.5	-24.4	33.3	0	0	0	111.3	D81 I82 I83 L114	P79-D81 PolarHBondContact O-N 2.84Å; P79-I82 HydrophobicContact CB-CD1 4.13Å; P79-I82 HydrophobicContact CB-CG1 4.12Å; P79-I82 HydrophobicContact CG-CD1 3.82Å; P79-I82 HydrophobicContact CG-CG1 4.37Å; P79-I82 PolarHBondContact O-N 3.4Å; P79-I82 VanDerWaalsContact O-N 3.14Å; P79-I83 PolarHBondContact O-N 2.94Å; P79-L114 HydrophobicContact CG-CD2 3.91Å
80	P	88.6	Confident	91.3	Very high	87 Å²	87	51.6 Å²	51.6	57%	0.565	28%	0.277	S	S	*	.	H	α-helix	trans	-59.7	-36.6	-178.5	24.3	-33.3	0	0	0	111.6	I82 I83 E84	P80-I82 VanDerWaalsContact C-N 3.28Å; P80-I82 PolarHBondContact O-N 2.91Å; P80-I83 WeakPolarHBondContact O-CB 3.13Å; P80-I83 PolarHBondContact O-N 3.19Å; P80-I83 VanDerWaalsContact O-N 3.08Å; P80-E84 PolarHBondContact O-N 3.02Å
81	D	89.3	Confident	90.8	Very high	85 Å²	85	55.8 Å²	55.8	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-37.9	178.9	-57.2	-7	0	0	0	112.3	P79 C85 F117	P79-D81 PolarHBondContact O-N 2.84Å; D81-C85 WeakPolarHBondContact O-CB 3.46Å; D81-C85 PolarHBondContact O-N 3.3Å; D81-C85 PolarHBondContact O-SG 2.67Å; D81-F117 HydrophobicContact CB-CD1 4.39Å; D81-F117 HydrophobicContact CB-CE1 3.96Å
82	I	90.8	Very high	90.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.8	-40.2	178.5	-64.5	178.5	0	0	0	110.2	P79 P80 A86 I96 L97 L114 F117	P79-I82 HydrophobicContact CB-CD1 4.13Å; P79-I82 HydrophobicContact CB-CG1 4.12Å; P79-I82 HydrophobicContact CG-CD1 3.82Å; P79-I82 HydrophobicContact CG-CG1 4.37Å; P79-I82 PolarHBondContact O-N 3.4Å; P79-I82 VanDerWaalsContact O-N 3.14Å; P80-I82 VanDerWaalsContact C-N 3.28Å; P80-I82 PolarHBondContact O-N 2.91Å; I82-A86 WeakPolarHBondContact O-CB 3.46Å; I82-A86 PolarHBondContact O-N 2.78Å; I82-I96 HydrophobicContact CD1-CG2 4.14Å; I82-L97 HydrophobicContact CG2-CB 3.91Å; I82-L97 HydrophobicContact CG2-CD1 3.84Å; I82-L97 HydrophobicContact CG2-CG 4.46Å; I82-L114 HydrophobicContact CD1-CD2 3.6Å; I82-F117 HydrophobicContact CD1-CB 3.98Å; I82-F117 HydrophobicContact CD1-CD1 4.3Å; I82-F117 HydrophobicContact CD1-CD2 4.22Å; I82-F117 HydrophobicContact CD1-CG 3.89Å; I82-F117 HydrophobicContact CG1-CB 4.1Å; I82-F117 HydrophobicContact CG1-CD1 3.47Å; I82-F117 VanDerWaalsContact CG1-CD1 3.47Å; I82-F117 HydrophobicContact CG1-CD2 3.74Å; I82-F117 HydrophobicContact CG1-CE1 3.75Å; I82-F117 HydrophobicContact CG1-CE2 4.03Å; I82-F117 HydrophobicContact CG1-CG 3.46Å; I82-F117 VanDerWaalsContact CG1-CG 3.46Å; I82-F117 HydrophobicContact CG1-CZ 4.03Å
83	I	92.8	Very high	90.1	Very high	10 Å²	10	50.5 Å²	50.5	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-49.6	179.2	-62.6	176.5	0	0	0	110	W64 Q68 L71 L78 P79 P80 C85 A86 A87	W64-I83 HydrophobicContact CD2-CG2 4.2Å; W64-I83 HydrophobicContact CE3-CG2 3.57Å; W64-I83 HydrophobicContact CZ3-CG2 4.01Å; Q68-I83 HydrophobicContact CG-CD1 3.96Å; Q68-I83 HydrophobicContact CG-CG2 4.09Å; L71-I83 HydrophobicContact CD1-CD1 4.14Å; L78-I83 HydrophobicContact CB-CD1 4.13Å; L78-I83 HydrophobicContact CB-CG1 4.39Å; P79-I83 PolarHBondContact O-N 2.94Å; P80-I83 WeakPolarHBondContact O-CB 3.13Å; P80-I83 PolarHBondContact O-N 3.19Å; P80-I83 VanDerWaalsContact O-N 3.08Å; I83-C85 VanDerWaalsContact C-N 3.34Å; I83-C85 PolarHBondContact O-N 2.9Å; I83-A86 PolarHBondContact O-N 3.43Å; I83-A87 PolarHBondContact O-N 3.18Å
84	E	92.6	Very high	89.9	Confident	89 Å²	89	43.2 Å²	43.2	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-58.9	-46.9	177	-177	-179.6	171.3	0	0	110.8	P80 A86 A87 H88	P80-E84 PolarHBondContact O-N 3.02Å; E84-A86 VanDerWaalsContact C-N 3.33Å; E84-A86 PolarHBondContact O-N 3.02Å; E84-A87 PolarHBondContact O-N 3.12Å; E84-H88 PolarHBondContact O-CD2 3.33Å; E84-H88 PolarHBondContact O-N 2.95Å; E84-H88 VanDerWaalsContact O-N 3.11Å
85	C	92.3	Very high	89.8	Confident	4 Å²	4	41.7 Å²	41.7	3%	0.027	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-35.9	178.2	-68.5	0	0	0	0	112.6	D81 I83 N89 K90 A93 F117	D81-C85 WeakPolarHBondContact O-CB 3.46Å; D81-C85 PolarHBondContact O-N 3.3Å; D81-C85 PolarHBondContact O-SG 2.67Å; I83-C85 VanDerWaalsContact C-N 3.34Å; I83-C85 PolarHBondContact O-N 2.9Å; C85-N89 PolarHBondContact O-N 2.91Å; C85-K90 HydrophobicContact CB-CB 3.95Å; C85-K90 HydrophobicContact CB-CD 3.76Å; C85-K90 HydrophobicContact CB-CG 4.41Å; C85-K90 WeakPolarHBondContact O-CB 3.21Å; C85-K90 PolarHBondContact O-N 3.4Å; C85-K90 WeakPolarHBondContact SG-CD 3.49Å; C85-A93 HydrophobicContact CB-CB 3.57Å; C85-F117 HydrophobicContact CB-CZ 3.7Å
86	A	93.1	Very high	89.6	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-45.2	175.5	0	0	0	0	0	111.2	V28 S29 W64 I82 I83 E84 H88 N89 L97	V28-A86 HydrophobicContact CG1-CB 4.19Å; S29-A86 VanDerWaalsContact CA-O 3.24Å; S29-A86 WeakPolarHBondContact CA-O 3.49Å; S29-A86 WeakPolarHBondContact CB-O 3.21Å; W64-A86 HydrophobicContact CH2-CB 3.97Å; W64-A86 HydrophobicContact CZ2-CB 3.75Å; I82-A86 WeakPolarHBondContact O-CB 3.46Å; I82-A86 PolarHBondContact O-N 2.78Å; I83-A86 PolarHBondContact O-N 3.43Å; E84-A86 VanDerWaalsContact C-N 3.33Å; E84-A86 PolarHBondContact O-N 3.02Å; A86-H88 VanDerWaalsContact C-N 3.27Å; A86-H88 PolarHBondContact O-N 3.28Å; A86-N89 PolarHBondContact O-N 3.27Å; A86-L97 HydrophobicContact CB-CD2 4.03Å
87	A	93.9	Very high	89.7	Confident	3 Å²	3	36.6 Å²	36.6	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-55.6	-43.5	176.6	0	0	0	0	0	112	S29 L61 W64 I83 E84 N89	S29-A87 PolarHBondContact OG-O 3.31Å; L61-A87 HydrophobicContact CD2-CB 4.46Å; W64-A87 HydrophobicContact CD2-CB 4.41Å; W64-A87 HydrophobicContact CG-CB 3.89Å; I83-A87 PolarHBondContact O-N 3.18Å; E84-A87 PolarHBondContact O-N 3.12Å; A87-N89 VanDerWaalsContact C-N 3.26Å; A87-N89 PolarHBondContact O-N 3.37Å
88	H	93.2	Very high	90	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.037	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	5.1	178.5	-66.1	-51.2	0	0	0	115.1	E84 A86 K90 S147 E148 T151	E84-H88 PolarHBondContact O-CD2 3.33Å; E84-H88 PolarHBondContact O-N 2.95Å; E84-H88 VanDerWaalsContact O-N 3.11Å; A86-H88 VanDerWaalsContact C-N 3.27Å; A86-H88 PolarHBondContact O-N 3.28Å; H88-K90 PolarHBondContact O-N 2.93Å; H88-S147 WeakPolarHBondContact ND1-CB 3.22Å; H88-S147 PolarHBondContact ND1-OG 3.11Å; H88-S147 PolarHBondContact O-OG 3.42Å; H88-E148 HydrophobicContact CB-CG 3.92Å; H88-E148 WeakPolarHBondContact CD2-CG 3.35Å; H88-E148 VanDerWaalsContact CG-CG 3.46Å; H88-T151 PolarHBondContact CE1-OG1 3.43Å; H88-T151 VanDerWaalsContact CE1-OG1 3.28Å
89	N	90.3	Very high	90.1	Very high	61 Å²	61	31.3 Å²	31.3	33%	0.326	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	36.6	-177.8	-166.8	36.2	0	0	0	112.9	K25 C85 A86 A87	K25-N89 PolarHBondContact O-OD1 2.91Å; C85-N89 PolarHBondContact O-N 2.91Å; A86-N89 PolarHBondContact O-N 3.27Å; A87-N89 VanDerWaalsContact C-N 3.26Å; A87-N89 PolarHBondContact O-N 3.37Å
90	K	89.4	Confident	90.2	Very high	30 Å²	30	29.2 Å²	29.2	13%	0.13	15%	0.153	C	C	.	.			trans	-61.9	152.7	172.9	-87.4	177.4	154.9	148.8	0	110.5	C85 H88 N92 A93 N143 T145 E148	C85-K90 HydrophobicContact CB-CB 3.95Å; C85-K90 HydrophobicContact CB-CD 3.76Å; C85-K90 HydrophobicContact CB-CG 4.41Å; C85-K90 WeakPolarHBondContact O-CB 3.21Å; C85-K90 PolarHBondContact O-N 3.4Å; C85-K90 WeakPolarHBondContact SG-CD 3.49Å; H88-K90 PolarHBondContact O-N 2.93Å; K90-N92 PolarHBondContact O-N 2.86Å; K90-A93 HydrophobicContact CB-CB 4.18Å; K90-A93 PolarHBondContact O-N 3.16Å; K90-N143 WeakPolarHBondContact CE-O 3.43Å; K90-T145 HydrophobicContact CG-CG2 3.91Å; K90-E148 VanDerWaalsContact CE-CD 3.42Å; K90-E148 WeakPolarHBondContact CE-OE1 3.22Å; K90-E148 VanDerWaalsContact CE-OE2 3.3Å; K90-E148 WeakPolarHBondContact CE-OE2 3.47Å; K90-E148 IonicContact NZ-OE1 2.87Å; K90-E148 PolarHBondContact NZ-OE1 3.02Å; K90-E148 IonicContact NZ-OE2 3.05Å; K90-E148 PolarHBondContact NZ-OE2 3.35Å
91	R	83.6	Confident	90.4	Very high	100 Å²	100	25 Å²	25	38%	0.377	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	137.3	-177.7	-171.9	167.1	174.9	144	0.2	110.3	A93 N121 Y124	R91-A93 PolarHBondContact O-N 2.78Å; R91-N121 WeakPolarHBondContact CD-OD1 3.27Å; R91-N121 PolarHBondContact NE-OD1 3.44Å; R91-Y124 VanDerWaalsContact NH2-CE1 3.32Å; R91-Y124 PolarHBondContact NH2-OH 3.31Å
92	N	83.9	Confident	90.4	Very high	43 Å²	43	21.6 Å²	21.6	23%	0.23	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	-18.7	-178.5	-57.2	-15.2	0	0	0	116.5	A2 K90 G94 I95 I96	A2-N92 WeakPolarHBondContact CB-OD1 3.42Å; K90-N92 PolarHBondContact O-N 2.86Å; N92-G94 PolarHBondContact O-N 3.28Å; N92-I95 WeakPolarHBondContact O-CB 3.43Å; N92-I95 PolarHBondContact O-N 3.05Å; N92-I96 HydrophobicContact CB-CD1 4.06Å; N92-I96 WeakPolarHBondContact O-CG1 3.36Å; N92-I96 PolarHBondContact O-N 2.98Å
93	A	89.3	Confident	90.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-53.7	-49.3	-177	0	0	0	0	0	113	C85 K90 R91 I95 I96 L97 F117	C85-A93 HydrophobicContact CB-CB 3.57Å; K90-A93 HydrophobicContact CB-CB 4.18Å; K90-A93 PolarHBondContact O-N 3.16Å; R91-A93 PolarHBondContact O-N 2.78Å; A93-I95 VanDerWaalsContact C-N 3.3Å; A93-I95 PolarHBondContact O-N 2.89Å; A93-I96 PolarHBondContact O-N 3.39Å; A93-L97 WeakPolarHBondContact O-CB 3.07Å; A93-L97 PolarHBondContact O-N 3.26Å; A93-F117 HydrophobicContact CB-CE2 4.26Å
94	G	90.2	Very high	90.2	Very high	12 Å²	12	24.7 Å²	24.7	12%	0.124	12%	0.123	C	C	.	.	H	α-helix	trans	-65	-31.6	178.5	0	0	0	0	0	114.1	N92 L98	N92-G94 PolarHBondContact O-N 3.28Å; G94-L98 VanDerWaalsContact O-CG 3.29Å; G94-L98 WeakPolarHBondContact O-CG 3.16Å; G94-L98 PolarHBondContact O-N 3.32Å
95	I	88.3	Confident	90.1	Very high	17 Å²	17	22.5 Å²	22.5	9%	0.087	11%	0.112	C	C	.	.	H	α-helix	trans	-72.3	-44.5	177.9	-56.8	177.9	0	0	0	110	A2 I4 N92 A93 L97 L98 T99	A2-I95 HydrophobicContact CB-CD1 3.74Å; A2-I95 WeakPolarHBondContact O-CD1 3.48Å; I4-I95 HydrophobicContact CG1-CD1 4.28Å; I4-I95 HydrophobicContact CG1-CG1 3.92Å; I4-I95 HydrophobicContact CG1-CG2 4.29Å; N92-I95 WeakPolarHBondContact O-CB 3.43Å; N92-I95 PolarHBondContact O-N 3.05Å; A93-I95 VanDerWaalsContact C-N 3.3Å; A93-I95 PolarHBondContact O-N 2.89Å; I95-L97 VanDerWaalsContact C-N 3.32Å; I95-L98 PolarHBondContact O-N 3.23Å; I95-T99 WeakPolarHBondContact O-CB 3.2Å; I95-T99 PolarHBondContact O-N 2.99Å; I95-T99 PolarHBondContact O-OG1 3.26Å
96	I	88.6	Confident	89.8	Confident	33 Å²	33	24.3 Å²	24.3	17%	0.169	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-46.3	177.7	-66.2	169.3	0	0	0	108.7	I82 N92 A93 L98 T99 T100 F117	I82-I96 HydrophobicContact CD1-CG2 4.14Å; N92-I96 HydrophobicContact CB-CD1 4.06Å; N92-I96 WeakPolarHBondContact O-CG1 3.36Å; N92-I96 PolarHBondContact O-N 2.98Å; A93-I96 PolarHBondContact O-N 3.39Å; I96-L98 PolarHBondContact O-N 3.01Å; I96-T99 WeakPolarHBondContact O-CB 3.34Å; I96-T99 PolarHBondContact O-N 3.47Å; I96-T99 VanDerWaalsContact O-N 3.17Å; I96-T100 HydrophobicContact CG2-CG2 4.19Å; I96-T100 WeakPolarHBondContact O-CG2 3.45Å; I96-T100 PolarHBondContact O-N 3.26Å; I96-T100 PolarHBondContact O-OG1 3.24Å; I96-F117 HydrophobicContact CB-CD2 4.36Å; I96-F117 HydrophobicContact CD1-CD2 3.6Å; I96-F117 HydrophobicContact CD1-CE2 4.12Å; I96-F117 HydrophobicContact CG2-CD2 4.01Å
97	L	92.1	Very high	89.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.4	-52.5	175.8	-176.5	73.2	0	0	0	112.3	V28 V34 W64 L78 I82 A86 A93 I95 T99 T100 L101	V28-L97 HydrophobicContact CG1-CD2 3.9Å; V34-L97 HydrophobicContact CG2-CD2 3.92Å; W64-L97 HydrophobicContact CH2-CD2 3.41Å; W64-L97 VanDerWaalsContact CH2-CD2 3.41Å; W64-L97 HydrophobicContact CZ2-CD2 4.33Å; W64-L97 HydrophobicContact CZ3-CD2 4.15Å; L78-L97 HydrophobicContact CD1-CD1 3.72Å; I82-L97 HydrophobicContact CG2-CB 3.91Å; I82-L97 HydrophobicContact CG2-CD1 3.84Å; I82-L97 HydrophobicContact CG2-CG 4.46Å; A86-L97 HydrophobicContact CB-CD2 4.03Å; A93-L97 WeakPolarHBondContact O-CB 3.07Å; A93-L97 PolarHBondContact O-N 3.26Å; I95-L97 VanDerWaalsContact C-N 3.32Å; L97-T99 VanDerWaalsContact C-N 3.25Å; L97-T99 PolarHBondContact O-N 3.5Å; L97-T100 WeakPolarHBondContact CA-OG1 3.38Å; L97-T100 PolarHBondContact O-N 3.29Å; L97-T100 VanDerWaalsContact O-N 3.12Å; L97-T100 PolarHBondContact O-OG1 3.4Å; L97-L101 HydrophobicContact CG-CD1 4.23Å; L97-L101 WeakPolarHBondContact O-CG 3.45Å; L97-L101 PolarHBondContact O-N 2.91Å
98	L	91.6	Very high	87.9	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-37.4	178.6	-72.4	173.3	0	0	0	112.3	I4 V8 L12 V28 L33 I37 G94 I95 I96 H102	I4-L98 HydrophobicContact CD1-CD1 4.43Å; V8-L98 HydrophobicContact CG1-CB 3.92Å; L12-L98 HydrophobicContact CD1-CD1 4.35Å; L12-L98 HydrophobicContact CD2-CD2 4.37Å; V28-L98 HydrophobicContact CG2-CD1 3.66Å; V28-L98 HydrophobicContact CG2-CD2 4.1Å; V28-L98 HydrophobicContact CG2-CG 3.81Å; L33-L98 HydrophobicContact CD2-CD1 4.42Å; L33-L98 HydrophobicContact CD2-CD2 4.24Å; I37-L98 HydrophobicContact CD1-CD2 3.6Å; G94-L98 VanDerWaalsContact O-CG 3.29Å; G94-L98 WeakPolarHBondContact O-CG 3.16Å; G94-L98 PolarHBondContact O-N 3.32Å; I95-L98 PolarHBondContact O-N 3.23Å; I96-L98 PolarHBondContact O-N 3.01Å; L98-H102 WeakPolarHBondContact O-CB 3.45Å; L98-H102 PolarHBondContact O-N 3.06Å
99	T	90	Very high	86.3	Confident	27 Å²	27	46.8 Å²	46.8	17%	0.166	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-43.3	175.8	-55.4	0	0	0	0	110.9	V8 I95 I96 L97 H102 E103	V8-T99 HydrophobicContact CG2-CG2 4.48Å; I95-T99 WeakPolarHBondContact O-CB 3.2Å; I95-T99 PolarHBondContact O-N 2.99Å; I95-T99 PolarHBondContact O-OG1 3.26Å; I96-T99 WeakPolarHBondContact O-CB 3.34Å; I96-T99 PolarHBondContact O-N 3.47Å; I96-T99 VanDerWaalsContact O-N 3.17Å; L97-T99 VanDerWaalsContact C-N 3.25Å; L97-T99 PolarHBondContact O-N 3.5Å; T99-H102 WeakPolarHBondContact O-CB 3.4Å; T99-H102 PolarHBondContact O-N 3.46Å; T99-E103 WeakPolarHBondContact O-CG 3.3Å; T99-E103 PolarHBondContact O-N 2.69Å
100	T	90	Very high	84.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-41.8	178.7	62.2	0	0	0	0	111.7	I96 L97 E103 I104 L114	I96-T100 HydrophobicContact CG2-CG2 4.19Å; I96-T100 WeakPolarHBondContact O-CG2 3.45Å; I96-T100 PolarHBondContact O-N 3.26Å; I96-T100 PolarHBondContact O-OG1 3.24Å; L97-T100 WeakPolarHBondContact CA-OG1 3.38Å; L97-T100 PolarHBondContact O-N 3.29Å; L97-T100 VanDerWaalsContact O-N 3.12Å; L97-T100 PolarHBondContact O-OG1 3.4Å; T100-E103 PolarHBondContact O-N 2.68Å; T100-I104 WeakPolarHBondContact O-CD1 3.16Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.25Å; T100-L114 HydrophobicContact CG2-CD2 3.29Å; T100-L114 HydrophobicContact CG2-CG 3.79Å
101	L	92.2	Very high	83.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-44.9	173.9	-70	174.8	0	0	0	111.4	W11 V34 L78 L97 E103 I104 F105	W11-L101 HydrophobicContact CH2-CB 3.92Å; V34-L101 HydrophobicContact CG1-CD1 4.06Å; V34-L101 HydrophobicContact CG2-CD1 4.38Å; L78-L101 HydrophobicContact CD1-CD2 4.1Å; L97-L101 HydrophobicContact CG-CD1 4.23Å; L97-L101 WeakPolarHBondContact O-CG 3.45Å; L97-L101 PolarHBondContact O-N 2.91Å; L101-E103 VanDerWaalsContact C-N 3.31Å; L101-E103 PolarHBondContact O-N 3.01Å; L101-I104 PolarHBondContact O-N 3.27Å; L101-F105 HydrophobicContact CB-CD2 4.46Å; L101-F105 HydrophobicContact CD2-CE2 4.22Å; L101-F105 WeakPolarHBondContact O-CD2 3.45Å; L101-F105 PolarHBondContact O-N 3.21Å
102	H	91.1	Very high	82	Confident	13 Å²	13	56.6 Å²	56.6	6%	0.06	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-42.4	175.5	171.9	-124.9	0	0	0	111.9	V8 W11 L98 T99 S106	V8-H102 HydrophobicContact CG2-CB 4.19Å; W11-H102 WeakPolarHBondContact CB-CD2 3.41Å; W11-H102 AromaticContact CD1-CD2 3.77Å; W11-H102 HydrophobicContact CD2-CB 3.89Å; W11-H102 AromaticContact CD2-CD2 3.58Å; W11-H102 HydrophobicContact CE3-CB 3.6Å; W11-H102 AromaticContact CG-CD2 3.26Å; W11-H102 HydrophobicContact CH2-CB 4.28Å; W11-H102 HydrophobicContact CZ3-CB 3.81Å; L98-H102 WeakPolarHBondContact O-CB 3.45Å; L98-H102 PolarHBondContact O-N 3.06Å; T99-H102 WeakPolarHBondContact O-CB 3.4Å; T99-H102 PolarHBondContact O-N 3.46Å; H102-S106 PolarHBondContact CD2-OG 3Å; H102-S106 PolarHBondContact NE2-OG 3.06Å; H102-S106 WeakPolarHBondContact O-CB 2.94Å; H102-S106 PolarHBondContact O-N 3.43Å; H102-S106 PolarHBondContact O-OG 3.45Å
103	E	89.3	Confident	80.8	Confident	21 Å²	21	55.6 Å²	55.6	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-45.6	176.5	-72.7	177	156.7	0	0	112	T99 T100 L101 K107 K108 V110 R111 S113	T99-E103 WeakPolarHBondContact O-CG 3.3Å; T99-E103 PolarHBondContact O-N 2.69Å; T100-E103 PolarHBondContact O-N 2.68Å; L101-E103 VanDerWaalsContact C-N 3.31Å; L101-E103 PolarHBondContact O-N 3.01Å; E103-K107 PolarHBondContact O-N 3.38Å; E103-K108 PolarHBondContact O-N 2.79Å; E103-V110 HydrophobicContact CB-CG2 4.16Å; E103-V110 WeakPolarHBondContact OE2-CA 3.24Å; E103-V110 WeakPolarHBondContact OE2-CG1 3.03Å; E103-R111 PolarHBondContact OE1-N 3.32Å; E103-S113 PolarHBondContact OE2-OG 2.89Å
104	I	89.5	Confident	79.3	Confident	54 Å²	54	58.3 Å²	58.3	28%	0.277	28%	0.276	S	S	.	.	H	α-helix	trans	-58.4	-52.3	177.4	-69.7	160.6	0	0	0	110.5	I76 L78 T100 L101	I76-I104 HydrophobicContact CG2-CD1 3.96Å; I76-I104 HydrophobicContact CG2-CG2 4.4Å; L78-I104 HydrophobicContact CD2-CD1 3.81Å; T100-I104 WeakPolarHBondContact O-CD1 3.16Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.25Å; L101-I104 PolarHBondContact O-N 3.27Å
105	F	90	Very high	77.8	Confident	43 Å²	43	62.2 Å²	62.2	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-77.5	-29.1	-175.1	-73.8	-64.2	0	0	0	114	W11 I37 L38 Y41 I76 L101 K107	W11-F105 HydrophobicContact CZ2-CB 4.36Å; W11-F105 HydrophobicContact CZ2-CD2 4.04Å; I37-F105 HydrophobicContact CG2-CD2 4.46Å; I37-F105 HydrophobicContact CG2-CE2 4.2Å; L38-F105 HydrophobicContact CD2-CE2 4.18Å; L38-F105 HydrophobicContact CD2-CZ 3.88Å; Y41-F105 AromaticContact CD1-CD1 3.57Å; Y41-F105 HydrophobicContact CD1-CD1 3.57Å; Y41-F105 AromaticContact CD1-CE1 3.97Å; Y41-F105 HydrophobicContact CD1-CE1 3.97Å; Y41-F105 HydrophobicContact CD1-CG 4.24Å; Y41-F105 HydrophobicContact CD2-CB 4.5Å; Y41-F105 AromaticContact CD2-CD1 3.54Å; Y41-F105 HydrophobicContact CD2-CD1 3.54Å; Y41-F105 AromaticContact CD2-CD2 3.89Å; Y41-F105 HydrophobicContact CD2-CD2 3.89Å; Y41-F105 AromaticContact CD2-CE1 3.58Å; Y41-F105 HydrophobicContact CD2-CE1 3.58Å; Y41-F105 AromaticContact CD2-CE2 3.92Å; Y41-F105 HydrophobicContact CD2-CE2 3.92Å; Y41-F105 AromaticContact CD2-CG 3.72Å; Y41-F105 HydrophobicContact CD2-CG 3.72Å; Y41-F105 AromaticContact CD2-CZ 3.78Å; Y41-F105 HydrophobicContact CD2-CZ 3.78Å; Y41-F105 HydrophobicContact CE1-CB 3.93Å; Y41-F105 AromaticContact CE1-CD1 3.73Å; Y41-F105 HydrophobicContact CE1-CD1 3.73Å; Y41-F105 AromaticContact CE1-CG 4Å; Y41-F105 HydrophobicContact CE1-CG 4Å; Y41-F105 HydrophobicContact CE2-CB 3.81Å; Y41-F105 AromaticContact CE2-CD1 3.73Å; Y41-F105 HydrophobicContact CE2-CD1 3.73Å; Y41-F105 AromaticContact CE2-CD2 3.7Å; Y41-F105 HydrophobicContact CE2-CD2 3.7Å; Y41-F105 HydrophobicContact CE2-CE1 4.22Å; Y41-F105 HydrophobicContact CE2-CE2 4.19Å; Y41-F105 AromaticContact CE2-CG 3.46Å; Y41-F105 HydrophobicContact CE2-CG 3.46Å; Y41-F105 VanDerWaalsContact CE2-CG 3.46Å; Y41-F105 HydrophobicContact CE2-CZ 4.43Å; Y41-F105 AromaticContact CG-CD1 3.48Å; Y41-F105 HydrophobicContact CG-CD1 3.48Å; Y41-F105 VanDerWaalsContact CG-CD1 3.48Å; Y41-F105 AromaticContact CG-CE1 3.45Å; Y41-F105 HydrophobicContact CG-CE1 3.45Å; Y41-F105 VanDerWaalsContact CG-CE1 3.45Å; Y41-F105 HydrophobicContact CG-CG 4.12Å; Y41-F105 HydrophobicContact CG-CZ 4.07Å; Y41-F105 VanDerWaalsContact CZ-CB 3.48Å; Y41-F105 AromaticContact CZ-CD1 3.82Å; Y41-F105 AromaticContact CZ-CG 3.62Å; Y41-F105 WeakPolarHBondContact OH-CB 3.48Å; I76-F105 HydrophobicContact CD1-CE1 4.31Å; I76-F105 HydrophobicContact CD1-CZ 3.82Å; L101-F105 HydrophobicContact CB-CD2 4.46Å; L101-F105 HydrophobicContact CD2-CE2 4.22Å; L101-F105 WeakPolarHBondContact O-CD2 3.45Å; L101-F105 PolarHBondContact O-N 3.21Å; F105-K107 PolarHBondContact O-N 3.5Å
106	S	86.2	Confident	76.7	Confident	42 Å²	42	66.7 Å²	66.7	29%	0.294	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.2	177.5	-57.4	0	0	0	0	113.6	H102 K108	H102-S106 PolarHBondContact CD2-OG 3Å; H102-S106 PolarHBondContact NE2-OG 3.06Å; H102-S106 WeakPolarHBondContact O-CB 2.94Å; H102-S106 PolarHBondContact O-N 3.43Å; H102-S106 PolarHBondContact O-OG 3.45Å; S106-K108 PolarHBondContact O-N 3.39Å
107	K	77.6	Confident	76	Confident	199 Å²	199	66.8 Å²	66.8	87%	0.865	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	21.8	-172.1	-56.1	-179.2	-178.8	178.5	0	113.3	E103 F105	E103-K107 PolarHBondContact O-N 3.38Å; F105-K107 PolarHBondContact O-N 3.5Å
108	K	69.2	Low	75.5	Confident	107 Å²	107	69.1 Å²	69.1	47%	0.465	34%	0.338	S	S	.	.			trans	-75.6	145.8	173	-72.1	177.6	176.9	173.1	0	106.9	E7 E103 S106 V110	E7-K108 IonicContact OE2-NZ 3.29Å; E7-K108 PolarHBondContact OE2-NZ 2.93Å; E103-K108 PolarHBondContact O-N 2.79Å; S106-K108 PolarHBondContact O-N 3.39Å; K108-V110 PolarHBondContact O-N 3.23Å
109	K	60.3	Low	75	Confident	178 Å²	178	71.7 Å²	71.7	77%	0.774	36%	0.355	S	S	*	.			trans	-51.4	122.4	172.4	-71.9	-174.8	177.3	-176.3	0	107.6	R111	K109-R111 HydrophobicContact CB-CG 4.38Å; K109-R111 PolarHBondContact O-N 3.3Å
110	V	59.9	Low	74.9	Confident	72 Å²	72	71.7 Å²	71.7	44%	0.436	36%	0.355	S	S	.	.			trans	-58.5	91.7	171.8	178.1	0	0	0	0	106.1	E103 K108 E112 L114	E103-V110 HydrophobicContact CB-CG2 4.16Å; E103-V110 WeakPolarHBondContact OE2-CA 3.24Å; E103-V110 WeakPolarHBondContact OE2-CG1 3.03Å; K108-V110 PolarHBondContact O-N 3.23Å; V110-E112 PolarHBondContact O-N 2.92Å; V110-L114 HydrophobicContact CG1-CD1 4Å; V110-L114 HydrophobicContact CG1-CG 4.27Å
111	R	54.3	Low	74.7	Confident	199 Å²	199	72 Å²	72	75%	0.751	36%	0.357	S	S	*	.			trans	-89.2	98	-171.9	-85.9	-174.7	177.4	173.6	-0.4	106.7	E103 K109 S113	E103-R111 PolarHBondContact OE1-N 3.32Å; K109-R111 HydrophobicContact CB-CG 4.38Å; K109-R111 PolarHBondContact O-N 3.3Å; R111-S113 PolarHBondContact O-N 2.92Å
112	E	59.1	Low	74.6	Confident	126 Å²	126	73.2 Å²	73.2	59%	0.589	36%	0.363	S	S	*	.	S	Bend	trans	58.2	-4.4	164.3	-64.3	175.1	-172.1	0	0	117.6	V110 L114 A115 K116	V110-E112 PolarHBondContact O-N 2.92Å; E112-L114 PolarHBondContact O-N 2.93Å; E112-A115 PolarHBondContact O-N 3.49Å; E112-K116 PolarHBondContact O-N 2.93Å; E112-K116 WeakPolarHBondContact OE2-CE 3.41Å; E112-K116 IonicContact OE2-NZ 2.69Å; E112-K116 PolarHBondContact OE2-NZ 3.14Å
113	S	57.3	Low	74.4	Confident	21 Å²	21	78.5 Å²	78.5	15%	0.147	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-44.5	-172	66.7	0	0	0	0	112	E103 R111	E103-S113 PolarHBondContact OE2-OG 2.89Å; R111-S113 PolarHBondContact O-N 2.92Å
114	L	58.1	Low	74.4	Confident	57 Å²	57	81 Å²	81	30%	0.298	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-71.1	-35.3	176.4	-68.2	175.6	0	0	0	112.9	P79 I82 T100 V110 E112 K116 F117	P79-L114 HydrophobicContact CG-CD2 3.91Å; I82-L114 HydrophobicContact CD1-CD2 3.6Å; T100-L114 HydrophobicContact CG2-CD2 3.29Å; T100-L114 HydrophobicContact CG2-CG 3.79Å; V110-L114 HydrophobicContact CG1-CD1 4Å; V110-L114 HydrophobicContact CG1-CG 4.27Å; E112-L114 PolarHBondContact O-N 2.93Å; L114-K116 PolarHBondContact O-N 3.13Å; L114-K116 VanDerWaalsContact O-N 3.16Å; L114-F117 PolarHBondContact O-N 3.08Å
115	A	59.5	Low	74.5	Confident	94 Å²	94	78.4 Å²	78.4	78%	0.777	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-68.4	-14.4	-177.5	0	0	0	0	0	113.1	E112	E112-A115 PolarHBondContact O-N 3.49Å
116	K	64.3	Low	74.6	Confident	112 Å²	112	78.8 Å²	78.8	49%	0.487	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-110.9	10.2	-177.9	-64.6	176.3	-173.1	165.3	0	113.2	E112 L114 D118	E112-K116 PolarHBondContact O-N 2.93Å; E112-K116 WeakPolarHBondContact OE2-CE 3.41Å; E112-K116 IonicContact OE2-NZ 2.69Å; E112-K116 PolarHBondContact OE2-NZ 3.14Å; L114-K116 PolarHBondContact O-N 3.13Å; L114-K116 VanDerWaalsContact O-N 3.16Å; K116-D118 VanDerWaalsContact C-N 3.33Å; K116-D118 PolarHBondContact O-N 2.82Å
117	F	74	Confident	74.8	Confident	34 Å²	34	80.7 Å²	80.7	15%	0.149	40%	0.399	C	S	.	.			trans	-70.3	95.4	176.1	-175.3	-105.6	0	0	0	110.1	D81 I82 C85 A93 I96 L114 P119	D81-F117 HydrophobicContact CB-CD1 4.39Å; D81-F117 HydrophobicContact CB-CE1 3.96Å; I82-F117 HydrophobicContact CD1-CB 3.98Å; I82-F117 HydrophobicContact CD1-CD1 4.3Å; I82-F117 HydrophobicContact CD1-CD2 4.22Å; I82-F117 HydrophobicContact CD1-CG 3.89Å; I82-F117 HydrophobicContact CG1-CB 4.1Å; I82-F117 HydrophobicContact CG1-CD1 3.47Å; I82-F117 VanDerWaalsContact CG1-CD1 3.47Å; I82-F117 HydrophobicContact CG1-CD2 3.74Å; I82-F117 HydrophobicContact CG1-CE1 3.75Å; I82-F117 HydrophobicContact CG1-CE2 4.03Å; I82-F117 HydrophobicContact CG1-CG 3.46Å; I82-F117 VanDerWaalsContact CG1-CG 3.46Å; I82-F117 HydrophobicContact CG1-CZ 4.03Å; C85-F117 HydrophobicContact CB-CZ 3.7Å; A93-F117 HydrophobicContact CB-CE2 4.26Å; I96-F117 HydrophobicContact CB-CD2 4.36Å; I96-F117 HydrophobicContact CD1-CD2 3.6Å; I96-F117 HydrophobicContact CD1-CE2 4.12Å; I96-F117 HydrophobicContact CG2-CD2 4.01Å; L114-F117 PolarHBondContact O-N 3.08Å; F117-P119 HydrophobicContact CE1-CB 3.94Å; F117-P119 HydrophobicContact CZ-CB 4.29Å
118	D	82	Confident	75.5	Confident	50 Å²	50	72.9 Å²	72.9	27%	0.267	37%	0.366	S	S	.	.			trans	-88.6	117.3	161.7	-174.7	1.6	0	0	0	107.7	K116 T120 L122	K116-D118 VanDerWaalsContact C-N 3.33Å; K116-D118 PolarHBondContact O-N 2.82Å; D118-T120 PolarHBondContact O-N 3.14Å; D118-T120 VanDerWaalsContact O-N 3.14Å; D118-T120 WeakPolarHBondContact OD1-CA 3.17Å; D118-T120 WeakPolarHBondContact OD1-CB 3.25Å; D118-T120 PolarHBondContact OD1-N 2.87Å; D118-T120 PolarHBondContact OD1-OG1 3.33Å; D118-T120 VanDerWaalsContact OD1-OG1 3.08Å; D118-L122 VanDerWaalsContact OD2-CB 3.22Å; D118-L122 WeakPolarHBondContact OD2-CB 3.38Å
119	P	81.4	Confident	76.6	Confident	56 Å²	56	70.8 Å²	70.8	36%	0.364	36%	0.364	S	S	.	.	S	Bend	trans	-62.6	-15.8	172.2	27.4	-34.9	0	0	0	111.8	F117	F117-P119 HydrophobicContact CE1-CB 3.94Å; F117-P119 HydrophobicContact CZ-CB 4.29Å
120	T	87.1	Confident	78	Confident	26 Å²	26	63.4 Å²	63.4	16%	0.16	33%	0.332	C	S	.	.	S	Bend	trans	-92	147.3	175	-38.7	0	0	0	0	110.9	D118 L122 F139 N143 L165	D118-T120 PolarHBondContact O-N 3.14Å; D118-T120 VanDerWaalsContact O-N 3.14Å; D118-T120 WeakPolarHBondContact OD1-CA 3.17Å; D118-T120 WeakPolarHBondContact OD1-CB 3.25Å; D118-T120 PolarHBondContact OD1-N 2.87Å; D118-T120 PolarHBondContact OD1-OG1 3.33Å; D118-T120 VanDerWaalsContact OD1-OG1 3.08Å; T120-L122 HydrophobicContact CG2-CB 4.36Å; T120-L122 PolarHBondContact O-N 2.87Å; T120-F139 HydrophobicContact CG2-CE1 4.24Å; T120-F139 HydrophobicContact CG2-CE2 4Å; T120-F139 HydrophobicContact CG2-CZ 3.41Å; T120-F139 VanDerWaalsContact CG2-CZ 3.41Å; T120-N143 WeakPolarHBondContact CA-OD1 3.39Å; T120-N143 WeakPolarHBondContact CG2-OD1 3.33Å; T120-L165 HydrophobicContact CG2-CD2 4.22Å
121	N	86.4	Confident	79.4	Confident	9 Å²	9	68.8 Å²	68.8	5%	0.048	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	23.9	176.1	-166.1	27.1	0	0	0	112.8	R91 Y124 Q125 N143	R91-N121 WeakPolarHBondContact CD-OD1 3.27Å; R91-N121 PolarHBondContact NE-OD1 3.44Å; N121-Y124 WeakPolarHBondContact ND2-CD1 3.11Å; N121-Y124 PolarHBondContact O-N 3.33Å; N121-Y124 WeakPolarHBondContact OD1-CB 3.4Å; N121-Y124 VanDerWaalsContact OD1-CD1 3.23Å; N121-Y124 WeakPolarHBondContact OD1-CD1 3.37Å; N121-Q125 WeakPolarHBondContact O-CG 3.49Å; N121-Q125 PolarHBondContact O-N 3.01Å; N121-Q125 VanDerWaalsContact O-N 3.1Å; N121-N143 VanDerWaalsContact CB-OD1 3.28Å; N121-N143 WeakPolarHBondContact CB-OD1 3.39Å; N121-N143 PolarHBondContact N-OD1 3.34Å
122	L	89.9	Confident	81.3	Confident	24 Å²	24	61.8 Å²	61.8	13%	0.126	33%	0.331	C	S	.	.	H	α-helix	trans	-69.8	-44.9	-169	-169.1	65.7	0	0	0	111.5	D118 T120 Y124 Q125 F126 T168 M172 I232	D118-L122 VanDerWaalsContact OD2-CB 3.22Å; D118-L122 WeakPolarHBondContact OD2-CB 3.38Å; T120-L122 HydrophobicContact CG2-CB 4.36Å; T120-L122 PolarHBondContact O-N 2.87Å; L122-Y124 PolarHBondContact O-N 3.4Å; L122-Q125 WeakPolarHBondContact O-CB 3.36Å; L122-Q125 PolarHBondContact O-N 3.37Å; L122-F126 HydrophobicContact CD1-CD2 4.11Å; L122-F126 HydrophobicContact CD1-CE2 3.6Å; L122-F126 HydrophobicContact CD1-CZ 4.47Å; L122-F126 HydrophobicContact CD2-CE2 3.94Å; L122-F126 HydrophobicContact CG-CD2 3.77Å; L122-F126 HydrophobicContact CG-CE2 3.5Å; L122-F126 VanDerWaalsContact CG-CE2 3.5Å; L122-F126 VanDerWaalsContact O-CD2 3.29Å; L122-F126 WeakPolarHBondContact O-CD2 3.46Å; L122-F126 PolarHBondContact O-N 3.5Å; L122-T168 HydrophobicContact CD1-CG2 4.35Å; L122-T168 HydrophobicContact CD2-CG2 4.38Å; L122-M172 HydrophobicContact CD1-CB 4.07Å; L122-M172 HydrophobicContact CD1-CG 4.04Å; L122-M172 HydrophobicContact CD1-SD 3.91Å; L122-I232 HydrophobicContact CD2-CD1 4.45Å
123	E	87.7	Confident	82.9	Confident	125 Å²	125	57.1 Å²	57.1	58%	0.584	31%	0.308	S	S	*	.	H	α-helix	trans	-53.9	-44.2	175.7	-175.1	-176.1	-172.7	0	0	111.5	F126 S127	E123-F126 PolarHBondContact O-N 3.44Å; E123-S127 PolarHBondContact O-N 3.03Å
124	Y	87.9	Confident	84.6	Confident	73 Å²	73	56.5 Å²	56.5	29%	0.286	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-42.5	175.5	171.3	-109	0	0	0	112	R91 N121 L122 F126 S127 L128	R91-Y124 VanDerWaalsContact NH2-CE1 3.32Å; R91-Y124 PolarHBondContact NH2-OH 3.31Å; N121-Y124 WeakPolarHBondContact ND2-CD1 3.11Å; N121-Y124 PolarHBondContact O-N 3.33Å; N121-Y124 WeakPolarHBondContact OD1-CB 3.4Å; N121-Y124 VanDerWaalsContact OD1-CD1 3.23Å; N121-Y124 WeakPolarHBondContact OD1-CD1 3.37Å; L122-Y124 PolarHBondContact O-N 3.4Å; Y124-F126 VanDerWaalsContact C-N 3.27Å; Y124-F126 PolarHBondContact O-N 3.45Å; Y124-S127 WeakPolarHBondContact O-CB 3.29Å; Y124-S127 PolarHBondContact O-N 2.92Å; Y124-S127 VanDerWaalsContact O-N 3.11Å; Y124-S127 PolarHBondContact O-OG 2.76Å; Y124-L128 HydrophobicContact CD1-CD1 4.33Å; Y124-L128 HydrophobicContact CE1-CD1 3.73Å; Y124-L128 HydrophobicContact CE1-CG 4.41Å; Y124-L128 HydrophobicContact CE2-CD1 4.37Å; Y124-L128 HydrophobicContact CE2-CD2 3.95Å; Y124-L128 HydrophobicContact CE2-CG 4.22Å; Y124-L128 WeakPolarHBondContact O-CG 3.38Å; Y124-L128 PolarHBondContact O-N 2.93Å
125	Q	92.3	Very high	86.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-41.1	176.6	-63.9	-60.9	-34	0	0	111.2	N121 L122 S127 L128 R133 S134 F139 M172	N121-Q125 WeakPolarHBondContact O-CG 3.49Å; N121-Q125 PolarHBondContact O-N 3.01Å; N121-Q125 VanDerWaalsContact O-N 3.1Å; L122-Q125 WeakPolarHBondContact O-CB 3.36Å; L122-Q125 PolarHBondContact O-N 3.37Å; Q125-S127 VanDerWaalsContact C-N 3.29Å; Q125-S127 PolarHBondContact O-N 3.41Å; Q125-L128 WeakPolarHBondContact O-CB 3.33Å; Q125-L128 PolarHBondContact O-N 3.17Å; Q125-L128 VanDerWaalsContact O-N 3.14Å; Q125-R133 WeakPolarHBondContact O-CD 3.41Å; Q125-R133 WeakPolarHBondContact O-CG 3.5Å; Q125-R133 PolarHBondContact O-NE 3.07Å; Q125-S134 PolarHBondContact NE2-OG 2.91Å; Q125-S134 PolarHBondContact OE1-OG 3.2Å; Q125-F139 HydrophobicContact CG-CD2 4.14Å; Q125-F139 HydrophobicContact CG-CE2 4.23Å; Q125-M172 HydrophobicContact CB-SD 3.61Å; Q125-M172 HydrophobicContact CG-SD 4.04Å
126	F	91.4	Very high	88.2	Confident	50 Å²	50	56.2 Å²	56.2	22%	0.219	29%	0.294	C	S	.	.	H	α-helix	trans	-68.4	-26	176.5	-77.4	-68.1	0	0	0	113.5	L122 E123 Y124 L128 M172 I175	L122-F126 HydrophobicContact CD1-CD2 4.11Å; L122-F126 HydrophobicContact CD1-CE2 3.6Å; L122-F126 HydrophobicContact CD1-CZ 4.47Å; L122-F126 HydrophobicContact CD2-CE2 3.94Å; L122-F126 HydrophobicContact CG-CD2 3.77Å; L122-F126 HydrophobicContact CG-CE2 3.5Å; L122-F126 VanDerWaalsContact CG-CE2 3.5Å; L122-F126 VanDerWaalsContact O-CD2 3.29Å; L122-F126 WeakPolarHBondContact O-CD2 3.46Å; L122-F126 PolarHBondContact O-N 3.5Å; E123-F126 PolarHBondContact O-N 3.44Å; Y124-F126 VanDerWaalsContact C-N 3.27Å; Y124-F126 PolarHBondContact O-N 3.45Å; F126-L128 PolarHBondContact O-N 3.4Å; F126-M172 HydrophobicContact CE1-CG 4.23Å; F126-M172 HydrophobicContact CE2-CG 4.21Å; F126-M172 HydrophobicContact CZ-CB 4.39Å; F126-M172 HydrophobicContact CZ-CG 3.79Å; F126-I175 HydrophobicContact CE1-CB 4.39Å; F126-I175 HydrophobicContact CE1-CG2 3.84Å; F126-I175 HydrophobicContact CZ-CB 4.36Å; F126-I175 HydrophobicContact CZ-CD1 4.01Å; F126-I175 HydrophobicContact CZ-CG2 4.14Å
127	S	90.6	Very high	89.7	Confident	83 Å²	83	54.3 Å²	54.3	58%	0.58	30%	0.299	S	S	*	.	H	α-helix	trans	-70	-17.9	172	79.4	0	0	0	0	113.9	E123 Y124 Q125	E123-S127 PolarHBondContact O-N 3.03Å; Y124-S127 WeakPolarHBondContact O-CB 3.29Å; Y124-S127 PolarHBondContact O-N 2.92Å; Y124-S127 VanDerWaalsContact O-N 3.11Å; Y124-S127 PolarHBondContact O-OG 2.76Å; Q125-S127 VanDerWaalsContact C-N 3.29Å; Q125-S127 PolarHBondContact O-N 3.41Å
128	L	92.3	Very high	90.7	Very high	34 Å²	34	57.3 Å²	57.3	18%	0.178	31%	0.312	C	S	.	.	S	Bend	trans	-89.3	146.8	-179.5	-61.8	174.2	0	0	0	111.5	Y124 Q125 F126 R133	Y124-L128 HydrophobicContact CD1-CD1 4.33Å; Y124-L128 HydrophobicContact CE1-CD1 3.73Å; Y124-L128 HydrophobicContact CE1-CG 4.41Å; Y124-L128 HydrophobicContact CE2-CD1 4.37Å; Y124-L128 HydrophobicContact CE2-CD2 3.95Å; Y124-L128 HydrophobicContact CE2-CG 4.22Å; Y124-L128 WeakPolarHBondContact O-CG 3.38Å; Y124-L128 PolarHBondContact O-N 2.93Å; Q125-L128 WeakPolarHBondContact O-CB 3.33Å; Q125-L128 PolarHBondContact O-N 3.17Å; Q125-L128 VanDerWaalsContact O-N 3.14Å; F126-L128 PolarHBondContact O-N 3.4Å; L128-R133 HydrophobicContact CB-CG 4.12Å; L128-R133 PolarHBondContact O-NE 3.03Å
129	P	92.2	Very high	91.3	Very high	64 Å²	64	54.9 Å²	54.9	42%	0.416	30%	0.299	S	S	.	.			trans	-53.6	144.1	164.4	-22.9	32.8	0	0	0	111.2	Y131 A132 R133	P129-Y131 HydrophobicContact CB-CD1 3.98Å; P129-Y131 HydrophobicContact CB-CE1 3.42Å; P129-Y131 VanDerWaalsContact CB-CE1 3.42Å; P129-Y131 HydrophobicContact CB-CE2 4.1Å; P129-Y131 VanDerWaalsContact CB-CZ 3.48Å; P129-Y131 HydrophobicContact CG-CE1 4.38Å; P129-Y131 PolarHBondContact O-N 3.01Å; P129-Y131 VanDerWaalsContact O-N 3.11Å; P129-A132 PolarHBondContact O-N 3.22Å; P129-R133 PolarHBondContact O-N 3.33Å
130	I	89.6	Confident	92	Very high	23 Å²	23	53.9 Å²	53.9	12%	0.118	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-56	-38.1	-170.5	-59.3	172.4	0	0	0	112.7	A132 R133 E176 E180	I130-A132 VanDerWaalsContact C-N 3.25Å; I130-A132 PolarHBondContact O-N 3.41Å; I130-R133 PolarHBondContact O-N 3.05Å; I130-E176 HydrophobicContact CG2-CG 4.2Å; I130-E180 HydrophobicContact CD1-CB 4.43Å; I130-E180 HydrophobicContact CD1-CG 3.96Å; I130-E180 WeakPolarHBondContact CD1-OE2 3.46Å
131	Y	89.6	Confident	92.3	Very high	185 Å²	185	60.6 Å²	60.6	73%	0.725	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-70	-18.4	179	59.1	-99.3	0	0	0	114	P129	P129-Y131 HydrophobicContact CB-CD1 3.98Å; P129-Y131 HydrophobicContact CB-CE1 3.42Å; P129-Y131 VanDerWaalsContact CB-CE1 3.42Å; P129-Y131 HydrophobicContact CB-CE2 4.1Å; P129-Y131 VanDerWaalsContact CB-CZ 3.48Å; P129-Y131 HydrophobicContact CG-CE1 4.38Å; P129-Y131 PolarHBondContact O-N 3.01Å; P129-Y131 VanDerWaalsContact O-N 3.11Å
132	A	93.6	Very high	92.5	Very high	52 Å²	52	62.1 Å²	62.1	43%	0.43	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-98.4	-5.1	180	0	0	0	0	0	113.1	P129 I130	P129-A132 PolarHBondContact O-N 3.22Å; I130-A132 VanDerWaalsContact C-N 3.25Å; I130-A132 PolarHBondContact O-N 3.41Å
133	R	93.4	Very high	92.6	Very high	27 Å²	27	61.4 Å²	61.4	10%	0.102	32%	0.322	C	S	.	.	S	Bend	trans	-65.9	151.4	177	-67.1	-178.4	-175.1	-176.5	6.1	111	Q125 L128 P129 I130 E176	Q125-R133 WeakPolarHBondContact O-CD 3.41Å; Q125-R133 WeakPolarHBondContact O-CG 3.5Å; Q125-R133 PolarHBondContact O-NE 3.07Å; L128-R133 HydrophobicContact CB-CG 4.12Å; L128-R133 PolarHBondContact O-NE 3.03Å; P129-R133 PolarHBondContact O-N 3.33Å; I130-R133 PolarHBondContact O-N 3.05Å; R133-E176 WeakPolarHBondContact CD-OE1 3.46Å; R133-E176 IonicContact CZ-OE1 3.81Å; R133-E176 IonicContact NE-OE1 3.83Å; R133-E176 VanDerWaalsContact NH1-CD 3.34Å; R133-E176 IonicContact NH1-OE1 2.99Å; R133-E176 PolarHBondContact NH1-OE1 3.41Å
134	S	94.3	Very high	92.9	Very high	8 Å²	8	56.2 Å²	56.2	6%	0.056	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.5	149.1	-174.8	-62.1	0	0	0	0	112.3	Q125 Y169	Q125-S134 PolarHBondContact NE2-OG 2.91Å; Q125-S134 PolarHBondContact OE1-OG 3.2Å; S134-Y169 VanDerWaalsContact O-CE2 3.23Å; S134-Y169 WeakPolarHBondContact O-CE2 3.01Å; S134-Y169 PolarHBondContact O-OH 3.01Å
135	C	95.7	Very high	93.1	Very high	75 Å²	75	53.9 Å²	53.9	51%	0.507	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-71.6	165.2	164.2	67.5	0	0	0	0	110.3	A137 K138 F139 Y169	C135-A137 VanDerWaalsContact C-N 3.34Å; C135-A137 PolarHBondContact O-N 2.84Å; C135-K138 PolarHBondContact O-N 2.95Å; C135-K138 VanDerWaalsContact O-N 3.14Å; C135-K138 PolarHBondContact SG-N 3.17Å; C135-F139 WeakPolarHBondContact O-CB 3.28Å; C135-F139 PolarHBondContact O-N 2.96Å; C135-Y169 WeakPolarHBondContact CA-OH 3.35Å
136	L	96.5	Very high	93.1	Very high	70 Å²	70	57.7 Å²	57.7	37%	0.366	32%	0.318	S	S	.	.	H	α-helix	trans	-53.6	-49	-178.7	174.9	60.7	0	0	0	112.3	K138 F139 I140 A166 Y169	L136-K138 VanDerWaalsContact C-N 3.33Å; L136-K138 PolarHBondContact O-N 3.08Å; L136-F139 WeakPolarHBondContact O-CB 3.36Å; L136-F139 PolarHBondContact O-N 3.32Å; L136-F139 VanDerWaalsContact O-N 3.17Å; L136-I140 HydrophobicContact CD1-CD1 3.8Å; L136-I140 HydrophobicContact CD1-CG1 4.13Å; L136-I140 HydrophobicContact CG-CD1 3.91Å; L136-I140 WeakPolarHBondContact O-CG1 3.42Å; L136-I140 PolarHBondContact O-N 2.62Å; L136-A166 HydrophobicContact CD1-CB 4.06Å; L136-Y169 HydrophobicContact CB-CD1 3.86Å; L136-Y169 HydrophobicContact CB-CE1 3.72Å; L136-Y169 HydrophobicContact CB-CG 4.32Å; L136-Y169 HydrophobicContact CD1-CD1 3.66Å; L136-Y169 HydrophobicContact CD1-CD2 4.36Å; L136-Y169 HydrophobicContact CD1-CE1 4.4Å; L136-Y169 HydrophobicContact CD1-CG 3.62Å; L136-Y169 HydrophobicContact CG-CD1 4.28Å; L136-Y169 VanDerWaalsContact N-CZ 3.28Å; L136-Y169 PolarHBondContact N-OH 2.85Å
137	A	96.3	Very high	93.1	Very high	72 Å²	72	56.5 Å²	56.5	60%	0.595	32%	0.316	S	S	*	.	H	α-helix	trans	-59.6	-42.9	179.8	0	0	0	0	0	112.2	C135 I140 K141	C135-A137 VanDerWaalsContact C-N 3.34Å; C135-A137 PolarHBondContact O-N 2.84Å; A137-I140 PolarHBondContact O-N 3.09Å; A137-K141 WeakPolarHBondContact O-CB 3.5Å; A137-K141 PolarHBondContact O-N 3.3Å
138	K	94.9	Very high	93.2	Very high	97 Å²	97	52.9 Å²	52.9	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-39.6	176.2	179.2	168.6	174.3	47.5	0	111.8	C135 L136 K141 D142	C135-K138 PolarHBondContact O-N 2.95Å; C135-K138 VanDerWaalsContact O-N 3.14Å; C135-K138 PolarHBondContact SG-N 3.17Å; L136-K138 VanDerWaalsContact C-N 3.33Å; L136-K138 PolarHBondContact O-N 3.08Å; K138-K141 PolarHBondContact O-N 3.49Å; K138-D142 WeakPolarHBondContact CE-OD2 3.36Å; K138-D142 IonicContact NZ-OD1 2.7Å; K138-D142 PolarHBondContact NZ-OD1 3.43Å; K138-D142 IonicContact NZ-OD2 3.25Å; K138-D142 PolarHBondContact NZ-OD2 3.25Å; K138-D142 VanDerWaalsContact O-CB 3.31Å; K138-D142 WeakPolarHBondContact O-CB 3.39Å; K138-D142 PolarHBondContact O-N 2.73Å
139	F	95.2	Very high	93.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.7	-45.1	176.5	-179.9	-96.9	0	0	0	111.5	T120 Q125 C135 L136 D142 N143 L165 T168 Y169	T120-F139 HydrophobicContact CG2-CE1 4.24Å; T120-F139 HydrophobicContact CG2-CE2 4Å; T120-F139 HydrophobicContact CG2-CZ 3.41Å; T120-F139 VanDerWaalsContact CG2-CZ 3.41Å; Q125-F139 HydrophobicContact CG-CD2 4.14Å; Q125-F139 HydrophobicContact CG-CE2 4.23Å; C135-F139 WeakPolarHBondContact O-CB 3.28Å; C135-F139 PolarHBondContact O-N 2.96Å; L136-F139 WeakPolarHBondContact O-CB 3.36Å; L136-F139 PolarHBondContact O-N 3.32Å; L136-F139 VanDerWaalsContact O-N 3.17Å; F139-D142 PolarHBondContact O-N 2.62Å; F139-N143 WeakPolarHBondContact CD2-ND2 3.33Å; F139-N143 VanDerWaalsContact CE2-ND2 3.33Å; F139-N143 WeakPolarHBondContact CE2-ND2 3.48Å; F139-N143 WeakPolarHBondContact CZ-ND2 3.45Å; F139-N143 WeakPolarHBondContact O-CB 3.33Å; F139-N143 PolarHBondContact O-N 2.79Å; F139-N143 PolarHBondContact O-ND2 3.02Å; F139-L165 HydrophobicContact CE1-CB 4.29Å; F139-L165 HydrophobicContact CE1-CD2 4.1Å; F139-L165 WeakPolarHBondContact CE1-O 3.12Å; F139-T168 HydrophobicContact CZ-CG2 4.17Å; F139-Y169 HydrophobicContact CB-CD2 3.66Å; F139-Y169 HydrophobicContact CB-CE2 4.03Å; F139-Y169 AromaticContact CD1-CD2 3.96Å; F139-Y169 HydrophobicContact CD1-CD2 3.96Å; F139-Y169 HydrophobicContact CD1-CG 4.39Å; F139-Y169 HydrophobicContact CD2-CD2 4.23Å; F139-Y169 AromaticContact CG-CD2 3.69Å; F139-Y169 HydrophobicContact CG-CD2 3.69Å; F139-Y169 HydrophobicContact CG-CE2 4.46Å
140	I	95.2	Very high	93.2	Very high	34 Å²	34	58 Å²	58	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-50.1	175.3	-66.4	163.1	0	0	0	109.9	L136 A137 D142 N143 L144 V162 L165	L136-I140 HydrophobicContact CD1-CD1 3.8Å; L136-I140 HydrophobicContact CD1-CG1 4.13Å; L136-I140 HydrophobicContact CG-CD1 3.91Å; L136-I140 WeakPolarHBondContact O-CG1 3.42Å; L136-I140 PolarHBondContact O-N 2.62Å; A137-I140 PolarHBondContact O-N 3.09Å; I140-D142 VanDerWaalsContact C-N 3.3Å; I140-D142 PolarHBondContact O-N 3.27Å; I140-N143 PolarHBondContact O-N 3.42Å; I140-N143 VanDerWaalsContact O-N 3.11Å; I140-L144 WeakPolarHBondContact O-CB 3.5Å; I140-L144 PolarHBondContact O-N 2.85Å; I140-V162 HydrophobicContact CD1-CG1 4.12Å; I140-V162 HydrophobicContact CG2-CG1 4.43Å; I140-V162 HydrophobicContact CG2-CG2 4.36Å; I140-L165 HydrophobicContact CG1-CB 4.27Å; I140-L165 HydrophobicContact CG2-CD1 4.48Å
141	K	93.1	Very high	93.3	Very high	168 Å²	168	59.4 Å²	59.4	73%	0.73	32%	0.318	S	S	*	.	H	α-helix	trans	-60.5	-36.5	-179.8	-176.5	177.7	178.7	176.8	0	113.5	A137 K138 N143	A137-K141 WeakPolarHBondContact O-CB 3.5Å; A137-K141 PolarHBondContact O-N 3.3Å; K138-K141 PolarHBondContact O-N 3.49Å; K141-N143 VanDerWaalsContact C-N 3.29Å
142	D	91.3	Very high	93.4	Very high	41 Å²	41	52.6 Å²	52.6	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-76.1	-17.6	-179.6	-71.8	-5.7	0	0	0	112.3	K138 F139 I140	K138-D142 WeakPolarHBondContact CE-OD2 3.36Å; K138-D142 IonicContact NZ-OD1 2.7Å; K138-D142 PolarHBondContact NZ-OD1 3.43Å; K138-D142 IonicContact NZ-OD2 3.25Å; K138-D142 PolarHBondContact NZ-OD2 3.25Å; K138-D142 VanDerWaalsContact O-CB 3.31Å; K138-D142 WeakPolarHBondContact O-CB 3.39Å; K138-D142 PolarHBondContact O-N 2.73Å; F139-D142 PolarHBondContact O-N 2.62Å; I140-D142 VanDerWaalsContact C-N 3.3Å; I140-D142 PolarHBondContact O-N 3.27Å
143	N	92.6	Very high	93.2	Very high	8 Å²	8	55 Å²	55	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-110.9	-21.6	-176.5	-73.4	-63.3	0	0	0	114.9	K90 T120 N121 F139 I140 K141 L165	K90-N143 WeakPolarHBondContact CE-O 3.43Å; T120-N143 WeakPolarHBondContact CA-OD1 3.39Å; T120-N143 WeakPolarHBondContact CG2-OD1 3.33Å; N121-N143 VanDerWaalsContact CB-OD1 3.28Å; N121-N143 WeakPolarHBondContact CB-OD1 3.39Å; N121-N143 PolarHBondContact N-OD1 3.34Å; F139-N143 WeakPolarHBondContact CD2-ND2 3.33Å; F139-N143 VanDerWaalsContact CE2-ND2 3.33Å; F139-N143 WeakPolarHBondContact CE2-ND2 3.48Å; F139-N143 WeakPolarHBondContact CZ-ND2 3.45Å; F139-N143 WeakPolarHBondContact O-CB 3.33Å; F139-N143 PolarHBondContact O-N 2.79Å; F139-N143 PolarHBondContact O-ND2 3.02Å; I140-N143 PolarHBondContact O-N 3.42Å; I140-N143 VanDerWaalsContact O-N 3.11Å; K141-N143 VanDerWaalsContact C-N 3.29Å; N143-L165 HydrophobicContact CB-CD1 3.95Å; N143-L165 HydrophobicContact CB-CD2 3.72Å
144	L	93.4	Very high	93.2	Very high	16 Å²	16	57.1 Å²	57.1	8%	0.084	32%	0.32	C	S	.	.	S	Bend	trans	-114.5	104.9	176.6	-175.6	66.3	0	0	0	108.9	I140 E148 M149 K161 V162 L165	I140-L144 WeakPolarHBondContact O-CB 3.5Å; I140-L144 PolarHBondContact O-N 2.85Å; L144-E148 HydrophobicContact CD1-CB 4.25Å; L144-M149 HydrophobicContact CD1-CG 4.38Å; L144-M149 HydrophobicContact CD2-CG 4.13Å; L144-M149 HydrophobicContact CD2-SD 3.98Å; L144-M149 HydrophobicContact CG-CG 4.12Å; L144-M149 HydrophobicContact CG-SD 4.38Å; L144-K161 HydrophobicContact CD1-CD 4.26Å; L144-V162 HydrophobicContact CD2-CG2 3.68Å; L144-L165 HydrophobicContact CB-CD1 4.02Å
145	T	92.3	Very high	93.2	Very high	25 Å²	25	62.1 Å²	62.1	15%	0.153	35%	0.345	C	S	.	.			trans	-79.7	151.8	-178.5	66	0	0	0	0	111.5	K90 S147 E148 M149	K90-T145 HydrophobicContact CG-CG2 3.91Å; T145-S147 PolarHBondContact O-N 2.85Å; T145-S147 PolarHBondContact OG1-OG 3.46Å; T145-E148 WeakPolarHBondContact CB-OE1 3.44Å; T145-E148 WeakPolarHBondContact CG2-OE1 3.38Å; T145-E148 PolarHBondContact N-OE1 3.32Å; T145-E148 PolarHBondContact O-N 2.9Å; T145-E148 VanDerWaalsContact O-N 3.12Å; T145-E148 VanDerWaalsContact OG1-CG 3.32Å; T145-E148 WeakPolarHBondContact OG1-CG 3.49Å; T145-E148 PolarHBondContact OG1-N 3.37Å; T145-E148 PolarHBondContact OG1-OE1 3.26Å; T145-M149 PolarHBondContact O-N 3.03Å
146	S	91	Very high	93.2	Very high	80 Å²	80	66 Å²	66	56%	0.559	35%	0.354	S	S	*	.	H	α-helix	trans	-57.2	-36.5	174.5	-54.5	0	0	0	0	112.1	E148 M149 E150	S146-E148 VanDerWaalsContact C-N 3.31Å; S146-E148 PolarHBondContact O-N 3.11Å; S146-M149 PolarHBondContact O-N 3.22Å; S146-E150 WeakPolarHBondContact O-CG 3.41Å; S146-E150 PolarHBondContact O-N 2.94Å
147	S	92.4	Very high	93.1	Very high	25 Å²	25	65.5 Å²	65.5	18%	0.175	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-32.2	177.7	45.6	0	0	0	0	114	H88 T145 E150 T151	H88-S147 WeakPolarHBondContact ND1-CB 3.22Å; H88-S147 PolarHBondContact ND1-OG 3.11Å; H88-S147 PolarHBondContact O-OG 3.42Å; T145-S147 PolarHBondContact O-N 2.85Å; T145-S147 PolarHBondContact OG1-OG 3.46Å; S147-E150 PolarHBondContact O-N 3.44Å; S147-T151 WeakPolarHBondContact O-CB 3.47Å; S147-T151 PolarHBondContact O-N 3.41Å; S147-T151 PolarHBondContact O-OG1 2.71Å
148	E	93.3	Very high	93	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.028	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-39.4	175.3	-76.9	162.5	-113.1	0	0	111.6	H88 K90 L144 T145 S146 E150 T151 T152	H88-E148 HydrophobicContact CB-CG 3.92Å; H88-E148 WeakPolarHBondContact CD2-CG 3.35Å; H88-E148 VanDerWaalsContact CG-CG 3.46Å; K90-E148 VanDerWaalsContact CE-CD 3.42Å; K90-E148 WeakPolarHBondContact CE-OE1 3.22Å; K90-E148 VanDerWaalsContact CE-OE2 3.3Å; K90-E148 WeakPolarHBondContact CE-OE2 3.47Å; K90-E148 IonicContact NZ-OE1 2.87Å; K90-E148 PolarHBondContact NZ-OE1 3.02Å; K90-E148 IonicContact NZ-OE2 3.05Å; K90-E148 PolarHBondContact NZ-OE2 3.35Å; L144-E148 HydrophobicContact CD1-CB 4.25Å; T145-E148 WeakPolarHBondContact CB-OE1 3.44Å; T145-E148 WeakPolarHBondContact CG2-OE1 3.38Å; T145-E148 PolarHBondContact N-OE1 3.32Å; T145-E148 PolarHBondContact O-N 2.9Å; T145-E148 VanDerWaalsContact O-N 3.12Å; T145-E148 VanDerWaalsContact OG1-CG 3.32Å; T145-E148 WeakPolarHBondContact OG1-CG 3.49Å; T145-E148 PolarHBondContact OG1-N 3.37Å; T145-E148 PolarHBondContact OG1-OE1 3.26Å; S146-E148 VanDerWaalsContact C-N 3.31Å; S146-E148 PolarHBondContact O-N 3.11Å; E148-E150 VanDerWaalsContact C-N 3.33Å; E148-T151 PolarHBondContact O-N 2.92Å; E148-T152 PolarHBondContact O-N 2.76Å; E148-T152 PolarHBondContact O-OG1 3.04Å
149	M	92.3	Very high	93.1	Very high	79 Å²	79	63.2 Å²	63.2	39%	0.389	33%	0.333	S	S	.	.	H	α-helix	trans	-68.5	-35.3	177	-61.8	-170.9	-65.7	0	0	111.4	L144 T145 S146 T152 P153	L144-M149 HydrophobicContact CD1-CG 4.38Å; L144-M149 HydrophobicContact CD2-CG 4.13Å; L144-M149 HydrophobicContact CD2-SD 3.98Å; L144-M149 HydrophobicContact CG-CG 4.12Å; L144-M149 HydrophobicContact CG-SD 4.38Å; T145-M149 PolarHBondContact O-N 3.03Å; S146-M149 PolarHBondContact O-N 3.22Å; M149-T152 CarbonylContact O-C 3.58Å; M149-T152 VanDerWaalsContact O-C 3.29Å; M149-T152 VanDerWaalsContact O-O 3.11Å; M149-P153 WeakPolarHBondContact O-CA 3.31Å
150	E	91.6	Very high	93.1	Very high	127 Å²	127	70.5 Å²	70.5	59%	0.593	37%	0.365	S	S	*	.	H	α-helix	trans	-68	-35.7	173.8	-73	174.8	-158.9	0	0	112.5	S146 S147 E148	S146-E150 WeakPolarHBondContact O-CG 3.41Å; S146-E150 PolarHBondContact O-N 2.94Å; S147-E150 PolarHBondContact O-N 3.44Å; E148-E150 VanDerWaalsContact C-N 3.33Å
151	T	92.2	Very high	93	Very high	52 Å²	52	71.5 Å²	71.5	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-76.4	-37.5	-178.6	-56.9	0	0	0	0	111.8	L61 H88 S147 E148 P153	L61-T151 HydrophobicContact CD1-CG2 3.67Å; H88-T151 PolarHBondContact CE1-OG1 3.43Å; H88-T151 VanDerWaalsContact CE1-OG1 3.28Å; S147-T151 WeakPolarHBondContact O-CB 3.47Å; S147-T151 PolarHBondContact O-N 3.41Å; S147-T151 PolarHBondContact O-OG1 2.71Å; E148-T151 PolarHBondContact O-N 2.92Å; T151-P153 VanDerWaalsContact O-CD 3.29Å; T151-P153 WeakPolarHBondContact O-CD 3.23Å
152	T	91	Very high	93.2	Very high	43 Å²	43	66 Å²	66	26%	0.264	35%	0.348	S	S	.	.	S	Bend	trans	-114	81.5	174.2	49.7	0	0	0	0	109.4	E148 M149 D154 N158 K161	E148-T152 PolarHBondContact O-N 2.76Å; E148-T152 PolarHBondContact O-OG1 3.04Å; M149-T152 CarbonylContact O-C 3.58Å; M149-T152 VanDerWaalsContact O-C 3.29Å; M149-T152 VanDerWaalsContact O-O 3.11Å; T152-D154 PolarHBondContact O-N 3.43Å; T152-D154 VanDerWaalsContact O-N 3.12Å; T152-N158 PolarHBondContact O-ND2 2.92Å; T152-N158 PolarHBondContact O-OD1 3.08Å; T152-N158 PolarHBondContact OG1-OD1 3.45Å; T152-K161 PolarHBondContact OG1-NZ 3.49Å
153	P	89.1	Confident	93.5	Very high	103 Å²	103	70.3 Å²	70.3	67%	0.669	37%	0.367	S	S	*	.			trans	-72.6	-4.2	-173.5	30.4	-36.9	0	0	0	113.8	M149 T151 I155	M149-P153 WeakPolarHBondContact O-CA 3.31Å; T151-P153 VanDerWaalsContact O-CD 3.29Å; T151-P153 WeakPolarHBondContact O-CD 3.23Å; P153-I155 PolarHBondContact O-N 3.24Å
154	D	94.5	Very high	93.7	Very high	71 Å²	71	75.2 Å²	75.2	38%	0.38	39%	0.393	S	S	.	.			trans	-63.8	122.2	178.1	175.5	35.7	0	0	0	111.7	T152 F156 T157 N158	T152-D154 PolarHBondContact O-N 3.43Å; T152-D154 VanDerWaalsContact O-N 3.12Å; D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 2.91Å; D154-F156 PolarHBondContact OD1-N 3.34Å; D154-T157 VanDerWaalsContact OD2-CB 3.23Å; D154-T157 WeakPolarHBondContact OD2-CB 3.47Å; D154-T157 PolarHBondContact OD2-N 3.31Å; D154-T157 PolarHBondContact OD2-OG1 2.97Å; D154-N158 WeakPolarHBondContact O-CB 3.42Å; D154-N158 PolarHBondContact O-N 3.36Å; D154-N158 PolarHBondContact O-ND2 3.16Å
155	I	93.7	Very high	93.8	Very high	113 Å²	113	75.2 Å²	75.2	58%	0.579	39%	0.392	S	S	*	.	H	α-helix	trans	-63.2	-42.8	-177.2	-62.2	173.2	0	0	0	110.2	P153 N158 Q159	P153-I155 PolarHBondContact O-N 3.24Å; I155-N158 PolarHBondContact O-N 2.94Å; I155-Q159 HydrophobicContact CG2-CG 4.28Å; I155-Q159 WeakPolarHBondContact O-CB 3.43Å; I155-Q159 VanDerWaalsContact O-CG 3.22Å; I155-Q159 WeakPolarHBondContact O-CG 3.39Å; I155-Q159 PolarHBondContact O-N 3.1Å
156	F	95.4	Very high	94	Very high	156 Å²	156	75.6 Å²	75.6	68%	0.684	40%	0.398	S	S	*	.	H	α-helix	trans	-68.2	-44.8	-176.2	-65.4	-76.5	0	0	0	111.4	D154 N158 Q159 K160	D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 2.91Å; D154-F156 PolarHBondContact OD1-N 3.34Å; F156-N158 VanDerWaalsContact C-N 3.35Å; F156-N158 PolarHBondContact O-N 3.21Å; F156-Q159 PolarHBondContact O-N 3.37Å; F156-K160 PolarHBondContact O-N 3.03Å
157	T	94.5	Very high	94.3	Very high	60 Å²	60	76.5 Å²	76.5	37%	0.368	40%	0.396	S	S	.	.	H	α-helix	trans	-58.6	-46.4	174.5	-64.2	0	0	0	0	111.5	D154 K160 K161	D154-T157 VanDerWaalsContact OD2-CB 3.23Å; D154-T157 WeakPolarHBondContact OD2-CB 3.47Å; D154-T157 PolarHBondContact OD2-N 3.31Å; D154-T157 PolarHBondContact OD2-OG1 2.97Å; T157-K160 PolarHBondContact O-N 3.49Å; T157-K161 WeakPolarHBondContact O-CG 3.32Å; T157-K161 PolarHBondContact O-N 3.49Å
158	N	94.5	Very high	94.4	Very high	23 Å²	23	77 Å²	77	12%	0.123	40%	0.398	C	S	.	.	H	α-helix	trans	-66.4	-39.5	178.6	-73.9	-27.8	0	0	0	112.7	T152 D154 I155 F156 K160 K161 V162	T152-N158 PolarHBondContact O-ND2 2.92Å; T152-N158 PolarHBondContact O-OD1 3.08Å; T152-N158 PolarHBondContact OG1-OD1 3.45Å; D154-N158 WeakPolarHBondContact O-CB 3.42Å; D154-N158 PolarHBondContact O-N 3.36Å; D154-N158 PolarHBondContact O-ND2 3.16Å; I155-N158 PolarHBondContact O-N 2.94Å; F156-N158 VanDerWaalsContact C-N 3.35Å; F156-N158 PolarHBondContact O-N 3.21Å; N158-K160 VanDerWaalsContact C-N 3.34Å; N158-K160 PolarHBondContact O-N 3.26Å; N158-K161 WeakPolarHBondContact O-CB 3.47Å; N158-K161 PolarHBondContact O-N 2.92Å; N158-V162 WeakPolarHBondContact O-CG2 3.42Å; N158-V162 PolarHBondContact O-N 3.14Å
159	Q	95.7	Very high	94.6	Very high	97 Å²	97	78.2 Å²	78.2	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-59.6	-44.4	173.3	-77.3	174.7	-5.5	0	0	111.6	I155 F156 K161 V162 Q163	I155-Q159 HydrophobicContact CG2-CG 4.28Å; I155-Q159 WeakPolarHBondContact O-CB 3.43Å; I155-Q159 VanDerWaalsContact O-CG 3.22Å; I155-Q159 WeakPolarHBondContact O-CG 3.39Å; I155-Q159 PolarHBondContact O-N 3.1Å; F156-Q159 PolarHBondContact O-N 3.37Å; Q159-K161 PolarHBondContact O-N 3.38Å; Q159-V162 PolarHBondContact O-N 3.33Å; Q159-Q163 WeakPolarHBondContact O-CG 3.02Å; Q159-Q163 PolarHBondContact O-N 3.27Å
160	K	95.7	Very high	94.8	Very high	154 Å²	154	80.4 Å²	80.4	67%	0.67	41%	0.41	S	S	*	.	H	α-helix	trans	-61.2	-42.7	176.5	-170.7	179.6	-179.4	-178.7	0	111.8	F156 T157 N158 V162 Q163 L164	F156-K160 PolarHBondContact O-N 3.03Å; T157-K160 PolarHBondContact O-N 3.49Å; N158-K160 VanDerWaalsContact C-N 3.34Å; N158-K160 PolarHBondContact O-N 3.26Å; K160-V162 PolarHBondContact O-N 3.17Å; K160-Q163 PolarHBondContact O-N 2.84Å; K160-L164 PolarHBondContact O-N 2.69Å
161	K	94.3	Very high	95	Very high	55 Å²	55	77.9 Å²	77.9	24%	0.239	40%	0.4	C	S	.	.	H	α-helix	trans	-58.2	-45.9	174.2	-71.3	175.9	178.5	179.9	0	111.4	L144 T152 T157 N158 Q159 L164 L165	L144-K161 HydrophobicContact CD1-CD 4.26Å; T152-K161 PolarHBondContact OG1-NZ 3.49Å; T157-K161 WeakPolarHBondContact O-CG 3.32Å; T157-K161 PolarHBondContact O-N 3.49Å; N158-K161 WeakPolarHBondContact O-CB 3.47Å; N158-K161 PolarHBondContact O-N 2.92Å; Q159-K161 PolarHBondContact O-N 3.38Å; K161-L164 PolarHBondContact O-N 3.48Å; K161-L165 WeakPolarHBondContact O-CG 3.41Å; K161-L165 PolarHBondContact O-N 3.44Å
162	V	95.9	Very high	95.1	Very high	52 Å²	52	75.5 Å²	75.5	32%	0.315	39%	0.386	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.9	173.1	0	0	0	0	111.7	I140 L144 N158 Q159 K160 L164 L165 A166	I140-V162 HydrophobicContact CD1-CG1 4.12Å; I140-V162 HydrophobicContact CG2-CG1 4.43Å; I140-V162 HydrophobicContact CG2-CG2 4.36Å; L144-V162 HydrophobicContact CD2-CG2 3.68Å; N158-V162 WeakPolarHBondContact O-CG2 3.42Å; N158-V162 PolarHBondContact O-N 3.14Å; Q159-V162 PolarHBondContact O-N 3.33Å; K160-V162 PolarHBondContact O-N 3.17Å; V162-L164 PolarHBondContact O-N 3.16Å; V162-L165 PolarHBondContact O-N 3.02Å; V162-A166 WeakPolarHBondContact O-CB 3.23Å; V162-A166 PolarHBondContact O-N 3.05Å
163	Q	97.4	Very high	95.2	Very high	131 Å²	131	76.2 Å²	76.2	61%	0.612	39%	0.385	S	S	*	.	H	α-helix	trans	-61.2	-43.3	176.7	-73.1	173.3	0.3	0	0	111.8	Q159 K160 A166 L167	Q159-Q163 WeakPolarHBondContact O-CG 3.02Å; Q159-Q163 PolarHBondContact O-N 3.27Å; K160-Q163 PolarHBondContact O-N 2.84Å; Q163-A166 PolarHBondContact O-N 3Å; Q163-L167 PolarHBondContact O-N 3.44Å
164	L	96.3	Very high	95.4	Very high	112 Å²	112	75.3 Å²	75.3	59%	0.586	37%	0.374	S	S	*	.	H	α-helix	trans	-60.3	-46.4	175.9	-172.8	114.8	0	0	0	111.3	K160 K161 V162 A166 L167 T168	K160-L164 PolarHBondContact O-N 2.69Å; K161-L164 PolarHBondContact O-N 3.48Å; V162-L164 PolarHBondContact O-N 3.16Å; L164-A166 VanDerWaalsContact C-N 3.32Å; L164-A166 PolarHBondContact O-N 3.1Å; L164-L167 PolarHBondContact O-N 3.07Å; L164-T168 PolarHBondContact O-N 3.04Å; L164-T168 PolarHBondContact O-OG1 3.34Å
165	L	96.2	Very high	95.3	Very high	15 Å²	15	75.2 Å²	75.2	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-62.4	-38.4	176	-71.1	172.9	0	0	0	112.3	T120 F139 I140 N143 L144 K161 V162 L167 T168 Y169	T120-L165 HydrophobicContact CG2-CD2 4.22Å; F139-L165 HydrophobicContact CE1-CB 4.29Å; F139-L165 HydrophobicContact CE1-CD2 4.1Å; F139-L165 WeakPolarHBondContact CE1-O 3.12Å; I140-L165 HydrophobicContact CG1-CB 4.27Å; I140-L165 HydrophobicContact CG2-CD1 4.48Å; N143-L165 HydrophobicContact CB-CD1 3.95Å; N143-L165 HydrophobicContact CB-CD2 3.72Å; L144-L165 HydrophobicContact CB-CD1 4.02Å; K161-L165 WeakPolarHBondContact O-CG 3.41Å; K161-L165 PolarHBondContact O-N 3.44Å; V162-L165 PolarHBondContact O-N 3.02Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L165-T168 PolarHBondContact O-N 3.5Å; L165-Y169 WeakPolarHBondContact O-CB 3.47Å; L165-Y169 PolarHBondContact O-N 3.25Å
166	A	97	Very high	95.1	Very high	33 Å²	33	70 Å²	70	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-38.3	176.1	0	0	0	0	0	112.3	L136 V162 Q163 L164 Y169 K170	L136-A166 HydrophobicContact CD1-CB 4.06Å; V162-A166 WeakPolarHBondContact O-CB 3.23Å; V162-A166 PolarHBondContact O-N 3.05Å; Q163-A166 PolarHBondContact O-N 3Å; L164-A166 VanDerWaalsContact C-N 3.32Å; L164-A166 PolarHBondContact O-N 3.1Å; A166-Y169 WeakPolarHBondContact O-CB 3.41Å; A166-Y169 PolarHBondContact O-N 3Å; A166-K170 PolarHBondContact O-N 3.44Å
167	L	97.1	Very high	94.9	Very high	99 Å²	99	69.9 Å²	69.9	52%	0.518	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-47.3	173.8	-178.3	61.7	0	0	0	111.6	Q163 L164 L165 Y169 K170 N171	Q163-L167 PolarHBondContact O-N 3.44Å; L164-L167 PolarHBondContact O-N 3.07Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L167-Y169 VanDerWaalsContact C-N 3.27Å; L167-Y169 PolarHBondContact O-N 3.32Å; L167-K170 WeakPolarHBondContact O-CB 3.29Å; L167-K170 PolarHBondContact O-N 3.33Å; L167-K170 VanDerWaalsContact O-N 3.1Å; L167-N171 PolarHBondContact O-N 2.98Å
168	T	95.5	Very high	94.7	Very high	35 Å²	35	73.8 Å²	73.8	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-57.2	-42.4	175	-58.5	0	0	0	0	111.3	L122 F139 L164 L165 N171 M172	L122-T168 HydrophobicContact CD1-CG2 4.35Å; L122-T168 HydrophobicContact CD2-CG2 4.38Å; F139-T168 HydrophobicContact CZ-CG2 4.17Å; L164-T168 PolarHBondContact O-N 3.04Å; L164-T168 PolarHBondContact O-OG1 3.34Å; L165-T168 PolarHBondContact O-N 3.5Å; T168-N171 PolarHBondContact O-N 3.13Å; T168-M172 PolarHBondContact O-N 3Å
169	Y	96.4	Very high	94.5	Very high	33 Å²	33	76.9 Å²	76.9	13%	0.129	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-44.2	174.9	-176.2	-93.6	0	0	0	112.5	S134 C135 L136 F139 L165 A166 L167 N171 M172 K173	S134-Y169 VanDerWaalsContact O-CE2 3.23Å; S134-Y169 WeakPolarHBondContact O-CE2 3.01Å; S134-Y169 PolarHBondContact O-OH 3.01Å; C135-Y169 WeakPolarHBondContact CA-OH 3.35Å; L136-Y169 HydrophobicContact CB-CD1 3.86Å; L136-Y169 HydrophobicContact CB-CE1 3.72Å; L136-Y169 HydrophobicContact CB-CG 4.32Å; L136-Y169 HydrophobicContact CD1-CD1 3.66Å; L136-Y169 HydrophobicContact CD1-CD2 4.36Å; L136-Y169 HydrophobicContact CD1-CE1 4.4Å; L136-Y169 HydrophobicContact CD1-CG 3.62Å; L136-Y169 HydrophobicContact CG-CD1 4.28Å; L136-Y169 VanDerWaalsContact N-CZ 3.28Å; L136-Y169 PolarHBondContact N-OH 2.85Å; F139-Y169 HydrophobicContact CB-CD2 3.66Å; F139-Y169 HydrophobicContact CB-CE2 4.03Å; F139-Y169 AromaticContact CD1-CD2 3.96Å; F139-Y169 HydrophobicContact CD1-CD2 3.96Å; F139-Y169 HydrophobicContact CD1-CG 4.39Å; F139-Y169 HydrophobicContact CD2-CD2 4.23Å; F139-Y169 AromaticContact CG-CD2 3.69Å; F139-Y169 HydrophobicContact CG-CD2 3.69Å; F139-Y169 HydrophobicContact CG-CE2 4.46Å; L165-Y169 WeakPolarHBondContact O-CB 3.47Å; L165-Y169 PolarHBondContact O-N 3.25Å; A166-Y169 WeakPolarHBondContact O-CB 3.41Å; A166-Y169 PolarHBondContact O-N 3Å; L167-Y169 VanDerWaalsContact C-N 3.27Å; L167-Y169 PolarHBondContact O-N 3.32Å; Y169-N171 VanDerWaalsContact C-N 3.31Å; Y169-N171 PolarHBondContact O-N 3.22Å; Y169-M172 HydrophobicContact CD2-CE 3.65Å; Y169-M172 HydrophobicContact CE2-CE 3.52Å; Y169-M172 WeakPolarHBondContact O-CB 3.42Å; Y169-M172 PolarHBondContact O-N 2.96Å; Y169-K173 HydrophobicContact CD1-CG 4.18Å; Y169-K173 HydrophobicContact CE1-CD 4.39Å; Y169-K173 HydrophobicContact CE1-CG 3.75Å; Y169-K173 VanDerWaalsContact CZ-CE 3.41Å; Y169-K173 PolarHBondContact O-N 2.93Å; Y169-K173 WeakPolarHBondContact OH-CE 3.14Å
170	K	96.3	Very high	94	Very high	125 Å²	125	75.3 Å²	75.3	54%	0.543	36%	0.363	S	S	.	.	H	α-helix	trans	-58.2	-45	175.8	-177.1	179.9	177.5	179.8	0	110.7	A166 L167 M172 K173 I174	A166-K170 PolarHBondContact O-N 3.44Å; L167-K170 WeakPolarHBondContact O-CB 3.29Å; L167-K170 PolarHBondContact O-N 3.33Å; L167-K170 VanDerWaalsContact O-N 3.1Å; K170-M172 PolarHBondContact O-N 3.28Å; K170-K173 PolarHBondContact O-N 3.29Å; K170-K173 VanDerWaalsContact O-N 3.16Å; K170-I174 HydrophobicContact CG-CD1 4.35Å; K170-I174 WeakPolarHBondContact O-CG1 3.01Å; K170-I174 PolarHBondContact O-N 3.33Å
171	N	95.5	Very high	93.7	Very high	73 Å²	73	71.2 Å²	71.2	39%	0.39	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-42.6	176.8	-70.6	-14.7	0	0	0	112.2	L167 T168 Y169 K173 I174 I175	L167-N171 PolarHBondContact O-N 2.98Å; T168-N171 PolarHBondContact O-N 3.13Å; Y169-N171 VanDerWaalsContact C-N 3.31Å; Y169-N171 PolarHBondContact O-N 3.22Å; N171-K173 VanDerWaalsContact C-N 3.28Å; N171-K173 PolarHBondContact O-N 2.7Å; N171-I174 WeakPolarHBondContact O-CB 3.48Å; N171-I174 PolarHBondContact O-N 2.99Å; N171-I174 VanDerWaalsContact O-N 3.13Å; N171-I175 WeakPolarHBondContact O-CG1 3.47Å; N171-I175 PolarHBondContact O-N 3.39Å
172	M	94.1	Very high	93.2	Very high	2 Å²	2	76 Å²	76	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-56.9	-41.7	173.3	-175.2	-172	71.8	0	0	111.9	L122 Q125 F126 T168 Y169 K170 I175 E176	L122-M172 HydrophobicContact CD1-CB 4.07Å; L122-M172 HydrophobicContact CD1-CG 4.04Å; L122-M172 HydrophobicContact CD1-SD 3.91Å; Q125-M172 HydrophobicContact CB-SD 3.61Å; Q125-M172 HydrophobicContact CG-SD 4.04Å; F126-M172 HydrophobicContact CE1-CG 4.23Å; F126-M172 HydrophobicContact CE2-CG 4.21Å; F126-M172 HydrophobicContact CZ-CB 4.39Å; F126-M172 HydrophobicContact CZ-CG 3.79Å; T168-M172 PolarHBondContact O-N 3Å; Y169-M172 HydrophobicContact CD2-CE 3.65Å; Y169-M172 HydrophobicContact CE2-CE 3.52Å; Y169-M172 WeakPolarHBondContact O-CB 3.42Å; Y169-M172 PolarHBondContact O-N 2.96Å; K170-M172 PolarHBondContact O-N 3.28Å; M172-I175 PolarHBondContact O-N 3.08Å; M172-E176 WeakPolarHBondContact O-CG 3.37Å; M172-E176 PolarHBondContact O-N 2.87Å
173	K	93.4	Very high	92.7	Very high	59 Å²	59	79 Å²	79	26%	0.257	37%	0.374	S	S	.	.	H	α-helix	trans	-68.2	-32	176.4	-67.8	-48.2	-173.4	-168.7	0	114	Y169 K170 N171 E176 R177	Y169-K173 HydrophobicContact CD1-CG 4.18Å; Y169-K173 HydrophobicContact CE1-CD 4.39Å; Y169-K173 HydrophobicContact CE1-CG 3.75Å; Y169-K173 VanDerWaalsContact CZ-CE 3.41Å; Y169-K173 PolarHBondContact O-N 2.93Å; Y169-K173 WeakPolarHBondContact OH-CE 3.14Å; K170-K173 PolarHBondContact O-N 3.29Å; K170-K173 VanDerWaalsContact O-N 3.16Å; N171-K173 VanDerWaalsContact C-N 3.28Å; N171-K173 PolarHBondContact O-N 2.7Å; K173-E176 WeakPolarHBondContact CD-OE2 3.38Å; K173-E176 IonicContact NZ-OE1 3.43Å; K173-E176 PolarHBondContact NZ-OE1 2.99Å; K173-E176 IonicContact NZ-OE2 2.99Å; K173-E176 PolarHBondContact NZ-OE2 3.26Å; K173-R177 PolarHBondContact O-N 3.24Å
174	I	93.5	Very high	92	Very high	83 Å²	83	76.2 Å²	76.2	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-65.6	-47.9	172.4	-67.2	166.1	0	0	0	109.5	K170 N171 E176 R177 M178	K170-I174 HydrophobicContact CG-CD1 4.35Å; K170-I174 WeakPolarHBondContact O-CG1 3.01Å; K170-I174 PolarHBondContact O-N 3.33Å; N171-I174 WeakPolarHBondContact O-CB 3.48Å; N171-I174 PolarHBondContact O-N 2.99Å; N171-I174 VanDerWaalsContact O-N 3.13Å; I174-E176 VanDerWaalsContact C-N 3.35Å; I174-E176 PolarHBondContact O-N 2.63Å; I174-R177 WeakPolarHBondContact O-CB 3.46Å; I174-R177 PolarHBondContact O-N 3.38Å; I174-R177 VanDerWaalsContact O-N 3.09Å; I174-M178 HydrophobicContact CG2-CG 4.5Å; I174-M178 WeakPolarHBondContact O-CG 3.49Å; I174-M178 PolarHBondContact O-N 3.11Å; I174-M178 VanDerWaalsContact O-N 3.08Å
175	I	93	Very high	91.1	Very high	70 Å²	70	80 Å²	80	36%	0.359	37%	0.367	S	S	.	.	H	α-helix	trans	-58.5	-45.8	178.4	-65.4	165.1	0	0	0	111	F126 N171 M172 R177 M178 E179	F126-I175 HydrophobicContact CE1-CB 4.39Å; F126-I175 HydrophobicContact CE1-CG2 3.84Å; F126-I175 HydrophobicContact CZ-CB 4.36Å; F126-I175 HydrophobicContact CZ-CD1 4.01Å; F126-I175 HydrophobicContact CZ-CG2 4.14Å; N171-I175 WeakPolarHBondContact O-CG1 3.47Å; N171-I175 PolarHBondContact O-N 3.39Å; M172-I175 PolarHBondContact O-N 3.08Å; I175-R177 VanDerWaalsContact C-N 3.25Å; I175-R177 PolarHBondContact O-N 3.27Å; I175-M178 PolarHBondContact O-N 3.02Å; I175-E179 HydrophobicContact CG2-CG 4.27Å; I175-E179 WeakPolarHBondContact O-CG 3.45Å; I175-E179 PolarHBondContact O-N 3.39Å
176	E	90.3	Very high	89.9	Confident	4 Å²	4	84.1 Å²	84.1	2%	0.019	40%	0.404	C	S	.	.	H	α-helix	trans	-53.1	-42.3	174.8	-77.3	172.2	-157.9	0	0	113	I130 R133 M172 K173 I174 M178 E180 F184	I130-E176 HydrophobicContact CG2-CG 4.2Å; R133-E176 WeakPolarHBondContact CD-OE1 3.46Å; R133-E176 IonicContact CZ-OE1 3.81Å; R133-E176 IonicContact NE-OE1 3.83Å; R133-E176 VanDerWaalsContact NH1-CD 3.34Å; R133-E176 IonicContact NH1-OE1 2.99Å; R133-E176 PolarHBondContact NH1-OE1 3.41Å; M172-E176 WeakPolarHBondContact O-CG 3.37Å; M172-E176 PolarHBondContact O-N 2.87Å; K173-E176 WeakPolarHBondContact CD-OE2 3.38Å; K173-E176 IonicContact NZ-OE1 3.43Å; K173-E176 PolarHBondContact NZ-OE1 2.99Å; K173-E176 IonicContact NZ-OE2 2.99Å; K173-E176 PolarHBondContact NZ-OE2 3.26Å; I174-E176 VanDerWaalsContact C-N 3.35Å; I174-E176 PolarHBondContact O-N 2.63Å; E176-M178 VanDerWaalsContact C-N 3.33Å; E176-E180 PolarHBondContact O-N 3.09Å; E176-F184 HydrophobicContact CB-CZ 4.27Å; E176-F184 WeakPolarHBondContact O-CE2 3.31Å
177	R	90.2	Very high	88.6	Confident	152 Å²	152	87.1 Å²	87.1	57%	0.574	42%	0.423	S	S	*	.	H	α-helix	trans	-69.1	-33.1	179.2	-171.8	-177.4	-65.4	169.8	-0.7	112.4	K173 I174 I175 P181 F184	K173-R177 PolarHBondContact O-N 3.24Å; I174-R177 WeakPolarHBondContact O-CB 3.46Å; I174-R177 PolarHBondContact O-N 3.38Å; I174-R177 VanDerWaalsContact O-N 3.09Å; I175-R177 VanDerWaalsContact C-N 3.25Å; I175-R177 PolarHBondContact O-N 3.27Å; R177-P181 VanDerWaalsContact O-CA 3.31Å; R177-P181 WeakPolarHBondContact O-CA 3.3Å; R177-F184 HydrophobicContact CB-CD2 4.05Å; R177-F184 HydrophobicContact CB-CE2 4.22Å; R177-F184 HydrophobicContact CB-CG 4.4Å; R177-F184 HydrophobicContact CG-CB 4.04Å; R177-F184 HydrophobicContact CG-CD2 3.9Å; R177-F184 HydrophobicContact CG-CG 3.98Å
178	M	90.9	Very high	87.4	Confident	143 Å²	143	91.5 Å²	91.5	70%	0.704	43%	0.432	S	S	*	.	H	α-helix	trans	-75	-35.4	177.9	-63.9	-59.2	-69.2	0	0	112.2	I174 I175 E176 P181	I174-M178 HydrophobicContact CG2-CG 4.5Å; I174-M178 WeakPolarHBondContact O-CG 3.49Å; I174-M178 PolarHBondContact O-N 3.11Å; I174-M178 VanDerWaalsContact O-N 3.08Å; I175-M178 PolarHBondContact O-N 3.02Å; E176-M178 VanDerWaalsContact C-N 3.33Å; M178-P181 WeakPolarHBondContact O-CD 3.49Å; M178-P181 WeakPolarHBondContact O-CG 3.48Å
179	E	88.9	Confident	86.7	Confident	87 Å²	87	93.3 Å²	93.3	41%	0.407	45%	0.446	S	S	.	.	H	α-helix	trans	-70.1	-42.5	178.1	-72	177.6	164.4	0	0	112.4	I175	I175-E179 HydrophobicContact CG2-CG 4.27Å; I175-E179 WeakPolarHBondContact O-CG 3.45Å; I175-E179 PolarHBondContact O-N 3.39Å
180	E	87	Confident	85.8	Confident	65 Å²	65	98.4 Å²	98.4	30%	0.304	48%	0.475	S	S	.	.			trans	-126.6	69.3	178.7	-59.5	-164	151.4	0	0	113.2	I130 E176 W182 R183 F184	I130-E180 HydrophobicContact CD1-CB 4.43Å; I130-E180 HydrophobicContact CD1-CG 3.96Å; I130-E180 WeakPolarHBondContact CD1-OE2 3.46Å; E176-E180 PolarHBondContact O-N 3.09Å; E180-W182 HydrophobicContact CB-CD2 4.36Å; E180-W182 HydrophobicContact CB-CE3 4.41Å; E180-W182 HydrophobicContact CB-CH2 3.85Å; E180-W182 HydrophobicContact CB-CZ2 3.77Å; E180-W182 HydrophobicContact CB-CZ3 4.16Å; E180-W182 HydrophobicContact CG-CH2 3.58Å; E180-W182 HydrophobicContact CG-CZ2 3.59Å; E180-W182 HydrophobicContact CG-CZ3 4.31Å; E180-W182 PolarHBondContact O-N 3.14Å; E180-W182 VanDerWaalsContact O-N 3.13Å; E180-R183 HydrophobicContact CB-CB 4.24Å; E180-R183 WeakPolarHBondContact O-CB 3.4Å; E180-R183 PolarHBondContact O-N 3.42Å; E180-R183 VanDerWaalsContact O-N 3.1Å; E180-F184 VanDerWaalsContact O-CD2 3.3Å; E180-F184 WeakPolarHBondContact O-CD2 3.34Å
181	P	87.8	Confident	85.2	Confident	67 Å²	67	96 Å²	96	44%	0.435	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-60.5	-31.4	-174.5	-23.7	33.7	0	0	0	113.5	R177 M178 R183 F184 R185	R177-P181 VanDerWaalsContact O-CA 3.31Å; R177-P181 WeakPolarHBondContact O-CA 3.3Å; M178-P181 WeakPolarHBondContact O-CD 3.49Å; M178-P181 WeakPolarHBondContact O-CG 3.48Å; P181-R183 PolarHBondContact O-N 2.94Å; P181-F184 PolarHBondContact O-N 3.02Å; P181-R185 PolarHBondContact O-N 3.11Å
182	W	85.8	Confident	84.6	Confident	156 Å²	156	94.4 Å²	94.4	59%	0.591	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-62.5	-30.4	-179.2	66.1	87.2	0	0	0	112.6	E180 F184	E180-W182 HydrophobicContact CB-CD2 4.36Å; E180-W182 HydrophobicContact CB-CE3 4.41Å; E180-W182 HydrophobicContact CB-CH2 3.85Å; E180-W182 HydrophobicContact CB-CZ2 3.77Å; E180-W182 HydrophobicContact CB-CZ3 4.16Å; E180-W182 HydrophobicContact CG-CH2 3.58Å; E180-W182 HydrophobicContact CG-CZ2 3.59Å; E180-W182 HydrophobicContact CG-CZ3 4.31Å; E180-W182 PolarHBondContact O-N 3.14Å; E180-W182 VanDerWaalsContact O-N 3.13Å; W182-F184 VanDerWaalsContact C-N 3.32Å; W182-F184 PolarHBondContact O-N 3.32Å
183	R	85.3	Confident	83.9	Confident	114 Å²	114	99.9 Å²	99.9	43%	0.43	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-69.5	-29.4	-180	-176.2	172.7	-178.9	-101.6	1.8	112.8	E180 P181	E180-R183 HydrophobicContact CB-CB 4.24Å; E180-R183 WeakPolarHBondContact O-CB 3.4Å; E180-R183 PolarHBondContact O-N 3.42Å; E180-R183 VanDerWaalsContact O-N 3.1Å; P181-R183 PolarHBondContact O-N 2.94Å
184	F	81	Confident	83.3	Confident	74 Å²	74	101.6 Å²	101.6	33%	0.325	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-101.6	7.2	-175.3	-58.7	-84.2	0	0	0	113.5	E176 R177 E180 P181 W182 A186	E176-F184 HydrophobicContact CB-CZ 4.27Å; E176-F184 WeakPolarHBondContact O-CE2 3.31Å; R177-F184 HydrophobicContact CB-CD2 4.05Å; R177-F184 HydrophobicContact CB-CE2 4.22Å; R177-F184 HydrophobicContact CB-CG 4.4Å; R177-F184 HydrophobicContact CG-CB 4.04Å; R177-F184 HydrophobicContact CG-CD2 3.9Å; R177-F184 HydrophobicContact CG-CG 3.98Å; E180-F184 VanDerWaalsContact O-CD2 3.3Å; E180-F184 WeakPolarHBondContact O-CD2 3.34Å; P181-F184 PolarHBondContact O-N 3.02Å; W182-F184 VanDerWaalsContact C-N 3.32Å; W182-F184 PolarHBondContact O-N 3.32Å; F184-A186 PolarHBondContact O-N 3.4Å
185	R	79	Confident	82.5	Confident	190 Å²	190	105 Å²	105	72%	0.717	53%	0.531	S	S	*	.	S	Bend	trans	-58.6	126.8	172.3	-70.3	-178.5	-177.5	178.2	2.4	108.5	P181 S187	P181-R185 PolarHBondContact O-N 3.11Å; R185-S187 PolarHBondContact O-N 3.36Å
186	A	70.9	Confident	81.5	Confident	103 Å²	103	112.6 Å²	112.6	85%	0.851	56%	0.555	S	S	*	*			trans	-57.1	106.9	176.8	0	0	0	0	0	108.7	F184	F184-A186 PolarHBondContact O-N 3.4Å
187	S	69.4	Low	80.4	Confident	96 Å²	96	117.8 Å²	117.8	67%	0.671	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-64	150.3	163.4	-65.6	0	0	0	0	107.4	R185 S189	R185-S187 PolarHBondContact O-N 3.36Å; S187-S189 PolarHBondContact O-N 2.87Å
188	R	72.1	Confident	79.2	Confident	190 Å²	190	116.2 Å²	116.2	72%	0.717	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-47.2	138.4	172.2	-66.3	-176.6	-175.9	-146.9	1	108.4	Q193	R188-Q193 HydrophobicContact CB-CG 3.75Å; R188-Q193 PolarHBondContact O-NE2 3.37Å
189	S	80.6	Confident	77.8	Confident	74 Å²	74	115.6 Å²	115.6	52%	0.517	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-52	147.5	177.7	65	0	0	0	0	109.7	S187 A191 S192 Q193	S187-S189 PolarHBondContact O-N 2.87Å; S189-A191 PolarHBondContact O-N 3.22Å; S189-A191 VanDerWaalsContact O-N 3.1Å; S189-S192 WeakPolarHBondContact O-CA 3.41Å; S189-S192 WeakPolarHBondContact O-CB 3.41Å; S189-S192 PolarHBondContact O-N 3.36Å; S189-S192 WeakPolarHBondContact OG-CB 3.46Å; S189-S192 PolarHBondContact OG-N 3.13Å; S189-S192 VanDerWaalsContact OG-N 3.16Å; S189-Q193 PolarHBondContact O-N 3.22Å
190	L	77.4	Confident	76.4	Confident	140 Å²	140	116.1 Å²	116.1	73%	0.733	62%	0.618	S	S	*	*	H	α-helix	trans	-48.3	-41.3	175.8	-88.2	144.7	0	0	0	111	S192 Q193 C194	L190-S192 PolarHBondContact O-N 3.48Å; L190-Q193 PolarHBondContact O-N 3.24Å; L190-C194 WeakPolarHBondContact O-CB 3.42Å; L190-C194 PolarHBondContact O-N 3.1Å; L190-C194 PolarHBondContact O-SG 3.1Å
191	A	83.6	Confident	74.9	Confident	74 Å²	74	121.6 Å²	121.6	61%	0.612	64%	0.64	S	S	*	*	H	α-helix	trans	-58.4	-43.2	174.1	0	0	0	0	0	113.7	S189 C194 Q195	S189-A191 PolarHBondContact O-N 3.22Å; S189-A191 VanDerWaalsContact O-N 3.1Å; A191-C194 PolarHBondContact O-N 3.29Å; A191-Q195 PolarHBondContact O-N 3.47Å
192	S	82.7	Confident	73.3	Confident	39 Å²	39	123.4 Å²	123.4	27%	0.273	66%	0.655	S	S	.	*	H	α-helix	trans	-70.2	-34.3	176.2	176.3	0	0	0	0	112.5	S189 L190 C194	S189-S192 WeakPolarHBondContact O-CA 3.41Å; S189-S192 WeakPolarHBondContact O-CB 3.41Å; S189-S192 PolarHBondContact O-N 3.36Å; S189-S192 WeakPolarHBondContact OG-CB 3.46Å; S189-S192 PolarHBondContact OG-N 3.13Å; S189-S192 VanDerWaalsContact OG-N 3.16Å; L190-S192 PolarHBondContact O-N 3.48Å; S192-C194 VanDerWaalsContact C-N 3.32Å
193	Q	79.2	Confident	71.5	Confident	117 Å²	117	124.3 Å²	124.3	55%	0.547	67%	0.671	S	S	.	*	H	α-helix	trans	-69.3	-31.3	175.3	-64	-176.9	16.5	0	0	112.2	R188 S189 L190	R188-Q193 HydrophobicContact CB-CG 3.75Å; R188-Q193 PolarHBondContact O-NE2 3.37Å; S189-Q193 PolarHBondContact O-N 3.22Å; L190-Q193 PolarHBondContact O-N 3.24Å
194	C	80.7	Confident	70	Confident	95 Å²	95	127.6 Å²	127.6	64%	0.642	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	2	179.7	-64.9	0	0	0	0	114.4	L190 A191 S192 R196	L190-C194 WeakPolarHBondContact O-CB 3.42Å; L190-C194 PolarHBondContact O-N 3.1Å; L190-C194 PolarHBondContact O-SG 3.1Å; A191-C194 PolarHBondContact O-N 3.29Å; S192-C194 VanDerWaalsContact C-N 3.32Å; C194-R196 PolarHBondContact O-N 3.37Å
195	Q	76.6	Confident	68.3	Low	154 Å²	154	134 Å²	134	72%	0.72	72%	0.716	S	S	*	*			trans	-63.1	106.7	173.9	-74.6	-172.7	-10.5	0	0	109.3	A191 S197	A191-Q195 PolarHBondContact O-N 3.47Å; Q195-S197 PolarHBondContact O-N 3.16Å
196	R	72.4	Confident	66.8	Low	230 Å²	230	130.8 Å²	130.8	87%	0.868	72%	0.72	S	S	*	*			trans	-61.4	123.2	169.2	-68.5	-177	171.2	-178.1	-2.9	107.2	C194 D198	C194-R196 PolarHBondContact O-N 3.37Å; R196-D198 PolarHBondContact O-N 2.91Å
197	S	66.7	Low	65.5	Low	113 Å²	113	137.1 Å²	137.1	79%	0.79	72%	0.722	S	S	*	*			trans	-65.6	107.3	170.7	54.6	0	0	0	0	108.3	Q195 S199	Q195-S197 PolarHBondContact O-N 3.16Å; S197-S199 PolarHBondContact O-N 2.84Å; S197-S199 VanDerWaalsContact O-N 3.09Å
198	D	64.7	Low	64.1	Low	120 Å²	120	139 Å²	139	64%	0.642	73%	0.73	S	S	*	*			trans	-62	111.6	163.9	-71.6	-30.1	0	0	0	107.3	R196 S200	R196-D198 PolarHBondContact O-N 2.91Å; D198-S200 PolarHBondContact O-N 3.33Å
199	S	61.9	Low	62.7	Low	129 Å²	129	138.6 Å²	138.6	90%	0.902	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	6.9	-177.6	49.4	0	0	0	0	114.2	S197	S197-S199 PolarHBondContact O-N 2.84Å; S197-S199 VanDerWaalsContact O-N 3.09Å
200	S	59.8	Low	60.6	Low	98 Å²	98	147 Å²	147	69%	0.685	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	5.1	-168	57.3	0	0	0	0	115.7	D198	D198-S200 PolarHBondContact O-N 3.33Å
201	K	55.1	Low	59	Low	180 Å²	180	145.2 Å²	145.2	78%	0.783	76%	0.761	S	S	*	*			trans	-102.5	103	175.9	-69.1	-175.3	-176.5	173.4	0	111.8
202	S	54.3	Low	56.9	Low	106 Å²	106	145.2 Å²	145.2	74%	0.741	77%	0.769	S	S	*	*			trans	-50.1	141.2	172.9	51.6	0	0	0	0	112.9	K204	S202-K204 PolarHBondContact O-N 2.78Å
203	N	49	Very low	54.7	Low	174 Å²	174	149 Å²	149	93%	0.93	79%	0.791	S	S	*	*			trans	-47.2	98.6	173.8	-85.7	-40.9	0	0	0	112.3
204	K	53.4	Low	52.9	Low	184 Å²	184	152 Å²	152	80%	0.8	81%	0.807	S	S	*	*			trans	-115.3	104.8	154.2	-78.1	-175.8	177.6	179.2	0	107.4	S202 P206	S202-K204 PolarHBondContact O-N 2.78Å; K204-P206 WeakPolarHBondContact O-CD 3.43Å
205	K	45.6	Very low	51	Low	208 Å²	208	153.6 Å²	153.6	90%	0.904	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-51.8	121.5	169.8	-81	176.7	173.1	176.4	0	108.8
206	P	47.9	Very low	49.2	Very low	122 Å²	122	152.1 Å²	152.1	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-74.5	131.1	170.2	-1.8	18.2	0	0	0	108.8	K204	K204-P206 WeakPolarHBondContact O-CD 3.43Å
207	R	43.2	Very low	47.8	Very low	237 Å²	237	145.8 Å²	145.8	89%	0.894	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65.9	133.1	171.7	-155.6	175.7	-177.3	178.5	-0.9	108.1	E209	R207-E209 PolarHBondContact O-N 2.88Å; R207-E209 VanDerWaalsContact O-N 3.16Å
208	T	40.5	Very low	46.5	Very low	136 Å²	136	148.5 Å²	148.5	83%	0.834	80%	0.804	S	S	*	*			trans	-61.2	109.5	-178.8	-36.4	0	0	0	0	110.8
209	E	41.8	Very low	45.3	Very low	180 Å²	180	149 Å²	149	84%	0.841	81%	0.814	S	S	*	*			trans	-117.1	114.2	162.9	-82.8	-178.4	179.8	0	0	109	R207 A211	R207-E209 PolarHBondContact O-N 2.88Å; R207-E209 VanDerWaalsContact O-N 3.16Å; E209-A211 PolarHBondContact O-N 3.16Å
210	R	37.2	Very low	44.5	Very low	251 Å²	251	148.8 Å²	148.8	95%	0.947	80%	0.801	S	S	*	*			trans	-70.3	111	170.2	-72	173.6	169.2	172.6	-4.2	107.8
211	A	43.9	Very low	43.3	Very low	102 Å²	102	150.4 Å²	150.4	84%	0.843	80%	0.802	S	S	*	*			trans	-156.8	134.9	165.3	0	0	0	0	0	110.7	E209	E209-A211 PolarHBondContact O-N 3.16Å
212	G	39.2	Very low	42.5	Very low	75 Å²	75	149.5 Å²	149.5	77%	0.773	80%	0.801	S	S	*	*			trans	109.9	68.7	157.7	0	0	0	0	0	116.7	M214	G212-M214 PolarHBondContact O-N 3.23Å
213	T	36.8	Very low	41.8	Very low	119 Å²	119	149.9 Å²	149.9	73%	0.73	80%	0.799	S	S	*	*			trans	-49.5	120.8	153.1	-56.4	0	0	0	0	110.3	I215	T213-I215 HydrophobicContact CG2-CD1 3.53Å; T213-I215 HydrophobicContact CG2-CG1 3.57Å
214	M	40	Very low	41.3	Very low	179 Å²	179	149.3 Å²	149.3	88%	0.882	80%	0.795	S	S	*	*			trans	-114.2	95.2	159	-89.2	-138.3	-79.4	0	0	108.9	G212	G212-M214 PolarHBondContact O-N 3.23Å
215	I	40.8	Very low	40.5	Very low	128 Å²	128	147.9 Å²	147.9	66%	0.656	79%	0.789	S	S	*	*			trans	-83.9	109.8	163.9	-68.2	159.9	0	0	0	105.6	T213 S217	T213-I215 HydrophobicContact CG2-CD1 3.53Å; T213-I215 HydrophobicContact CG2-CG1 3.57Å; I215-S217 WeakPolarHBondContact CG2-OG 3.43Å
216	C	39.3	Very low	40.1	Very low	124 Å²	124	144.9 Å²	144.9	84%	0.838	78%	0.783	S	S	*	*			trans	-99.9	81.7	160.1	-73.3	0	0	0	0	107
217	S	42.1	Very low	39.5	Very low	96 Å²	96	146 Å²	146	67%	0.671	78%	0.782	S	S	*	*			trans	-102.3	106.5	163.6	-54.5	0	0	0	0	106.2	I215	I215-S217 WeakPolarHBondContact CG2-OG 3.43Å
218	E	40.4	Very low	39.3	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.7	138.8	161.7	-70.3	178.7	167.3	0	0	108	I220	E218-I220 PolarHBondContact O-N 3.44Å
219	P	38.4	Very low	39.2	Very low	129 Å²	129	141.5 Å²	141.5	84%	0.838	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.5	120.6	177.3	27.7	-31.2	0	0	0	108.9	D221	P219-D221 PolarHBondContact O-N 2.94Å
220	I	45.7	Very low	39.2	Very low	126 Å²	126	139.5 Å²	139.5	65%	0.646	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-78	117.6	165.6	-62.4	170.1	0	0	0	105.5	E218 E222 F225	E218-I220 PolarHBondContact O-N 3.44Å; I220-E222 PolarHBondContact O-N 3.21Å; I220-F225 HydrophobicContact CG2-CE2 4.3Å
221	D	35.3	Very low	39.1	Very low	132 Å²	132	132.7 Å²	132.7	71%	0.706	76%	0.755	S	S	*	*			trans	-67.5	99.6	171	-146.6	-1.5	0	0	0	107.7	P219 T223	P219-D221 PolarHBondContact O-N 2.94Å; D221-T223 PolarHBondContact O-N 3.43Å
222	E	38.1	Very low	39	Very low	161 Å²	161	133 Å²	133	75%	0.752	74%	0.742	S	S	*	*			trans	-74	5.6	-172.5	-83.9	-176	159	0	0	113.8	I220 L224	I220-E222 PolarHBondContact O-N 3.21Å; E222-L224 PolarHBondContact O-N 3.4Å
223	T	40.3	Very low	38.9	Very low	114 Å²	114	138 Å²	138	70%	0.699	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	13.9	-168.8	56.8	0	0	0	0	116	D221	D221-T223 PolarHBondContact O-N 3.43Å
224	L	38.1	Very low	39.1	Very low	162 Å²	162	137.3 Å²	137.3	85%	0.848	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	11.8	175.2	-74.8	168.8	0	0	0	114	E222 N226	E222-L224 PolarHBondContact O-N 3.4Å; L224-N226 PolarHBondContact O-N 2.95Å
225	F	37	Very low	39.2	Very low	154 Å²	154	138.8 Å²	138.8	68%	0.675	74%	0.741	S	S	*	*			trans	-92.2	79.4	177.6	-76.4	-87.3	0	0	0	111.1	I220	I220-F225 HydrophobicContact CG2-CE2 4.3Å
226	N	35.5	Very low	39.1	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	75%	0.752	S	S	*	*			trans	-144.8	134.3	150.1	-104.7	-10.6	0	0	0	108.4	L224	L224-N226 PolarHBondContact O-N 2.95Å
227	D	35.6	Very low	39.6	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	75%	0.752	S	S	*	*	S	Bend	trans	87.3	108.8	171.5	-46.7	-27.1	0	0	0	116.3
228	N	40	Very low	39.7	Very low	155 Å²	155	148.7 Å²	148.7	83%	0.829	78%	0.781	S	S	*	*			trans	97.5	56.3	169.7	-51	-27.8	0	0	0	118.1	I230	N228-I230 PolarHBondContact O-N 3.06Å
229	V	38.2	Very low	39.7	Very low	124 Å²	124	147.6 Å²	147.6	75%	0.752	78%	0.78	S	S	*	*			trans	-75.9	96.6	159.8	179.8	0	0	0	0	109.4	T231	V229-T231 PolarHBondContact O-N 3.25Å; V229-T231 VanDerWaalsContact O-N 3.09Å
230	I	42.1	Very low	39.8	Very low	138 Å²	138	148.6 Å²	148.6	71%	0.708	78%	0.777	S	S	*	*			trans	-71.2	101.5	165.6	-59	175.5	0	0	0	107.4	N228 I232	N228-I230 PolarHBondContact O-N 3.06Å; I230-I232 HydrophobicContact CG2-CG1 4.03Å; I230-I232 PolarHBondContact O-N 2.92Å
231	T	33.6	Very low	39.4	Very low	108 Å²	108	149.8 Å²	149.8	66%	0.663	79%	0.785	S	S	*	*			trans	-79.4	100.3	177.3	-57.2	0	0	0	0	109.3	V229 K233	V229-T231 PolarHBondContact O-N 3.25Å; V229-T231 VanDerWaalsContact O-N 3.09Å; T231-K233 HydrophobicContact CG2-CG 4.38Å
232	I	42.7	Very low	39.7	Very low	109 Å²	109	150.9 Å²	150.9	56%	0.559	79%	0.789	S	S	*	*			trans	-93.4	107.3	168.7	-54.1	179.5	0	0	0	107.5	L122 I230	L122-I232 HydrophobicContact CD2-CD1 4.45Å; I230-I232 HydrophobicContact CG2-CG1 4.03Å; I230-I232 PolarHBondContact O-N 2.92Å
233	K	37.1	Very low	39.8	Very low	180 Å²	180	150.3 Å²	150.3	78%	0.783	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.3	132.7	173.3	-69.4	-174.1	178.1	-179	0	109.7	T231	T231-K233 HydrophobicContact CG2-CG 4.38Å
234	P	40.1	Very low	39.7	Very low	103 Å²	103	152.7 Å²	152.7	67%	0.669	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.3	172.9	25.4	-31	0	0	0	110.4	Q236	P234-Q236 PolarHBondContact O-N 3.09Å
235	K	42.7	Very low	39.9	Very low	210 Å²	210	152 Å²	152	91%	0.913	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-58.9	118.1	171.2	-104.1	179.2	174.3	177.9	0	108.7	S237	K235-S237 PolarHBondContact O-N 2.9Å
236	Q	38	Very low	40.1	Very low	193 Å²	193	151.8 Å²	151.8	90%	0.902	80%	0.803	S	S	*	*			trans	-69.8	115.5	163.2	-69.3	-175.8	-25.1	0	0	108	P234	P234-Q236 PolarHBondContact O-N 3.09Å
237	S	50.8	Low	40.5	Very low	118 Å²	118	152.4 Å²	152.4	83%	0.825	81%	0.805	S	S	*	*			trans	-80.1	119.6	163.2	52.7	0	0	0	0	108.5	K235	K235-S237 PolarHBondContact O-N 2.9Å
238	L	44.6	Very low	40.9	Very low	246 Å²	246	153.1 Å²	153.1	100%	1.288	81%	0.808	S	S	*	*			trans	-76.8	0	156	-80.3	161.8	0	0	0	109.6

Retrieved 238 of 238 residues in 325.9 ms (Link to these results)

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