A0A077Z3J1_TRITR Loading...

mTERF domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3J1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 322 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	31.5	Very low	31.4	Very low	242 Å²	242	165.7 Å²	165.7	100%	1.192	88%	0.882	S	S	*	*				0	109.9	0	-74.7	-172.9	-156.6	0	0	108.6
2	L	32.5	Very low	31.7	Very low	181 Å²	181	163.6 Å²	163.6	95%	0.948	87%	0.868	S	S	*	*			trans	171.6	110	142.4	-92.8	161.5	0	0	0	106.2
3	R	31.8	Very low	31.8	Very low	236 Å²	236	158.7 Å²	158.7	89%	0.891	87%	0.865	S	S	*	*			trans	-76.4	127	-174.5	-70.7	175.2	174.7	176	-2.6	109.1	F5	R3-F5 PolarHBondContact O-N 3.48Å
4	G	34.1	Very low	32.1	Very low	84 Å²	84	154.8 Å²	154.8	87%	0.866	84%	0.841	S	S	*	*			trans	-73.9	109.9	170.4	0	0	0	0	0	110.7
5	F	31.4	Very low	32.3	Very low	210 Å²	210	149.1 Å²	149.1	92%	0.921	82%	0.817	S	S	*	*			trans	-83.4	136.1	162	-96.2	-93.9	0	0	0	108.9	R3	R3-F5 PolarHBondContact O-N 3.48Å
6	G	29.3	Very low	32.7	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	81%	0.811	S	S	*	*			trans	177.7	68.1	174.8	0	0	0	0	0	116.6
7	R	30.3	Very low	33	Very low	250 Å²	250	147.5 Å²	147.5	94%	0.943	81%	0.807	S	S	*	*			trans	62.2	81.2	148.8	-60.9	-179.8	172.3	-176.1	-2.5	117.6
8	Q	30.8	Very low	33.4	Very low	192 Å²	192	144.2 Å²	144.2	90%	0.897	79%	0.788	S	S	*	*			trans	-85.2	108.4	150.9	-84	176.8	-16.8	0	0	109.7	A10	Q8-A10 PolarHBondContact O-N 3.35Å
9	S	30.5	Very low	33.7	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	78%	0.776	S	S	*	*			trans	31.9	80.2	136	-44.6	0	0	0	0	117.8	L11	S9-L11 VanDerWaalsContact C-N 3.27Å; S9-L11 PolarHBondContact O-N 3.43Å
10	A	32.9	Very low	33.5	Very low	91 Å²	91	141.6 Å²	141.6	75%	0.752	77%	0.768	S	S	*	*			trans	-73.9	83.9	159	0	0	0	0	0	109.3	Q8 I12	Q8-A10 PolarHBondContact O-N 3.35Å; A10-I12 VanDerWaalsContact C-N 3.33Å; A10-I12 PolarHBondContact O-N 3Å
11	L	30	Very low	33.5	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	77%	0.769	S	S	*	*			trans	-70.1	89.7	165.6	-88	157.6	0	0	0	108.3	S9 A13	S9-L11 VanDerWaalsContact C-N 3.27Å; S9-L11 PolarHBondContact O-N 3.43Å; L11-A13 PolarHBondContact O-N 3.47Å
12	I	35.8	Very low	33.7	Very low	140 Å²	140	138.7 Å²	138.7	72%	0.718	74%	0.74	S	S	*	*			trans	-75.8	106.3	174.8	-61.6	175.6	0	0	0	107.8	A10 I14	A10-I12 VanDerWaalsContact C-N 3.33Å; A10-I12 PolarHBondContact O-N 3Å; I12-I14 HydrophobicContact CG2-CG1 4.29Å; I12-I14 PolarHBondContact O-N 3.45Å; I12-I14 VanDerWaalsContact O-N 3.1Å
13	A	32.8	Very low	33.7	Very low	100 Å²	100	139.2 Å²	139.2	83%	0.826	73%	0.729	S	S	*	*			trans	-66.3	101.8	169.7	0	0	0	0	0	109.4	L11 S15	L11-A13 PolarHBondContact O-N 3.47Å; A13-S15 PolarHBondContact O-N 3.48Å
14	I	35.3	Very low	33.6	Very low	104 Å²	104	135 Å²	135	53%	0.533	72%	0.723	S	S	.	*			trans	-80.9	117.9	176.7	-61.3	174.7	0	0	0	108.1	I12 N18	I12-I14 HydrophobicContact CG2-CG1 4.29Å; I12-I14 PolarHBondContact O-N 3.45Å; I12-I14 VanDerWaalsContact O-N 3.1Å; I14-N18 HydrophobicContact CG2-CB 3.68Å
15	S	36	Very low	33.7	Very low	69 Å²	69	134.7 Å²	134.7	48%	0.483	71%	0.713	S	S	.	*			trans	-65.8	150.4	179.6	78.2	0	0	0	0	112.2	A13 F17 N18	A13-S15 PolarHBondContact O-N 3.48Å; S15-F17 PolarHBondContact O-N 3.47Å; S15-N18 PolarHBondContact O-N 3.29Å
16	S	37.9	Very low	34.1	Very low	102 Å²	102	129.4 Å²	129.4	71%	0.713	70%	0.698	S	S	*	*	H	α-helix	trans	-55.1	-22.8	-176.4	57.4	0	0	0	0	114.3	L19	S16-L19 VanDerWaalsContact O-CB 3.27Å; S16-L19 WeakPolarHBondContact O-CB 3.49Å; S16-L19 PolarHBondContact O-N 3.02Å
17	F	37.8	Very low	34.5	Very low	169 Å²	169	131.7 Å²	131.7	74%	0.741	70%	0.702	S	S	*	*	H	α-helix	trans	-72.6	-33.4	178.8	-153.8	-97.9	0	0	0	112.7	S15 L19 H20	S15-F17 PolarHBondContact O-N 3.47Å; F17-L19 VanDerWaalsContact C-N 3.27Å; F17-L19 PolarHBondContact O-N 3.1Å; F17-H20 PolarHBondContact O-N 3Å
18	N	40	Very low	35.1	Very low	89 Å²	89	125.2 Å²	125.2	48%	0.476	70%	0.695	S	S	.	*	H	α-helix	trans	-72.8	-23.5	172.9	-76.2	-30.7	0	0	0	112.1	I14 S15 H20 L22	I14-N18 HydrophobicContact CG2-CB 3.68Å; S15-N18 PolarHBondContact O-N 3.29Å; N18-H20 VanDerWaalsContact C-N 3.33Å; N18-H20 PolarHBondContact O-N 3.37Å; N18-L22 WeakPolarHBondContact O-CB 3.44Å; N18-L22 WeakPolarHBondContact O-CD1 3.4Å; N18-L22 WeakPolarHBondContact O-CG 3.34Å; N18-L22 PolarHBondContact O-N 3.2Å
19	L	39	Very low	36.1	Very low	107 Å²	107	118.7 Å²	118.7	56%	0.56	67%	0.669	S	S	*	*	H	α-helix	trans	-65.9	-33.6	176	-117.4	134.1	0	0	0	112.4	S16 F17 R23	S16-L19 VanDerWaalsContact O-CB 3.27Å; S16-L19 WeakPolarHBondContact O-CB 3.49Å; S16-L19 PolarHBondContact O-N 3.02Å; F17-L19 VanDerWaalsContact C-N 3.27Å; F17-L19 PolarHBondContact O-N 3.1Å; L19-R23 PolarHBondContact O-N 3.09Å
20	H	31.1	Very low	38	Very low	129 Å²	129	118.1 Å²	118.1	60%	0.597	66%	0.657	S	S	*	*	H	α-helix	trans	-78.9	-34.6	-179.7	-152.8	-21.3	0	0	0	112.8	F17 N18 R23	F17-H20 PolarHBondContact O-N 3Å; N18-H20 VanDerWaalsContact C-N 3.33Å; N18-H20 PolarHBondContact O-N 3.37Å; H20-R23 WeakPolarHBondContact O-CB 3.27Å; H20-R23 PolarHBondContact O-N 3.42Å
21	R	32.4	Very low	40.1	Very low	210 Å²	210	121.2 Å²	121.2	79%	0.792	66%	0.656	S	S	*	*	H	α-helix	trans	-75.7	-30.5	174.9	-117.2	-176.4	166	-174.1	-4.7	112.9	R23 L24	R21-R23 VanDerWaalsContact C-N 3.25Å; R21-R23 PolarHBondContact O-N 3.01Å; R21-L24 PolarHBondContact O-N 3.05Å
22	L	35.9	Very low	42.6	Very low	113 Å²	113	116.8 Å²	116.8	59%	0.592	63%	0.628	S	S	*	*	H	α-helix	trans	-69.3	-22.4	169.2	-81.7	161.6	0	0	0	113	N18 L24	N18-L22 WeakPolarHBondContact O-CB 3.44Å; N18-L22 WeakPolarHBondContact O-CD1 3.4Å; N18-L22 WeakPolarHBondContact O-CG 3.34Å; N18-L22 PolarHBondContact O-N 3.2Å; L22-L24 VanDerWaalsContact C-N 3.28Å; L22-L24 PolarHBondContact O-N 3.25Å
23	R	32.9	Very low	44.6	Very low	192 Å²	192	110.5 Å²	110.5	73%	0.725	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-16.4	176.5	-131.8	177.5	-174.3	166.6	1.1	114.2	L19 H20 R21	L19-R23 PolarHBondContact O-N 3.09Å; H20-R23 WeakPolarHBondContact O-CB 3.27Å; H20-R23 PolarHBondContact O-N 3.42Å; R21-R23 VanDerWaalsContact C-N 3.25Å; R21-R23 PolarHBondContact O-N 3.01Å
24	L	30.3	Very low	46.8	Very low	146 Å²	146	109.6 Å²	109.6	76%	0.764	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-4.2	-177.5	-68.1	171.5	0	0	0	113.8	R21 L22	R21-L24 PolarHBondContact O-N 3.05Å; L22-L24 VanDerWaalsContact C-N 3.28Å; L22-L24 PolarHBondContact O-N 3.25Å
25	A	36.2	Very low	49.1	Very low	79 Å²	79	111.9 Å²	111.9	65%	0.653	58%	0.577	S	S	*	*			trans	-100.6	4.2	178.5	0	0	0	0	0	113.7	C27	A25-C27 VanDerWaalsContact C-N 3.33Å; A25-C27 PolarHBondContact O-N 3.34Å; A25-C27 VanDerWaalsContact O-N 3.09Å
26	T	38.3	Very low	51.4	Low	99 Å²	99	108.8 Å²	108.8	61%	0.607	56%	0.555	S	S	*	*			trans	-85	83.6	173	54.8	0	0	0	0	108.9	S28	T26-S28 PolarHBondContact O-N 3.09Å
27	C	38.8	Very low	53.4	Low	116 Å²	116	104.5 Å²	104.5	78%	0.784	52%	0.523	S	S	*	.			trans	-44.4	109.3	161.9	-175.8	0	0	0	0	109.4	A25 T29	A25-C27 VanDerWaalsContact C-N 3.33Å; A25-C27 PolarHBondContact O-N 3.34Å; A25-C27 VanDerWaalsContact O-N 3.09Å; C27-T29 PolarHBondContact O-N 3.2Å
28	S	41.4	Very low	55.5	Low	113 Å²	113	101.4 Å²	101.4	79%	0.79	51%	0.511	S	S	*	.			trans	21.3	70.6	157.6	-178.2	0	0	0	0	115	T26 D30	T26-S28 PolarHBondContact O-N 3.09Å; S28-D30 PolarHBondContact O-N 2.95Å; S28-D30 VanDerWaalsContact O-N 3.11Å
29	T	53.8	Low	57.6	Low	56 Å²	56	100.9 Å²	100.9	34%	0.344	51%	0.506	S	S	.	.			trans	-66.7	111.5	167.5	43	0	0	0	0	107.1	C27 E31	C27-T29 PolarHBondContact O-N 3.2Å; T29-E31 PolarHBondContact O-N 3.06Å
30	D	69.3	Low	59.7	Low	91 Å²	91	95.8 Å²	95.8	49%	0.487	48%	0.479	S	S	.	.			trans	-48.6	120.6	173.7	-176.2	-13	0	0	0	109	S28 R32 V33 Q34	S28-D30 PolarHBondContact O-N 2.95Å; S28-D30 VanDerWaalsContact O-N 3.11Å; D30-R32 PolarHBondContact O-N 3.27Å; D30-R32 VanDerWaalsContact OD1-CB 3.27Å; D30-R32 WeakPolarHBondContact OD1-CB 3.2Å; D30-R32 PolarHBondContact OD1-N 2.88Å; D30-V33 HydrophobicContact CB-CB 4.34Å; D30-V33 HydrophobicContact CB-CG2 3.92Å; D30-V33 WeakPolarHBondContact O-CB 3.5Å; D30-V33 PolarHBondContact O-N 2.76Å; D30-Q34 PolarHBondContact O-N 2.69Å
31	E	78	Confident	62	Low	157 Å²	157	90.7 Å²	90.7	73%	0.734	46%	0.458	S	S	*	.	H	α-helix	trans	-53.3	-27.7	-179.9	-70.9	-176.5	168.5	0	0	111.3	T29 R35	T29-E31 PolarHBondContact O-N 3.06Å; E31-R35 VanDerWaalsContact O-CG 3.32Å; E31-R35 WeakPolarHBondContact O-CG 3.17Å; E31-R35 PolarHBondContact O-N 3.25Å; E31-R35 VanDerWaalsContact O-N 3.11Å; E31-R35 PolarHBondContact O-NE 3.21Å
32	R	81.2	Confident	64.4	Low	71 Å²	71	86.3 Å²	86.3	27%	0.268	45%	0.451	S	S	.	.	H	α-helix	trans	-63.4	-48.4	172.9	-174.3	-178.7	175.5	-150.9	-4	112	D30 Q34 R35 L36 M71 D73	D30-R32 PolarHBondContact O-N 3.27Å; D30-R32 VanDerWaalsContact OD1-CB 3.27Å; D30-R32 WeakPolarHBondContact OD1-CB 3.2Å; D30-R32 PolarHBondContact OD1-N 2.88Å; R32-Q34 VanDerWaalsContact C-N 3.3Å; R32-Q34 PolarHBondContact O-N 3.44Å; R32-R35 PolarHBondContact O-N 3.31Å; R32-L36 HydrophobicContact CG-CD1 4.14Å; R32-L36 VanDerWaalsContact O-CG 3.31Å; R32-L36 WeakPolarHBondContact O-CG 3.5Å; R32-L36 PolarHBondContact O-N 2.82Å; R32-M71 PolarHBondContact NH2-O 3.34Å; R32-D73 IonicContact CZ-OD1 3.59Å; R32-D73 VanDerWaalsContact CZ-OD1 3.24Å; R32-D73 IonicContact NE-OD1 3.24Å; R32-D73 PolarHBondContact NE-OD1 3.15Å; R32-D73 IonicContact NE-OD2 3.53Å; R32-D73 IonicContact NH2-OD1 2.73Å; R32-D73 PolarHBondContact NH2-OD1 3.11Å
33	V	78.7	Confident	66.5	Low	8 Å²	8	84.8 Å²	84.8	5%	0.048	44%	0.437	C	S	.	.	H	α-helix	trans	-64.4	-38.7	-178.3	174	0	0	0	0	110.9	D30 L36 F37 I63	D30-V33 HydrophobicContact CB-CB 4.34Å; D30-V33 HydrophobicContact CB-CG2 3.92Å; D30-V33 WeakPolarHBondContact O-CB 3.5Å; D30-V33 PolarHBondContact O-N 2.76Å; V33-L36 PolarHBondContact O-N 3.22Å; V33-F37 PolarHBondContact O-N 3.37Å; V33-I63 HydrophobicContact CB-CG2 4.48Å; V33-I63 HydrophobicContact CG1-CB 4.21Å; V33-I63 HydrophobicContact CG1-CG2 3.9Å
34	Q	79.3	Confident	68.8	Low	82 Å²	82	75.7 Å²	75.7	38%	0.383	40%	0.403	S	S	.	.	H	α-helix	trans	-66.3	-45.6	177.2	-171.7	169.3	-17.2	0	0	111.8	D30 R32 L36 F37 E38 L54	D30-Q34 PolarHBondContact O-N 2.69Å; R32-Q34 VanDerWaalsContact C-N 3.3Å; R32-Q34 PolarHBondContact O-N 3.44Å; Q34-L36 PolarHBondContact O-N 3.33Å; Q34-F37 PolarHBondContact O-N 3.03Å; Q34-E38 PolarHBondContact NE2-OE1 3.39Å; Q34-E38 WeakPolarHBondContact O-CG 3.49Å; Q34-E38 PolarHBondContact O-N 2.89Å; Q34-E38 VanDerWaalsContact O-N 3.07Å; Q34-L54 HydrophobicContact CG-CD2 4.21Å
35	R	83	Confident	71.1	Confident	151 Å²	151	71.7 Å²	71.7	57%	0.57	39%	0.39	S	S	*	.	H	α-helix	trans	-59	-45.3	174.5	-75.2	-174.3	-65.6	142	-1.5	112.2	E31 R32 F37 E38 E39	E31-R35 VanDerWaalsContact O-CG 3.32Å; E31-R35 WeakPolarHBondContact O-CG 3.17Å; E31-R35 PolarHBondContact O-N 3.25Å; E31-R35 VanDerWaalsContact O-N 3.11Å; E31-R35 PolarHBondContact O-NE 3.21Å; R32-R35 PolarHBondContact O-N 3.31Å; R35-F37 VanDerWaalsContact C-N 3.33Å; R35-F37 PolarHBondContact O-N 3.44Å; R35-E38 PolarHBondContact O-N 3.18Å; R35-E39 PolarHBondContact O-N 2.93Å; R35-E39 VanDerWaalsContact O-N 3.16Å
36	L	84.4	Confident	73.3	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-59	-44.4	176.9	-75	171.2	0	0	0	111.7	R32 V33 Q34 E39 I40 I63 D73 I76 I77	R32-L36 HydrophobicContact CG-CD1 4.14Å; R32-L36 VanDerWaalsContact O-CG 3.31Å; R32-L36 WeakPolarHBondContact O-CG 3.5Å; R32-L36 PolarHBondContact O-N 2.82Å; V33-L36 PolarHBondContact O-N 3.22Å; Q34-L36 PolarHBondContact O-N 3.33Å; L36-E39 PolarHBondContact O-N 3.47Å; L36-I40 WeakPolarHBondContact O-CB 3.25Å; L36-I40 WeakPolarHBondContact O-CD1 3.46Å; L36-I40 WeakPolarHBondContact O-CG1 3.38Å; L36-I40 PolarHBondContact O-N 3.04Å; L36-I63 HydrophobicContact CB-CG2 3.98Å; L36-I63 HydrophobicContact CD1-CG2 3.93Å; L36-D73 HydrophobicContact CD2-CB 3.69Å; L36-I76 HydrophobicContact CD1-CD1 4.15Å; L36-I76 HydrophobicContact CD1-CG2 4.38Å; L36-I77 HydrophobicContact CD2-CD1 3.88Å; L36-I77 HydrophobicContact CD2-CG1 3.78Å
37	F	80.6	Confident	75.1	Confident	13 Å²	13	73.4 Å²	73.4	6%	0.057	39%	0.392	C	S	.	.	H	α-helix	trans	-65.8	-40.8	179.9	-179.3	-94.7	0	0	0	113	V33 Q34 R35 E39 I40 S41 I51 L54 Q59 I63	V33-F37 PolarHBondContact O-N 3.37Å; Q34-F37 PolarHBondContact O-N 3.03Å; R35-F37 VanDerWaalsContact C-N 3.33Å; R35-F37 PolarHBondContact O-N 3.44Å; F37-E39 VanDerWaalsContact C-N 3.33Å; F37-I40 PolarHBondContact O-N 2.96Å; F37-S41 WeakPolarHBondContact CD1-OG 3.43Å; F37-S41 WeakPolarHBondContact CE1-OG 3.31Å; F37-S41 WeakPolarHBondContact CZ-OG 3.35Å; F37-S41 VanDerWaalsContact O-CB 3.28Å; F37-S41 WeakPolarHBondContact O-CB 3.29Å; F37-S41 PolarHBondContact O-N 3.4Å; F37-S41 PolarHBondContact O-OG 3.4Å; F37-I51 HydrophobicContact CE2-CG2 4.31Å; F37-I51 HydrophobicContact CZ-CG2 4.08Å; F37-L54 HydrophobicContact CB-CD1 3.62Å; F37-L54 HydrophobicContact CB-CD2 3.87Å; F37-L54 HydrophobicContact CB-CG 4.33Å; F37-L54 HydrophobicContact CD1-CB 3.6Å; F37-L54 HydrophobicContact CD1-CD1 3.34Å; F37-L54 HydrophobicContact CD1-CD2 3.57Å; F37-L54 HydrophobicContact CD1-CG 3.63Å; F37-L54 HydrophobicContact CD2-CD1 3.17Å; F37-L54 HydrophobicContact CD2-CG 4.33Å; F37-L54 HydrophobicContact CE1-CB 3.37Å; F37-L54 HydrophobicContact CE1-CD1 3.68Å; F37-L54 HydrophobicContact CE1-CD2 4.29Å; F37-L54 HydrophobicContact CE1-CG 3.91Å; F37-L54 HydrophobicContact CE2-CB 4.5Å; F37-L54 HydrophobicContact CE2-CD1 3.51Å; F37-L54 HydrophobicContact CG-CB 4.26Å; F37-L54 HydrophobicContact CG-CD1 3.04Å; F37-L54 HydrophobicContact CG-CD2 3.81Å; F37-L54 HydrophobicContact CG-CG 3.83Å; F37-L54 HydrophobicContact CZ-CB 3.85Å; F37-L54 HydrophobicContact CZ-CD1 3.73Å; F37-L54 HydrophobicContact CZ-CG 4.34Å; F37-Q59 HydrophobicContact CE2-CB 4.17Å; F37-I63 HydrophobicContact CB-CD1 3.73Å; F37-I63 HydrophobicContact CD2-CD1 3.66Å; F37-I63 HydrophobicContact CG-CD1 4.2Å
38	E	81.6	Confident	76.9	Confident	103 Å²	103	70.9 Å²	70.9	48%	0.481	39%	0.386	S	S	.	.	H	α-helix	trans	-58.6	-47.6	177	-73.4	172.8	-170.7	0	0	110.2	Q34 R35 S41 D42	Q34-E38 PolarHBondContact NE2-OE1 3.39Å; Q34-E38 WeakPolarHBondContact O-CG 3.49Å; Q34-E38 PolarHBondContact O-N 2.89Å; Q34-E38 VanDerWaalsContact O-N 3.07Å; R35-E38 PolarHBondContact O-N 3.18Å; E38-S41 WeakPolarHBondContact O-CB 3.41Å; E38-S41 PolarHBondContact O-N 2.93Å; E38-D42 PolarHBondContact O-N 3.44Å
39	E	84.3	Confident	78.2	Confident	78 Å²	78	70.3 Å²	70.3	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-41.1	178.8	-166.9	176.9	158.4	0	0	113.3	R35 L36 F37 S41 D42 R43 I77	R35-E39 PolarHBondContact O-N 2.93Å; R35-E39 VanDerWaalsContact O-N 3.16Å; L36-E39 PolarHBondContact O-N 3.47Å; F37-E39 VanDerWaalsContact C-N 3.33Å; E39-S41 PolarHBondContact O-N 3.4Å; E39-D42 PolarHBondContact O-N 2.66Å; E39-R43 WeakPolarHBondContact O-CG 3.4Å; E39-R43 PolarHBondContact O-N 2.89Å; E39-R43 IonicContact OE1-CZ 3.95Å; E39-R43 IonicContact OE1-NE 2.83Å; E39-R43 IonicContact OE1-NH2 3.34Å; E39-R43 PolarHBondContact OE1-NH2 3.31Å; E39-I77 HydrophobicContact CB-CD1 4.17Å; E39-I77 HydrophobicContact CB-CG1 4.48Å; E39-I77 HydrophobicContact CG-CD1 4.04Å; E39-I77 HydrophobicContact CG-CG2 4.25Å; E39-I77 VanDerWaalsContact OE2-CD1 3.23Å; E39-I77 WeakPolarHBondContact OE2-CD1 3.24Å
40	I	82.9	Confident	78.6	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-58.3	-41.2	173.4	-72	162.7	0	0	0	110.3	L36 F37 R43 L44 I63 I76 I77 A80 L87	L36-I40 WeakPolarHBondContact O-CB 3.25Å; L36-I40 WeakPolarHBondContact O-CD1 3.46Å; L36-I40 WeakPolarHBondContact O-CG1 3.38Å; L36-I40 PolarHBondContact O-N 3.04Å; F37-I40 PolarHBondContact O-N 2.96Å; I40-R43 PolarHBondContact O-N 3.43Å; I40-L44 HydrophobicContact CG2-CD1 3.78Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 WeakPolarHBondContact O-CG 2.94Å; I40-L44 PolarHBondContact O-N 3.38Å; I40-I63 HydrophobicContact CD1-CD1 3.81Å; I40-I63 HydrophobicContact CD1-CG1 4.13Å; I40-I76 HydrophobicContact CD1-CG2 4.48Å; I40-I77 HydrophobicContact CG1-CB 4.22Å; I40-I77 HydrophobicContact CG1-CG1 4.03Å; I40-I77 HydrophobicContact CG1-CG2 4.17Å; I40-A80 HydrophobicContact CD1-CB 3.64Å; I40-A80 HydrophobicContact CG1-CB 3.96Å; I40-A80 HydrophobicContact CG2-CB 3.91Å; I40-L87 HydrophobicContact CG2-CD1 4.04Å
41	S	78.9	Confident	78.2	Confident	23 Å²	23	72.2 Å²	72.2	16%	0.161	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-44.8	179.7	-61.3	0	0	0	0	112.3	F37 E38 E39 L44 A45	F37-S41 WeakPolarHBondContact CD1-OG 3.43Å; F37-S41 WeakPolarHBondContact CE1-OG 3.31Å; F37-S41 WeakPolarHBondContact CZ-OG 3.35Å; F37-S41 VanDerWaalsContact O-CB 3.28Å; F37-S41 WeakPolarHBondContact O-CB 3.29Å; F37-S41 PolarHBondContact O-N 3.4Å; F37-S41 PolarHBondContact O-OG 3.4Å; E38-S41 WeakPolarHBondContact O-CB 3.41Å; E38-S41 PolarHBondContact O-N 2.93Å; E39-S41 PolarHBondContact O-N 3.4Å; S41-L44 PolarHBondContact O-N 3.23Å; S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.19Å
42	D	81.8	Confident	77.2	Confident	118 Å²	118	69.9 Å²	69.9	63%	0.631	38%	0.375	S	S	*	.	H	α-helix	trans	-63	-42.6	176.4	-71.5	-16.7	0	0	0	111.6	E38 E39 A45 A46	E38-D42 PolarHBondContact O-N 3.44Å; E39-D42 PolarHBondContact O-N 2.66Å; D42-A45 PolarHBondContact O-N 3.36Å; D42-A46 WeakPolarHBondContact O-CB 3.17Å; D42-A46 PolarHBondContact O-N 2.9Å
43	R	81.8	Confident	76.1	Confident	81 Å²	81	71 Å²	71	31%	0.306	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-40	178.1	-71.4	-161.6	-168.6	-174.3	8.8	113.4	E39 I40 A46 K47 I77 D78 A81	E39-R43 WeakPolarHBondContact O-CG 3.4Å; E39-R43 PolarHBondContact O-N 2.89Å; E39-R43 IonicContact OE1-CZ 3.95Å; E39-R43 IonicContact OE1-NE 2.83Å; E39-R43 IonicContact OE1-NH2 3.34Å; E39-R43 PolarHBondContact OE1-NH2 3.31Å; I40-R43 PolarHBondContact O-N 3.43Å; R43-A46 PolarHBondContact O-N 3.28Å; R43-K47 PolarHBondContact O-N 3.16Å; R43-I77 HydrophobicContact CG-CG2 4.37Å; R43-I77 VanDerWaalsContact CZ-CG2 3.41Å; R43-I77 VanDerWaalsContact NE-CG2 3.33Å; R43-D78 IonicContact CZ-OD1 3.67Å; R43-D78 IonicContact NH1-OD1 2.69Å; R43-D78 PolarHBondContact NH1-OD1 3.44Å; R43-A81 HydrophobicContact CB-CB 4.13Å
44	L	79.5	Confident	74.9	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	40%	0.398	C	S	.	.	H	α-helix	trans	-72.2	-36.6	176.9	-80.3	173.8	0	0	0	111.6	I40 S41 A46 K47 G48 H49 I51 A84 L87	I40-L44 HydrophobicContact CG2-CD1 3.78Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 WeakPolarHBondContact O-CG 2.94Å; I40-L44 PolarHBondContact O-N 3.38Å; S41-L44 PolarHBondContact O-N 3.23Å; L44-A46 VanDerWaalsContact C-N 3.32Å; L44-A46 PolarHBondContact O-N 2.94Å; L44-K47 CarbonylContact O-C 3.51Å; L44-K47 WeakPolarHBondContact O-CA 3.35Å; L44-K47 WeakPolarHBondContact O-CB 3.49Å; L44-K47 PolarHBondContact O-N 3.4Å; L44-K47 VanDerWaalsContact O-N 3.08Å; L44-G48 PolarHBondContact O-N 3.22Å; L44-H49 HydrophobicContact CB-CB 4.19Å; L44-H49 HydrophobicContact CD2-CB 4.34Å; L44-H49 WeakPolarHBondContact O-CB 3.44Å; L44-H49 PolarHBondContact O-N 2.99Å; L44-I51 HydrophobicContact CB-CD1 3.63Å; L44-I51 HydrophobicContact CB-CG1 3.97Å; L44-I51 HydrophobicContact CD1-CD1 3.24Å; L44-I51 HydrophobicContact CD1-CG1 3.96Å; L44-I51 HydrophobicContact CG-CD1 4.03Å; L44-A84 HydrophobicContact CD1-CB 4.4Å; L44-A84 HydrophobicContact CD2-CB 4.16Å; L44-L87 HydrophobicContact CD1-CD1 3.8Å
45	A	79.1	Confident	73.8	Confident	61 Å²	61	79.3 Å²	79.3	50%	0.504	42%	0.421	S	S	.	.	H	α-helix	trans	-61.5	-40.6	172.1	0	0	0	0	0	111.5	S41 D42 K47 G48	S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.19Å; D42-A45 PolarHBondContact O-N 3.36Å; A45-K47 PolarHBondContact O-N 3.49Å; A45-G48 PolarHBondContact O-N 3.2Å
46	A	82.4	Confident	72.6	Confident	92 Å²	92	76.8 Å²	76.8	76%	0.76	42%	0.416	S	S	*	.	H	α-helix	trans	-62.3	-27.2	173.7	0	0	0	0	0	113.3	D42 R43 L44 G48	D42-A46 WeakPolarHBondContact O-CB 3.17Å; D42-A46 PolarHBondContact O-N 2.9Å; R43-A46 PolarHBondContact O-N 3.28Å; L44-A46 VanDerWaalsContact C-N 3.32Å; L44-A46 PolarHBondContact O-N 2.94Å; A46-G48 VanDerWaalsContact C-N 3.31Å
47	K	76.9	Confident	71.8	Confident	122 Å²	122	80.4 Å²	80.4	53%	0.53	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	0.8	172.5	-68.5	-178.1	-177.5	-176.9	0	113.7	R43 L44 A45 A81	R43-K47 PolarHBondContact O-N 3.16Å; L44-K47 CarbonylContact O-C 3.51Å; L44-K47 WeakPolarHBondContact O-CA 3.35Å; L44-K47 WeakPolarHBondContact O-CB 3.49Å; L44-K47 PolarHBondContact O-N 3.4Å; L44-K47 VanDerWaalsContact O-N 3.08Å; A45-K47 PolarHBondContact O-N 3.49Å; K47-A81 PolarHBondContact NZ-O 3.26Å
48	G	75.3	Confident	71.2	Confident	64 Å²	64	81.3 Å²	81.3	66%	0.66	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	9.4	-179.3	0	0	0	0	0	114.9	L44 A45 A46	L44-G48 PolarHBondContact O-N 3.22Å; A45-G48 PolarHBondContact O-N 3.2Å; A46-G48 VanDerWaalsContact C-N 3.31Å
49	H	70.4	Confident	70.7	Confident	100 Å²	100	77 Å²	77	46%	0.463	43%	0.429	S	S	.	.			trans	-80.1	132.3	173.9	-65.9	-72.9	0	0	0	110.5	L44	L44-H49 HydrophobicContact CB-CB 4.19Å; L44-H49 HydrophobicContact CD2-CB 4.34Å; L44-H49 WeakPolarHBondContact O-CB 3.44Å; L44-H49 PolarHBondContact O-N 2.99Å
50	T	62	Low	70.2	Confident	146 Å²	146	76 Å²	76	90%	0.896	42%	0.424	S	S	*	.			trans	-88	108.5	170.1	-43.6	0	0	0	0	108.9
51	I	61.2	Low	69.9	Low	41 Å²	41	79.6 Å²	79.6	21%	0.21	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-89.9	135.8	171.4	-45.2	-173.3	0	0	0	109.3	F37 L44 L87	F37-I51 HydrophobicContact CE2-CG2 4.31Å; F37-I51 HydrophobicContact CZ-CG2 4.08Å; L44-I51 HydrophobicContact CB-CD1 3.63Å; L44-I51 HydrophobicContact CB-CG1 3.97Å; L44-I51 HydrophobicContact CD1-CD1 3.24Å; L44-I51 HydrophobicContact CD1-CG1 3.96Å; L44-I51 HydrophobicContact CG-CD1 4.03Å; I51-L87 HydrophobicContact CD1-CD1 4.37Å
52	L	56.5	Low	69.8	Low	108 Å²	108	78.5 Å²	78.5	57%	0.565	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64.3	144.7	166.6	-67.5	169.5	0	0	0	110.4	Q59	L52-Q59 PolarHBondContact O-NE2 3.43Å; L52-Q59 PolarHBondContact O-OE1 3.46Å
53	P	56.7	Low	69.7	Low	96 Å²	96	72.9 Å²	72.9	62%	0.623	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-54.8	146.9	178	19.8	-30.7	0	0	0	111.7	R55	P53-R55 PolarHBondContact O-N 3.16Å
54	L	55.5	Low	69.6	Low	30 Å²	30	71 Å²	71	16%	0.157	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-2.4	-174.1	-166.4	47.3	0	0	0	117.5	Q34 F37 H56 Q60	Q34-L54 HydrophobicContact CG-CD2 4.21Å; F37-L54 HydrophobicContact CB-CD1 3.62Å; F37-L54 HydrophobicContact CB-CD2 3.87Å; F37-L54 HydrophobicContact CB-CG 4.33Å; F37-L54 HydrophobicContact CD1-CB 3.6Å; F37-L54 HydrophobicContact CD1-CD1 3.34Å; F37-L54 HydrophobicContact CD1-CD2 3.57Å; F37-L54 HydrophobicContact CD1-CG 3.63Å; F37-L54 HydrophobicContact CD2-CD1 3.17Å; F37-L54 HydrophobicContact CD2-CG 4.33Å; F37-L54 HydrophobicContact CE1-CB 3.37Å; F37-L54 HydrophobicContact CE1-CD1 3.68Å; F37-L54 HydrophobicContact CE1-CD2 4.29Å; F37-L54 HydrophobicContact CE1-CG 3.91Å; F37-L54 HydrophobicContact CE2-CB 4.5Å; F37-L54 HydrophobicContact CE2-CD1 3.51Å; F37-L54 HydrophobicContact CG-CB 4.26Å; F37-L54 HydrophobicContact CG-CD1 3.04Å; F37-L54 HydrophobicContact CG-CD2 3.81Å; F37-L54 HydrophobicContact CG-CG 3.83Å; F37-L54 HydrophobicContact CZ-CB 3.85Å; F37-L54 HydrophobicContact CZ-CD1 3.73Å; F37-L54 HydrophobicContact CZ-CG 4.34Å; L54-H56 PolarHBondContact O-N 3.26Å; L54-Q60 HydrophobicContact CD1-CG 3.7Å; L54-Q60 HydrophobicContact CG-CG 4.13Å
55	R	54.3	Low	69.5	Low	233 Å²	233	70.9 Å²	70.9	88%	0.879	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-3.1	-177.5	-61.9	-171.9	179.8	-168.6	1	113.9	P53	P53-R55 PolarHBondContact O-N 3.16Å
56	H	59.8	Low	69.5	Low	99 Å²	99	68.1 Å²	68.1	46%	0.458	38%	0.38	S	S	.	.			trans	-82.8	115.9	172.7	-101.4	-83.6	0	0	0	110	L54 C58 Q59	L54-H56 PolarHBondContact O-N 3.26Å; H56-C58 PolarHBondContact O-N 3.26Å; H56-C58 VanDerWaalsContact O-N 3.09Å; H56-Q59 HydrophobicContact CB-CG 4.18Å; H56-Q59 PolarHBondContact O-N 3.27Å
57	S	66.4	Low	69.4	Low	79 Å²	79	64.4 Å²	64.4	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-53.3	-30.6	-179.5	52.3	0	0	0	0	113.5	N61	S57-N61 VanDerWaalsContact O-CB 3.25Å; S57-N61 WeakPolarHBondContact O-CB 3.25Å; S57-N61 PolarHBondContact O-N 3.35Å; S57-N61 PolarHBondContact O-ND2 2.88Å; S57-N61 PolarHBondContact O-OD1 3.02Å
58	C	67.9	Low	69.7	Low	32 Å²	32	64.6 Å²	64.6	22%	0.216	35%	0.353	C	S	.	.	H	α-helix	trans	-62.6	-42.8	176.4	51.1	0	0	0	0	113.1	H56 N61 A62	H56-C58 PolarHBondContact O-N 3.26Å; H56-C58 VanDerWaalsContact O-N 3.09Å; C58-N61 PolarHBondContact O-N 2.89Å; C58-A62 WeakPolarHBondContact O-CB 3.38Å; C58-A62 PolarHBondContact O-N 3.12Å
59	Q	70.6	Confident	69.8	Low	13 Å²	13	64 Å²	64	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-66	-43.7	-177.4	-61.4	175.7	-33.2	0	0	111.5	F37 L52 H56 A62 I63 L87	F37-Q59 HydrophobicContact CE2-CB 4.17Å; L52-Q59 PolarHBondContact O-NE2 3.43Å; L52-Q59 PolarHBondContact O-OE1 3.46Å; H56-Q59 HydrophobicContact CB-CG 4.18Å; H56-Q59 PolarHBondContact O-N 3.27Å; Q59-A62 PolarHBondContact O-N 3.19Å; Q59-I63 WeakPolarHBondContact O-CG1 3.46Å; Q59-I63 PolarHBondContact O-N 3.25Å; Q59-I63 VanDerWaalsContact O-N 3.12Å; Q59-L87 WeakPolarHBondContact CA-O 3.41Å; Q59-L87 HydrophobicContact CG-CB 4.23Å; Q59-L87 VanDerWaalsContact CG-O 3.29Å; Q59-L87 WeakPolarHBondContact CG-O 3.42Å; Q59-L87 PolarHBondContact N-O 2.86Å
60	Q	73.9	Confident	70.1	Confident	56 Å²	56	66.9 Å²	66.9	26%	0.262	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-47	175.6	-67.7	-175.6	-26.2	0	0	110.8	L54 A62 I63 C64	L54-Q60 HydrophobicContact CD1-CG 3.7Å; L54-Q60 HydrophobicContact CG-CG 4.13Å; Q60-A62 VanDerWaalsContact C-N 3.29Å; Q60-A62 PolarHBondContact O-N 3.02Å; Q60-I63 PolarHBondContact O-N 3.4Å; Q60-C64 WeakPolarHBondContact O-CB 3.4Å; Q60-C64 PolarHBondContact O-N 3.28Å; Q60-C64 PolarHBondContact O-SG 3.07Å
61	N	76.8	Confident	70.9	Confident	76 Å²	76	60.2 Å²	60.2	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-62.1	-36.7	-180	-70.8	-10.5	0	0	0	112.4	S57 C58 A65 N91	S57-N61 VanDerWaalsContact O-CB 3.25Å; S57-N61 WeakPolarHBondContact O-CB 3.25Å; S57-N61 PolarHBondContact O-N 3.35Å; S57-N61 PolarHBondContact O-ND2 2.88Å; S57-N61 PolarHBondContact O-OD1 3.02Å; C58-N61 PolarHBondContact O-N 2.89Å; N61-A65 WeakPolarHBondContact O-CB 3.45Å; N61-A65 PolarHBondContact O-N 3.26Å; N61-N91 HydrophobicContact CB-CB 4.28Å
62	A	77.4	Confident	72.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-65.1	-49.6	175.3	0	0	0	0	0	111.5	C58 Q59 Q60 C64 A65 L66 L86 I94	C58-A62 WeakPolarHBondContact O-CB 3.38Å; C58-A62 PolarHBondContact O-N 3.12Å; Q59-A62 PolarHBondContact O-N 3.19Å; Q60-A62 VanDerWaalsContact C-N 3.29Å; Q60-A62 PolarHBondContact O-N 3.02Å; A62-C64 VanDerWaalsContact C-N 3.33Å; A62-C64 PolarHBondContact O-N 3.17Å; A62-A65 WeakPolarHBondContact O-CB 3.27Å; A62-A65 PolarHBondContact O-N 3.48Å; A62-A65 VanDerWaalsContact O-N 3.16Å; A62-L66 WeakPolarHBondContact O-CG 3.36Å; A62-L66 PolarHBondContact O-N 3.49Å; A62-L86 WeakPolarHBondContact CB-O 3.22Å; A62-I94 HydrophobicContact CB-CD1 3.53Å
63	I	78.7	Confident	73.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-41.2	178.4	-65.5	172.1	0	0	0	111	V33 L36 F37 I40 Q59 Q60 A65 L66 A67 L87	V33-I63 HydrophobicContact CB-CG2 4.48Å; V33-I63 HydrophobicContact CG1-CB 4.21Å; V33-I63 HydrophobicContact CG1-CG2 3.9Å; L36-I63 HydrophobicContact CB-CG2 3.98Å; L36-I63 HydrophobicContact CD1-CG2 3.93Å; F37-I63 HydrophobicContact CB-CD1 3.73Å; F37-I63 HydrophobicContact CD2-CD1 3.66Å; F37-I63 HydrophobicContact CG-CD1 4.2Å; I40-I63 HydrophobicContact CD1-CD1 3.81Å; I40-I63 HydrophobicContact CD1-CG1 4.13Å; Q59-I63 WeakPolarHBondContact O-CG1 3.46Å; Q59-I63 PolarHBondContact O-N 3.25Å; Q59-I63 VanDerWaalsContact O-N 3.12Å; Q60-I63 PolarHBondContact O-N 3.4Å; I63-A65 PolarHBondContact O-N 3Å; I63-L66 PolarHBondContact O-N 2.76Å; I63-A67 WeakPolarHBondContact O-CB 3.34Å; I63-A67 PolarHBondContact O-N 3.22Å; I63-L87 HydrophobicContact CD1-CD2 4.31Å; I63-L87 HydrophobicContact CG1-CD2 4.11Å
64	C	79.6	Confident	74.7	Confident	40 Å²	40	58.8 Å²	58.8	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-47.4	172.9	-67.8	0	0	0	0	111.4	Q60 A62 L66 A67 E68	Q60-C64 WeakPolarHBondContact O-CB 3.4Å; Q60-C64 PolarHBondContact O-N 3.28Å; Q60-C64 PolarHBondContact O-SG 3.07Å; A62-C64 VanDerWaalsContact C-N 3.33Å; A62-C64 PolarHBondContact O-N 3.17Å; C64-L66 PolarHBondContact O-N 3.28Å; C64-A67 PolarHBondContact O-N 3.05Å; C64-A67 VanDerWaalsContact O-N 3.16Å; C64-E68 WeakPolarHBondContact O-CG 3.44Å; C64-E68 PolarHBondContact O-N 3.47Å
65	A	77.9	Confident	76.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-38.5	179.1	0	0	0	0	0	112.2	N61 A62 I63 Q69 N91 I94	N61-A65 WeakPolarHBondContact O-CB 3.45Å; N61-A65 PolarHBondContact O-N 3.26Å; A62-A65 WeakPolarHBondContact O-CB 3.27Å; A62-A65 PolarHBondContact O-N 3.48Å; A62-A65 VanDerWaalsContact O-N 3.16Å; I63-A65 PolarHBondContact O-N 3Å; A65-Q69 WeakPolarHBondContact O-CG 3.3Å; A65-Q69 PolarHBondContact O-NE2 3.45Å; A65-Q69 VanDerWaalsContact O-NE2 3.16Å; A65-N91 HydrophobicContact CB-CB 4.25Å; A65-N91 WeakPolarHBondContact CB-ND2 3.31Å; A65-I94 HydrophobicContact CB-CB 4.49Å; A65-I94 HydrophobicContact CB-CD1 4.48Å; A65-I94 HydrophobicContact CB-CG2 4.2Å
66	L	79.5	Confident	77.4	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-72.8	-42	177.2	-63.2	-176.6	0	0	0	112.3	A62 I63 C64 E68 Q69 M71 I76 I94 V112	A62-L66 WeakPolarHBondContact O-CG 3.36Å; A62-L66 PolarHBondContact O-N 3.49Å; I63-L66 PolarHBondContact O-N 2.76Å; C64-L66 PolarHBondContact O-N 3.28Å; L66-E68 PolarHBondContact O-N 3.26Å; L66-Q69 WeakPolarHBondContact O-CB 3.49Å; L66-Q69 PolarHBondContact O-N 3.28Å; L66-M71 HydrophobicContact CB-CE 3.59Å; L66-M71 HydrophobicContact CD2-CE 3.74Å; L66-M71 HydrophobicContact CG-CE 4.15Å; L66-M71 VanDerWaalsContact O-CE 3.31Å; L66-M71 WeakPolarHBondContact O-CE 3.45Å; L66-I76 HydrophobicContact CB-CG1 4.28Å; L66-I76 HydrophobicContact CB-CG2 4.15Å; L66-I76 HydrophobicContact CD1-CG2 4.24Å; L66-I94 HydrophobicContact CD2-CG2 3.92Å; L66-V112 HydrophobicContact CD1-CG1 4.29Å; L66-V112 HydrophobicContact CD2-CB 4.23Å; L66-V112 HydrophobicContact CD2-CG1 3.44Å; L66-V112 VanDerWaalsContact CD2-CG1 3.44Å; L66-V112 HydrophobicContact CD2-CG2 3.74Å
67	A	80	Confident	78.5	Confident	15 Å²	15	45.7 Å²	45.7	12%	0.124	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-30.5	176.8	0	0	0	0	0	112.7	I63 C64 Q69 I76	I63-A67 WeakPolarHBondContact O-CB 3.34Å; I63-A67 PolarHBondContact O-N 3.22Å; C64-A67 PolarHBondContact O-N 3.05Å; C64-A67 VanDerWaalsContact O-N 3.16Å; A67-Q69 VanDerWaalsContact C-N 3.26Å; A67-Q69 PolarHBondContact O-N 2.9Å; A67-I76 HydrophobicContact CB-CD1 4.17Å
68	E	82.6	Confident	79.3	Confident	125 Å²	125	45.3 Å²	45.3	58%	0.584	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.5	173.9	-72.7	173.3	-179.1	0	0	113.5	C64 L66 N70	C64-E68 WeakPolarHBondContact O-CG 3.44Å; C64-E68 PolarHBondContact O-N 3.47Å; L66-E68 PolarHBondContact O-N 3.26Å; E68-N70 PolarHBondContact O-N 3.37Å
69	Q	78.4	Confident	79.9	Confident	53 Å²	53	43.8 Å²	43.8	25%	0.248	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	13.7	179.4	-54.8	-51.8	-56.9	0	0	114.3	A65 L66 A67 M71 I98	A65-Q69 WeakPolarHBondContact O-CG 3.3Å; A65-Q69 PolarHBondContact O-NE2 3.45Å; A65-Q69 VanDerWaalsContact O-NE2 3.16Å; L66-Q69 WeakPolarHBondContact O-CB 3.49Å; L66-Q69 PolarHBondContact O-N 3.28Å; A67-Q69 VanDerWaalsContact C-N 3.26Å; A67-Q69 PolarHBondContact O-N 2.9Å; Q69-M71 HydrophobicContact CB-CE 4.13Å; Q69-M71 HydrophobicContact CB-CG 4.12Å; Q69-M71 HydrophobicContact CG-CE 4.45Å; Q69-M71 PolarHBondContact O-N 3.14Å; Q69-I98 HydrophobicContact CG-CD1 3.8Å
70	N	76.2	Confident	80.3	Confident	159 Å²	159	43.1 Å²	43.1	85%	0.85	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	25.5	-174.7	-59.3	-53.9	0	0	0	114.4	E68	E68-N70 PolarHBondContact O-N 3.37Å
71	M	79.1	Confident	80.6	Confident	7 Å²	7	40.8 Å²	40.8	3%	0.034	22%	0.219	C	C	.	.			trans	-77.8	150.7	174.2	-64.7	-171.4	-65.6	0	0	110.6	R32 L66 Q69 E75 I76 I79 A109	R32-M71 PolarHBondContact NH2-O 3.34Å; L66-M71 HydrophobicContact CB-CE 3.59Å; L66-M71 HydrophobicContact CD2-CE 3.74Å; L66-M71 HydrophobicContact CG-CE 4.15Å; L66-M71 VanDerWaalsContact O-CE 3.31Å; L66-M71 WeakPolarHBondContact O-CE 3.45Å; Q69-M71 HydrophobicContact CB-CE 4.13Å; Q69-M71 HydrophobicContact CB-CG 4.12Å; Q69-M71 HydrophobicContact CG-CE 4.45Å; Q69-M71 PolarHBondContact O-N 3.14Å; M71-E75 HydrophobicContact CB-CB 4.31Å; M71-I76 HydrophobicContact CB-CD1 4.3Å; M71-I76 HydrophobicContact CB-CG1 3.81Å; M71-I76 HydrophobicContact CE-CG1 4.08Å; M71-I79 HydrophobicContact CE-CD1 4.03Å; M71-I79 HydrophobicContact SD-CD1 3.45Å; M71-I79 WeakPolarHBondContact SD-CD1 3.31Å; M71-A109 HydrophobicContact SD-CB 4.41Å
72	S	85.6	Confident	80.6	Confident	53 Å²	53	40.8 Å²	40.8	37%	0.371	23%	0.225	S	C	.	.			trans	-68.3	157.5	173.1	77.9	0	0	0	0	110.7	D74 E75 I76	S72-D74 VanDerWaalsContact C-N 3.28Å; S72-D74 PolarHBondContact O-N 3.44Å; S72-E75 PolarHBondContact N-OE2 3.14Å; S72-E75 VanDerWaalsContact N-OE2 3.14Å; S72-E75 PolarHBondContact O-N 3.44Å; S72-E75 WeakPolarHBondContact OG-CB 3.09Å; S72-E75 VanDerWaalsContact OG-CG 3.28Å; S72-E75 WeakPolarHBondContact OG-CG 3.45Å; S72-E75 PolarHBondContact OG-N 2.91Å; S72-E75 VanDerWaalsContact OG-N 3.08Å; S72-I76 WeakPolarHBondContact O-CG1 3.44Å; S72-I76 PolarHBondContact O-N 2.9Å
73	D	84.9	Confident	80.5	Confident	56 Å²	56	41.9 Å²	41.9	30%	0.299	23%	0.231	S	C	.	.	H	α-helix	trans	-58.9	-43.8	177.6	-71.7	-2.3	0	0	0	110.5	R32 L36 E75 I76 I77	R32-D73 IonicContact CZ-OD1 3.59Å; R32-D73 VanDerWaalsContact CZ-OD1 3.24Å; R32-D73 IonicContact NE-OD1 3.24Å; R32-D73 PolarHBondContact NE-OD1 3.15Å; R32-D73 IonicContact NE-OD2 3.53Å; R32-D73 IonicContact NH2-OD1 2.73Å; R32-D73 PolarHBondContact NH2-OD1 3.11Å; L36-D73 HydrophobicContact CD2-CB 3.69Å; D73-E75 VanDerWaalsContact C-N 3.35Å; D73-E75 PolarHBondContact O-N 2.95Å; D73-I76 PolarHBondContact O-N 3.4Å; D73-I77 VanDerWaalsContact O-CD1 3.29Å; D73-I77 WeakPolarHBondContact O-CD1 3.34Å; D73-I77 VanDerWaalsContact O-CG1 3.22Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.48Å
74	D	84.4	Confident	80.4	Confident	105 Å²	105	43.4 Å²	43.4	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-58.8	-42	175.2	-67.6	-43.2	0	0	0	112.8	S72 I77 D78	S72-D74 VanDerWaalsContact C-N 3.28Å; S72-D74 PolarHBondContact O-N 3.44Å; D74-I77 PolarHBondContact O-N 3.4Å; D74-D78 WeakPolarHBondContact O-CB 3.47Å; D74-D78 PolarHBondContact O-N 2.92Å
75	E	83.8	Confident	80.2	Confident	87 Å²	87	47.9 Å²	47.9	41%	0.407	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-44.5	177.5	-78.4	177.3	154.1	0	0	111.5	M71 S72 D73 I77 D78 I79	M71-E75 HydrophobicContact CB-CB 4.31Å; S72-E75 PolarHBondContact N-OE2 3.14Å; S72-E75 VanDerWaalsContact N-OE2 3.14Å; S72-E75 PolarHBondContact O-N 3.44Å; S72-E75 WeakPolarHBondContact OG-CB 3.09Å; S72-E75 VanDerWaalsContact OG-CG 3.28Å; S72-E75 WeakPolarHBondContact OG-CG 3.45Å; S72-E75 PolarHBondContact OG-N 2.91Å; S72-E75 VanDerWaalsContact OG-N 3.08Å; D73-E75 VanDerWaalsContact C-N 3.35Å; D73-E75 PolarHBondContact O-N 2.95Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.46Å; E75-D78 PolarHBondContact O-N 3.11Å; E75-I79 WeakPolarHBondContact O-CB 3.32Å; E75-I79 VanDerWaalsContact O-CD1 3.26Å; E75-I79 WeakPolarHBondContact O-CD1 3.33Å; E75-I79 WeakPolarHBondContact O-CG1 3.5Å; E75-I79 PolarHBondContact O-N 3.25Å
76	I	82.4	Confident	80.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-46.3	178	-65.2	164.1	0	0	0	109.9	L36 I40 L66 A67 M71 S72 D73 I79 A80	L36-I76 HydrophobicContact CD1-CD1 4.15Å; L36-I76 HydrophobicContact CD1-CG2 4.38Å; I40-I76 HydrophobicContact CD1-CG2 4.48Å; L66-I76 HydrophobicContact CB-CG1 4.28Å; L66-I76 HydrophobicContact CB-CG2 4.15Å; L66-I76 HydrophobicContact CD1-CG2 4.24Å; A67-I76 HydrophobicContact CB-CD1 4.17Å; M71-I76 HydrophobicContact CB-CD1 4.3Å; M71-I76 HydrophobicContact CB-CG1 3.81Å; M71-I76 HydrophobicContact CE-CG1 4.08Å; S72-I76 WeakPolarHBondContact O-CG1 3.44Å; S72-I76 PolarHBondContact O-N 2.9Å; D73-I76 PolarHBondContact O-N 3.4Å; I76-I79 PolarHBondContact O-N 3.22Å; I76-A80 WeakPolarHBondContact O-CB 3.36Å; I76-A80 PolarHBondContact O-N 2.91Å
77	I	83.3	Confident	80	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-47.3	179.3	-66.3	156.2	0	0	0	110.4	L36 E39 I40 R43 D73 D74 E75 I79 A80 A81	L36-I77 HydrophobicContact CD2-CD1 3.88Å; L36-I77 HydrophobicContact CD2-CG1 3.78Å; E39-I77 HydrophobicContact CB-CD1 4.17Å; E39-I77 HydrophobicContact CB-CG1 4.48Å; E39-I77 HydrophobicContact CG-CD1 4.04Å; E39-I77 HydrophobicContact CG-CG2 4.25Å; E39-I77 VanDerWaalsContact OE2-CD1 3.23Å; E39-I77 WeakPolarHBondContact OE2-CD1 3.24Å; I40-I77 HydrophobicContact CG1-CB 4.22Å; I40-I77 HydrophobicContact CG1-CG1 4.03Å; I40-I77 HydrophobicContact CG1-CG2 4.17Å; R43-I77 HydrophobicContact CG-CG2 4.37Å; R43-I77 VanDerWaalsContact CZ-CG2 3.41Å; R43-I77 VanDerWaalsContact NE-CG2 3.33Å; D73-I77 VanDerWaalsContact O-CD1 3.29Å; D73-I77 WeakPolarHBondContact O-CD1 3.34Å; D73-I77 VanDerWaalsContact O-CG1 3.22Å; D73-I77 WeakPolarHBondContact O-CG1 3.49Å; D73-I77 PolarHBondContact O-N 3.48Å; D74-I77 PolarHBondContact O-N 3.4Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.46Å; I77-I79 VanDerWaalsContact C-N 3.34Å; I77-I79 PolarHBondContact O-N 3.41Å; I77-A80 PolarHBondContact O-N 2.92Å; I77-A81 WeakPolarHBondContact O-CB 3.28Å; I77-A81 PolarHBondContact O-N 3.02Å
78	D	83	Confident	79.8	Confident	70 Å²	70	54.6 Å²	54.6	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-41.9	177.7	-94.3	6.5	0	0	0	112.4	R43 D74 E75 S82	R43-D78 IonicContact CZ-OD1 3.67Å; R43-D78 IonicContact NH1-OD1 2.69Å; R43-D78 PolarHBondContact NH1-OD1 3.44Å; D74-D78 WeakPolarHBondContact O-CB 3.47Å; D74-D78 PolarHBondContact O-N 2.92Å; E75-D78 PolarHBondContact O-N 3.11Å; D78-S82 VanDerWaalsContact O-CB 3.26Å; D78-S82 WeakPolarHBondContact O-CB 3.45Å; D78-S82 PolarHBondContact O-N 3.24Å; D78-S82 PolarHBondContact O-OG 2.97Å
79	I	80.3	Confident	79.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-52.1	179.6	-68.9	162	0	0	0	110.4	M71 E75 I76 I77 A81 S82 N83 L86 A109 V112 R113	M71-I79 HydrophobicContact CE-CD1 4.03Å; M71-I79 HydrophobicContact SD-CD1 3.45Å; M71-I79 WeakPolarHBondContact SD-CD1 3.31Å; E75-I79 WeakPolarHBondContact O-CB 3.32Å; E75-I79 VanDerWaalsContact O-CD1 3.26Å; E75-I79 WeakPolarHBondContact O-CD1 3.33Å; E75-I79 WeakPolarHBondContact O-CG1 3.5Å; E75-I79 PolarHBondContact O-N 3.25Å; I76-I79 PolarHBondContact O-N 3.22Å; I77-I79 VanDerWaalsContact C-N 3.34Å; I77-I79 PolarHBondContact O-N 3.41Å; I79-A81 VanDerWaalsContact C-N 3.33Å; I79-A81 PolarHBondContact O-N 3.43Å; I79-S82 PolarHBondContact O-N 3.09Å; I79-S82 VanDerWaalsContact O-N 3.09Å; I79-N83 PolarHBondContact O-N 3.33Å; I79-N83 VanDerWaalsContact O-N 3.13Å; I79-L86 HydrophobicContact CG2-CD1 3.7Å; I79-A109 HydrophobicContact CD1-CB 3.88Å; I79-V112 HydrophobicContact CG2-CB 3.93Å; I79-V112 HydrophobicContact CG2-CG1 3.31Å; I79-R113 HydrophobicContact CB-CG 4.23Å; I79-R113 HydrophobicContact CG1-CG 3.9Å; I79-R113 HydrophobicContact CG2-CG 3.98Å
80	A	79.2	Confident	79.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-35.7	-179.4	0	0	0	0	0	112.3	I40 I76 I77 S82 N83 L87	I40-A80 HydrophobicContact CD1-CB 3.64Å; I40-A80 HydrophobicContact CG1-CB 3.96Å; I40-A80 HydrophobicContact CG2-CB 3.91Å; I76-A80 WeakPolarHBondContact O-CB 3.36Å; I76-A80 PolarHBondContact O-N 2.91Å; I77-A80 PolarHBondContact O-N 2.92Å; A80-S82 VanDerWaalsContact C-N 3.27Å; A80-S82 PolarHBondContact O-N 3.16Å; A80-N83 CarbonylContact O-C 3.52Å; A80-L87 HydrophobicContact CB-CD2 4.3Å
81	A	79.2	Confident	79.3	Confident	6 Å²	6	45.1 Å²	45.1	5%	0.05	25%	0.246	C	C	.	.	H	α-helix	trans	-73.6	-17.3	174.9	0	0	0	0	0	113.4	R43 K47 I77 I79	R43-A81 HydrophobicContact CB-CB 4.13Å; K47-A81 PolarHBondContact NZ-O 3.26Å; I77-A81 WeakPolarHBondContact O-CB 3.28Å; I77-A81 PolarHBondContact O-N 3.02Å; I79-A81 VanDerWaalsContact C-N 3.33Å; I79-A81 PolarHBondContact O-N 3.43Å
82	S	77.2	Confident	79.3	Confident	76 Å²	76	52 Å²	52	53%	0.531	28%	0.279	S	S	.	.	H	α-helix	trans	-88.6	-28.7	177	-62.7	0	0	0	0	112.8	D78 I79 A80	D78-S82 VanDerWaalsContact O-CB 3.26Å; D78-S82 WeakPolarHBondContact O-CB 3.45Å; D78-S82 PolarHBondContact O-N 3.24Å; D78-S82 PolarHBondContact O-OG 2.97Å; I79-S82 PolarHBondContact O-N 3.09Å; I79-S82 VanDerWaalsContact O-N 3.09Å; A80-S82 VanDerWaalsContact C-N 3.27Å; A80-S82 PolarHBondContact O-N 3.16Å
83	N	76.2	Confident	78.8	Confident	24 Å²	24	53.8 Å²	53.8	13%	0.128	28%	0.281	C	S	.	.			trans	-136.9	96.2	176.9	-178.7	-1.9	0	0	0	109.9	I79 A80 E85 L86 R113 T115	I79-N83 PolarHBondContact O-N 3.33Å; I79-N83 VanDerWaalsContact O-N 3.13Å; A80-N83 CarbonylContact O-C 3.52Å; N83-E85 PolarHBondContact O-N 2.98Å; N83-E85 VanDerWaalsContact OD1-CB 3.3Å; N83-E85 WeakPolarHBondContact OD1-CB 3.31Å; N83-E85 PolarHBondContact OD1-N 3.37Å; N83-L86 HydrophobicContact CB-CD1 3.82Å; N83-L86 HydrophobicContact CB-CG 4.23Å; N83-L86 VanDerWaalsContact O-CB 3.31Å; N83-L86 WeakPolarHBondContact O-CB 3.48Å; N83-L86 PolarHBondContact O-N 3.22Å; N83-R113 PolarHBondContact ND2-O 3.39Å; N83-T115 PolarHBondContact ND2-OG1 3.35Å; N83-T115 VanDerWaalsContact ND2-OG1 3.13Å
84	A	76.3	Confident	78.5	Confident	33 Å²	33	51.1 Å²	51.1	27%	0.273	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-67.9	-18.7	-179.7	0	0	0	0	0	113.2	L44 L86 L87	L44-A84 HydrophobicContact CD1-CB 4.4Å; L44-A84 HydrophobicContact CD2-CB 4.16Å; A84-L86 PolarHBondContact O-N 3.34Å; A84-L87 PolarHBondContact O-N 3.27Å
85	E	75.6	Confident	78.3	Confident	133 Å²	133	48.1 Å²	48.1	62%	0.621	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-67.3	-27.2	177.3	-56.6	-175.2	168.4	0	0	111.4	N83 L87 Q88 M89	N83-E85 PolarHBondContact O-N 2.98Å; N83-E85 VanDerWaalsContact OD1-CB 3.3Å; N83-E85 WeakPolarHBondContact OD1-CB 3.31Å; N83-E85 PolarHBondContact OD1-N 3.37Å; E85-L87 PolarHBondContact O-N 2.88Å; E85-Q88 WeakPolarHBondContact O-CB 3.47Å; E85-Q88 PolarHBondContact O-N 3.27Å; E85-M89 PolarHBondContact O-N 3.05Å
86	L	76.2	Confident	78.2	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-53.4	-36.4	172.4	-81.1	162.2	0	0	0	113.1	A62 I79 N83 A84 Q88 M89 I94 V112 T115	A62-L86 WeakPolarHBondContact CB-O 3.22Å; I79-L86 HydrophobicContact CG2-CD1 3.7Å; N83-L86 HydrophobicContact CB-CD1 3.82Å; N83-L86 HydrophobicContact CB-CG 4.23Å; N83-L86 VanDerWaalsContact O-CB 3.31Å; N83-L86 WeakPolarHBondContact O-CB 3.48Å; N83-L86 PolarHBondContact O-N 3.22Å; A84-L86 PolarHBondContact O-N 3.34Å; L86-Q88 PolarHBondContact O-N 3.05Å; L86-M89 HydrophobicContact CD2-SD 4.13Å; L86-M89 PolarHBondContact O-N 3.04Å; L86-I94 HydrophobicContact CD2-CG1 4.37Å; L86-V112 HydrophobicContact CD1-CG1 3.56Å; L86-V112 HydrophobicContact CD2-CG1 3.41Å; L86-V112 VanDerWaalsContact CD2-CG1 3.41Å; L86-V112 HydrophobicContact CG-CG1 4.14Å; L86-T115 HydrophobicContact CD2-CG2 3.88Å; L86-T115 WeakPolarHBondContact CD2-OG1 3.35Å; L86-T115 WeakPolarHBondContact CG-OG1 3.48Å
87	L	75.3	Confident	78	Confident	5 Å²	5	47 Å²	47	3%	0.026	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-71.7	-12.3	-178.9	-62.5	178.6	0	0	0	112.5	I40 L44 I51 Q59 I63 A80 A84 E85	I40-L87 HydrophobicContact CG2-CD1 4.04Å; L44-L87 HydrophobicContact CD1-CD1 3.8Å; I51-L87 HydrophobicContact CD1-CD1 4.37Å; Q59-L87 WeakPolarHBondContact CA-O 3.41Å; Q59-L87 HydrophobicContact CG-CB 4.23Å; Q59-L87 VanDerWaalsContact CG-O 3.29Å; Q59-L87 WeakPolarHBondContact CG-O 3.42Å; Q59-L87 PolarHBondContact N-O 2.86Å; I63-L87 HydrophobicContact CD1-CD2 4.31Å; I63-L87 HydrophobicContact CG1-CD2 4.11Å; A80-L87 HydrophobicContact CB-CD2 4.3Å; A84-L87 PolarHBondContact O-N 3.27Å; E85-L87 PolarHBondContact O-N 2.88Å
88	Q	76.1	Confident	77.9	Confident	153 Å²	153	47.5 Å²	47.5	72%	0.715	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-98.6	-14.7	176	-56.6	-177.8	25.9	0	0	112.3	E85 L86	E85-Q88 WeakPolarHBondContact O-CB 3.47Å; E85-Q88 PolarHBondContact O-N 3.27Å; L86-Q88 PolarHBondContact O-N 3.05Å
89	M	74	Confident	78	Confident	31 Å²	31	50.8 Å²	50.8	15%	0.153	27%	0.266	C	S	.	.	S	Bend	trans	-73.6	152	178.9	-63.8	-178.9	70.8	0	0	111.6	E85 L86 E93 I94 T115	E85-M89 PolarHBondContact O-N 3.05Å; L86-M89 HydrophobicContact CD2-SD 4.13Å; L86-M89 PolarHBondContact O-N 3.04Å; M89-E93 HydrophobicContact CB-CB 4.49Å; M89-E93 HydrophobicContact CE-CB 3.63Å; M89-I94 HydrophobicContact CB-CD1 4.2Å; M89-I94 HydrophobicContact CB-CG1 3.97Å; M89-T115 HydrophobicContact CE-CG2 4.15Å; M89-T115 HydrophobicContact SD-CG2 4.08Å
90	T	75.9	Confident	78.1	Confident	64 Å²	64	51.7 Å²	51.7	39%	0.393	27%	0.27	S	S	.	.			trans	-75.7	155.1	170.1	63.5	0	0	0	0	110.8	E92 E93 I94	T90-E92 PolarHBondContact O-N 2.64Å; T90-E93 WeakPolarHBondContact CB-OE2 3.26Å; T90-E93 PolarHBondContact N-OE2 3.33Å; T90-E93 PolarHBondContact O-N 3.16Å; T90-E93 WeakPolarHBondContact OG1-CB 3.49Å; T90-E93 WeakPolarHBondContact OG1-CG 3.5Å; T90-E93 PolarHBondContact OG1-N 3.28Å; T90-E93 PolarHBondContact OG1-OE2 2.73Å; T90-I94 WeakPolarHBondContact O-CG1 3.35Å; T90-I94 PolarHBondContact O-N 3.16Å; T90-I94 VanDerWaalsContact O-N 3.15Å
91	N	76.4	Confident	78.4	Confident	42 Å²	42	51.7 Å²	51.7	23%	0.225	27%	0.27	C	S	.	.	H	α-helix	trans	-56	-40.5	173.9	176.7	-52.2	0	0	0	111	N61 A65 E93 I94 I95	N61-N91 HydrophobicContact CB-CB 4.28Å; A65-N91 HydrophobicContact CB-CB 4.25Å; A65-N91 WeakPolarHBondContact CB-ND2 3.31Å; N91-E93 PolarHBondContact O-N 2.95Å; N91-I94 PolarHBondContact O-N 3.43Å; N91-I95 WeakPolarHBondContact O-CB 3.4Å; N91-I95 WeakPolarHBondContact O-CG1 3.45Å; N91-I95 PolarHBondContact O-N 3.44Å; N91-I95 WeakPolarHBondContact OD1-CD1 3.42Å
92	E	79.1	Confident	78.7	Confident	153 Å²	153	54.2 Å²	54.2	72%	0.715	29%	0.291	S	S	*	.	H	α-helix	trans	-61.8	-41.3	178.1	-64.9	-175.4	175.2	0	0	113	T90 S96	T90-E92 PolarHBondContact O-N 2.64Å; E92-S96 WeakPolarHBondContact O-CB 3.38Å; E92-S96 PolarHBondContact O-N 3.13Å; E92-S96 PolarHBondContact O-OG 2.93Å
93	E	77	Confident	79.2	Confident	89 Å²	89	56.7 Å²	56.7	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-66	-41.9	176.8	-72.1	163.2	143.7	0	0	111.6	M89 T90 N91 S96 A97	M89-E93 HydrophobicContact CB-CB 4.49Å; M89-E93 HydrophobicContact CE-CB 3.63Å; T90-E93 WeakPolarHBondContact CB-OE2 3.26Å; T90-E93 PolarHBondContact N-OE2 3.33Å; T90-E93 PolarHBondContact O-N 3.16Å; T90-E93 WeakPolarHBondContact OG1-CB 3.49Å; T90-E93 WeakPolarHBondContact OG1-CG 3.5Å; T90-E93 PolarHBondContact OG1-N 3.28Å; T90-E93 PolarHBondContact OG1-OE2 2.73Å; N91-E93 PolarHBondContact O-N 2.95Å; E93-S96 PolarHBondContact O-N 3.44Å; E93-A97 WeakPolarHBondContact O-CB 3.32Å; E93-A97 PolarHBondContact O-N 3.43Å
94	I	77.8	Confident	79.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-49.7	177.5	-66.8	166.8	0	0	0	110.2	A62 A65 L66 L86 M89 T90 N91 S96 A97 I98	A62-I94 HydrophobicContact CB-CD1 3.53Å; A65-I94 HydrophobicContact CB-CB 4.49Å; A65-I94 HydrophobicContact CB-CD1 4.48Å; A65-I94 HydrophobicContact CB-CG2 4.2Å; L66-I94 HydrophobicContact CD2-CG2 3.92Å; L86-I94 HydrophobicContact CD2-CG1 4.37Å; M89-I94 HydrophobicContact CB-CD1 4.2Å; M89-I94 HydrophobicContact CB-CG1 3.97Å; T90-I94 WeakPolarHBondContact O-CG1 3.35Å; T90-I94 PolarHBondContact O-N 3.16Å; T90-I94 VanDerWaalsContact O-N 3.15Å; N91-I94 PolarHBondContact O-N 3.43Å; I94-S96 VanDerWaalsContact C-N 3.3Å; I94-S96 PolarHBondContact O-N 2.88Å; I94-A97 PolarHBondContact O-N 2.93Å; I94-I98 HydrophobicContact CG2-CD1 3.69Å; I94-I98 HydrophobicContact CG2-CG1 4.49Å; I94-I98 WeakPolarHBondContact O-CD1 3.16Å; I94-I98 VanDerWaalsContact O-CG1 3.25Å; I94-I98 WeakPolarHBondContact O-CG1 3.33Å; I94-I98 PolarHBondContact O-N 3.43Å
95	I	80.6	Confident	80.2	Confident	42 Å²	42	57.1 Å²	57.1	22%	0.215	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-41.8	177.8	-69.9	-176.6	0	0	0	110.7	N91 I98 K99	N91-I95 WeakPolarHBondContact O-CB 3.4Å; N91-I95 WeakPolarHBondContact O-CG1 3.45Å; N91-I95 PolarHBondContact O-N 3.44Å; N91-I95 WeakPolarHBondContact OD1-CD1 3.42Å; I95-I98 PolarHBondContact O-N 3.11Å; I95-K99 HydrophobicContact CG2-CD 3.92Å; I95-K99 VanDerWaalsContact CG2-CE 3.47Å; I95-K99 HydrophobicContact CG2-CG 4.4Å; I95-K99 WeakPolarHBondContact O-CB 3.33Å; I95-K99 VanDerWaalsContact O-CG 3.31Å; I95-K99 WeakPolarHBondContact O-CG 3.38Å; I95-K99 PolarHBondContact O-N 3.13Å
96	S	80.7	Confident	80.7	Confident	62 Å²	62	51.1 Å²	51.1	43%	0.434	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-43.9	179.2	-62	0	0	0	0	111.6	E92 E93 I94 K99 L100	E92-S96 WeakPolarHBondContact O-CB 3.38Å; E92-S96 PolarHBondContact O-N 3.13Å; E92-S96 PolarHBondContact O-OG 2.93Å; E93-S96 PolarHBondContact O-N 3.44Å; I94-S96 VanDerWaalsContact C-N 3.3Å; I94-S96 PolarHBondContact O-N 2.88Å; S96-K99 PolarHBondContact O-N 3.43Å; S96-L100 VanDerWaalsContact O-CB 3.3Å; S96-L100 WeakPolarHBondContact O-CB 3.31Å; S96-L100 PolarHBondContact O-N 3.49Å
97	A	78.6	Confident	81.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-48.4	174.3	0	0	0	0	0	111.3	E93 I94 K99 L100 F101 T115	E93-A97 WeakPolarHBondContact O-CB 3.32Å; E93-A97 PolarHBondContact O-N 3.43Å; I94-A97 PolarHBondContact O-N 2.93Å; A97-K99 PolarHBondContact O-N 3.16Å; A97-L100 WeakPolarHBondContact O-CB 3.46Å; A97-L100 PolarHBondContact O-N 3.36Å; A97-F101 VanDerWaalsContact O-CD2 3.22Å; A97-F101 WeakPolarHBondContact O-CD2 3.4Å; A97-F101 PolarHBondContact O-N 3.44Å; A97-T115 HydrophobicContact CB-CG2 3.94Å
98	I	82.3	Confident	81.3	Confident	12 Å²	12	56 Å²	56	6%	0.062	31%	0.311	C	S	.	.	H	α-helix	trans	-57.3	-48.8	178.2	-69.8	162.7	0	0	0	111.1	Q69 I94 I95 L100 F101 A102 T108 V112	Q69-I98 HydrophobicContact CG-CD1 3.8Å; I94-I98 HydrophobicContact CG2-CD1 3.69Å; I94-I98 HydrophobicContact CG2-CG1 4.49Å; I94-I98 WeakPolarHBondContact O-CD1 3.16Å; I94-I98 VanDerWaalsContact O-CG1 3.25Å; I94-I98 WeakPolarHBondContact O-CG1 3.33Å; I94-I98 PolarHBondContact O-N 3.43Å; I95-I98 PolarHBondContact O-N 3.11Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.21Å; I98-F101 PolarHBondContact O-N 2.99Å; I98-A102 VanDerWaalsContact O-CB 3.31Å; I98-A102 WeakPolarHBondContact O-CB 3.47Å; I98-A102 PolarHBondContact O-N 3.34Å; I98-T108 HydrophobicContact CG2-CG2 3.95Å; I98-V112 HydrophobicContact CD1-CG2 3.77Å; I98-V112 HydrophobicContact CG1-CG2 3.64Å
99	K	83.3	Confident	81.4	Confident	140 Å²	140	49.6 Å²	49.6	61%	0.609	29%	0.285	S	S	*	.	H	α-helix	trans	-59.6	-44.7	178.4	-76.1	174	179.6	172	0	111.5	I95 S96 A97 A102 L103	I95-K99 HydrophobicContact CG2-CD 3.92Å; I95-K99 VanDerWaalsContact CG2-CE 3.47Å; I95-K99 HydrophobicContact CG2-CG 4.4Å; I95-K99 WeakPolarHBondContact O-CB 3.33Å; I95-K99 VanDerWaalsContact O-CG 3.31Å; I95-K99 WeakPolarHBondContact O-CG 3.38Å; I95-K99 PolarHBondContact O-N 3.13Å; S96-K99 PolarHBondContact O-N 3.43Å; A97-K99 PolarHBondContact O-N 3.16Å; K99-A102 WeakPolarHBondContact O-CB 3.16Å; K99-A102 PolarHBondContact O-N 2.97Å; K99-L103 WeakPolarHBondContact O-CG 3.49Å; K99-L103 PolarHBondContact O-N 3.4Å
100	L	83.2	Confident	81.8	Confident	18 Å²	18	50.2 Å²	50.2	9%	0.094	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-50.6	178.6	-177.9	169.5	0	0	0	111.6	S96 A97 I98 A102 L103 F104 P118 V121 H122	S96-L100 VanDerWaalsContact O-CB 3.3Å; S96-L100 WeakPolarHBondContact O-CB 3.31Å; S96-L100 PolarHBondContact O-N 3.49Å; A97-L100 WeakPolarHBondContact O-CB 3.46Å; A97-L100 PolarHBondContact O-N 3.36Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.21Å; L100-A102 VanDerWaalsContact C-N 3.28Å; L100-A102 PolarHBondContact O-N 2.87Å; L100-L103 VanDerWaalsContact O-CB 3.32Å; L100-L103 WeakPolarHBondContact O-CB 3.21Å; L100-L103 PolarHBondContact O-N 3.33Å; L100-L103 VanDerWaalsContact O-N 3.15Å; L100-F104 HydrophobicContact CD2-CD2 4.03Å; L100-F104 HydrophobicContact CD2-CE2 3.98Å; L100-F104 VanDerWaalsContact O-CD2 3.31Å; L100-F104 WeakPolarHBondContact O-CD2 3.37Å; L100-P118 HydrophobicContact CD1-CB 3.69Å; L100-P118 WeakPolarHBondContact CD1-O 3.47Å; L100-V121 HydrophobicContact CD2-CG1 4.24Å; L100-H122 HydrophobicContact CD1-CB 3.77Å; L100-H122 HydrophobicContact CD2-CB 4.31Å; L100-H122 HydrophobicContact CG-CB 4.13Å
101	F	86.1	Confident	81.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-33.3	179.2	-84.9	-72.6	0	0	0	112.4	A97 I98 L103 F104 G105 V106 A111 L114 V121 L125 L142 L149	A97-F101 VanDerWaalsContact O-CD2 3.22Å; A97-F101 WeakPolarHBondContact O-CD2 3.4Å; A97-F101 PolarHBondContact O-N 3.44Å; I98-F101 PolarHBondContact O-N 2.99Å; F101-L103 VanDerWaalsContact C-N 3.3Å; F101-L103 PolarHBondContact O-N 3Å; F101-F104 CarbonylContact O-C 3.33Å; F101-F104 PolarHBondContact O-N 3.25Å; F101-G105 PolarHBondContact O-N 3.39Å; F101-V106 HydrophobicContact CB-CB 4.03Å; F101-V106 HydrophobicContact CB-CG1 4.38Å; F101-V106 HydrophobicContact CD1-CB 3.88Å; F101-V106 HydrophobicContact CD1-CG1 3.85Å; F101-V106 HydrophobicContact CD1-CG2 4.03Å; F101-V106 HydrophobicContact CG-CB 4.41Å; F101-V106 HydrophobicContact CG-CG1 4.42Å; F101-V106 PolarHBondContact O-N 3.26Å; F101-A111 HydrophobicContact CB-CB 3.34Å; F101-A111 HydrophobicContact CD1-CB 4.35Å; F101-A111 HydrophobicContact CD2-CB 3.49Å; F101-A111 VanDerWaalsContact CD2-CB 3.49Å; F101-A111 HydrophobicContact CE2-CB 4.33Å; F101-A111 HydrophobicContact CG-CB 3.49Å; F101-A111 VanDerWaalsContact CG-CB 3.49Å; F101-L114 HydrophobicContact CE1-CD1 4.32Å; F101-L114 HydrophobicContact CZ-CB 4.11Å; F101-V121 HydrophobicContact CE1-CG1 3.77Å; F101-V121 HydrophobicContact CE2-CG1 4.32Å; F101-V121 HydrophobicContact CZ-CG1 3.62Å; F101-L125 HydrophobicContact CD1-CD1 4.29Å; F101-L125 HydrophobicContact CE1-CD1 4.28Å; F101-L142 HydrophobicContact CE1-CD1 4.12Å; F101-L149 HydrophobicContact CE1-CD1 4.23Å; F101-L149 HydrophobicContact CZ-CD1 4.08Å
102	A	85.7	Confident	82	Confident	59 Å²	59	45.2 Å²	45.2	49%	0.488	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-34.4	174	0	0	0	0	0	112.5	I98 K99 L100 F104 G105	I98-A102 VanDerWaalsContact O-CB 3.31Å; I98-A102 WeakPolarHBondContact O-CB 3.47Å; I98-A102 PolarHBondContact O-N 3.34Å; K99-A102 WeakPolarHBondContact O-CB 3.16Å; K99-A102 PolarHBondContact O-N 2.97Å; L100-A102 VanDerWaalsContact C-N 3.28Å; L100-A102 PolarHBondContact O-N 2.87Å; A102-F104 PolarHBondContact O-N 3.32Å; A102-G105 PolarHBondContact O-N 3.1Å
103	L	86.8	Confident	81.8	Confident	129 Å²	129	43 Å²	43	68%	0.675	24%	0.243	S	C	*	.	H	α-helix	trans	-59.8	-27.2	173.6	-63.1	173.5	0	0	0	112.6	K99 L100 F101	K99-L103 WeakPolarHBondContact O-CG 3.49Å; K99-L103 PolarHBondContact O-N 3.4Å; L100-L103 VanDerWaalsContact O-CB 3.32Å; L100-L103 WeakPolarHBondContact O-CB 3.21Å; L100-L103 PolarHBondContact O-N 3.33Å; L100-L103 VanDerWaalsContact O-N 3.15Å; F101-L103 VanDerWaalsContact C-N 3.3Å; F101-L103 PolarHBondContact O-N 3Å
104	F	87.6	Confident	81.8	Confident	15 Å²	15	39.9 Å²	39.9	7%	0.066	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	7.1	-179.5	-68.1	-67.8	0	0	0	113	L100 F101 A102 V106 H122 L125 R126 T135 F138	L100-F104 HydrophobicContact CD2-CD2 4.03Å; L100-F104 HydrophobicContact CD2-CE2 3.98Å; L100-F104 VanDerWaalsContact O-CD2 3.31Å; L100-F104 WeakPolarHBondContact O-CD2 3.37Å; F101-F104 CarbonylContact O-C 3.33Å; F101-F104 PolarHBondContact O-N 3.25Å; A102-F104 PolarHBondContact O-N 3.32Å; F104-V106 VanDerWaalsContact C-N 3.31Å; F104-V106 HydrophobicContact CB-CG2 4.45Å; F104-V106 PolarHBondContact O-N 2.95Å; F104-H122 AromaticContact CE2-CE1 3.94Å; F104-H122 AromaticContact CE2-ND1 3.45Å; F104-H122 WeakPolarHBondContact CE2-ND1 3.37Å; F104-H122 AromaticContact CZ-CE1 3.89Å; F104-H122 AromaticContact CZ-ND1 3.78Å; F104-L125 HydrophobicContact CB-CD1 4.05Å; F104-L125 HydrophobicContact CD1-CB 3.87Å; F104-L125 HydrophobicContact CD2-CB 3.89Å; F104-L125 HydrophobicContact CD2-CD1 3.46Å; F104-L125 VanDerWaalsContact CD2-CD1 3.46Å; F104-L125 HydrophobicContact CD2-CG 4.34Å; F104-L125 HydrophobicContact CE1-CB 3.69Å; F104-L125 HydrophobicContact CE2-CB 3.72Å; F104-L125 HydrophobicContact CE2-CD1 3.96Å; F104-L125 HydrophobicContact CE2-CG 4.5Å; F104-L125 HydrophobicContact CG-CB 3.95Å; F104-L125 HydrophobicContact CG-CD1 3.77Å; F104-L125 HydrophobicContact CG-CG 4.47Å; F104-L125 HydrophobicContact CZ-CB 3.61Å; F104-R126 HydrophobicContact CZ-CB 4.27Å; F104-T135 HydrophobicContact CD1-CG2 4.19Å; F104-F138 HydrophobicContact CB-CD2 3.8Å; F104-F138 HydrophobicContact CB-CE2 4.31Å; F104-F138 HydrophobicContact CD1-CD2 4.07Å; F104-F138 AromaticContact CD1-CE2 3.68Å; F104-F138 HydrophobicContact CD1-CE2 3.68Å; F104-F138 HydrophobicContact CE1-CE2 4.43Å; F104-F138 HydrophobicContact CG-CD2 4.3Å; F104-F138 HydrophobicContact CG-CE2 4.32Å
105	G	85.8	Confident	81.3	Confident	51 Å²	51	40.2 Å²	40.2	53%	0.526	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	21.3	177.9	0	0	0	0	0	114.4	F101 A102	F101-G105 PolarHBondContact O-N 3.39Å; A102-G105 PolarHBondContact O-N 3.1Å
106	V	86	Confident	80.5	Confident	7 Å²	7	41.4 Å²	41.4	4%	0.042	24%	0.237	C	C	.	.			trans	-87.3	137.4	176	179	0	0	0	0	109.2	F101 F104 K110 F138 L142	F101-V106 HydrophobicContact CB-CB 4.03Å; F101-V106 HydrophobicContact CB-CG1 4.38Å; F101-V106 HydrophobicContact CD1-CB 3.88Å; F101-V106 HydrophobicContact CD1-CG1 3.85Å; F101-V106 HydrophobicContact CD1-CG2 4.03Å; F101-V106 HydrophobicContact CG-CB 4.41Å; F101-V106 HydrophobicContact CG-CG1 4.42Å; F101-V106 PolarHBondContact O-N 3.26Å; F104-V106 VanDerWaalsContact C-N 3.31Å; F104-V106 HydrophobicContact CB-CG2 4.45Å; F104-V106 PolarHBondContact O-N 2.95Å; V106-K110 HydrophobicContact CG1-CB 4.05Å; V106-K110 HydrophobicContact CG1-CD 4.2Å; V106-K110 HydrophobicContact CG1-CG 4.15Å; V106-F138 HydrophobicContact CG2-CB 3.9Å; V106-L142 HydrophobicContact CG1-CD1 4.4Å; V106-L142 HydrophobicContact CG2-CD1 3.81Å
107	S	85	Confident	79.7	Confident	51 Å²	51	41.5 Å²	41.5	36%	0.357	24%	0.242	S	C	.	.			trans	-64.8	150.3	-178.3	70	0	0	0	0	112.3	A109 K110 A111 D139	S107-A109 PolarHBondContact O-N 3.48Å; S107-K110 PolarHBondContact O-N 2.96Å; S107-K110 VanDerWaalsContact O-N 3.15Å; S107-K110 VanDerWaalsContact OG-CB 3.26Å; S107-K110 WeakPolarHBondContact OG-CB 3.48Å; S107-K110 PolarHBondContact OG-N 3.43Å; S107-A111 WeakPolarHBondContact O-CB 3.48Å; S107-A111 PolarHBondContact O-N 3.24Å; S107-D139 PolarHBondContact N-OD1 3.48Å; S107-D139 VanDerWaalsContact N-OD1 3.11Å; S107-D139 PolarHBondContact OG-OD1 3.48Å
108	T	80.4	Confident	79.2	Confident	56 Å²	56	43.1 Å²	43.1	34%	0.344	25%	0.252	S	S	.	.	H	α-helix	trans	-54.9	-49.8	178.3	49.3	0	0	0	0	111.5	I98 K110 A111 V112	I98-T108 HydrophobicContact CG2-CG2 3.95Å; T108-K110 VanDerWaalsContact C-N 3.27Å; T108-K110 PolarHBondContact O-N 2.86Å; T108-A111 WeakPolarHBondContact O-CB 3.47Å; T108-A111 PolarHBondContact O-N 3.44Å; T108-V112 VanDerWaalsContact O-CG2 3.26Å; T108-V112 WeakPolarHBondContact O-CG2 3.47Å; T108-V112 PolarHBondContact O-N 3.23Å
109	A	77.7	Confident	78.7	Confident	20 Å²	20	48.8 Å²	48.8	17%	0.165	28%	0.278	C	S	.	.	H	α-helix	trans	-57	-40.2	178.4	0	0	0	0	0	112.5	M71 I79 S107 R113	M71-A109 HydrophobicContact SD-CB 4.41Å; I79-A109 HydrophobicContact CD1-CB 3.88Å; S107-A109 PolarHBondContact O-N 3.48Å; A109-R113 VanDerWaalsContact O-CG 3.3Å; A109-R113 WeakPolarHBondContact O-CG 3.41Å; A109-R113 PolarHBondContact O-N 3.3Å; A109-R113 VanDerWaalsContact O-N 3.17Å
110	K	81.5	Confident	78.5	Confident	44 Å²	44	45.8 Å²	45.8	19%	0.191	28%	0.275	C	S	.	.	H	α-helix	trans	-74.8	-43.7	179.1	-169.9	173.3	-68.9	145.4	0	111.7	V106 S107 T108 V112 R113 L114 D139 L142	V106-K110 HydrophobicContact CG1-CB 4.05Å; V106-K110 HydrophobicContact CG1-CD 4.2Å; V106-K110 HydrophobicContact CG1-CG 4.15Å; S107-K110 PolarHBondContact O-N 2.96Å; S107-K110 VanDerWaalsContact O-N 3.15Å; S107-K110 VanDerWaalsContact OG-CB 3.26Å; S107-K110 WeakPolarHBondContact OG-CB 3.48Å; S107-K110 PolarHBondContact OG-N 3.43Å; T108-K110 VanDerWaalsContact C-N 3.27Å; T108-K110 PolarHBondContact O-N 2.86Å; K110-V112 VanDerWaalsContact C-N 3.26Å; K110-V112 PolarHBondContact O-N 2.95Å; K110-R113 PolarHBondContact O-N 2.94Å; K110-L114 HydrophobicContact CD-CD1 4.35Å; K110-L114 HydrophobicContact CG-CD1 3.7Å; K110-L114 HydrophobicContact CG-CG 4.15Å; K110-L114 WeakPolarHBondContact O-CB 3.42Å; K110-L114 WeakPolarHBondContact O-CG 3.43Å; K110-L114 PolarHBondContact O-N 3.24Å; K110-D139 PolarHBondContact NZ-O 2.89Å; K110-D139 IonicContact NZ-OD1 3.14Å; K110-D139 PolarHBondContact NZ-OD1 3.4Å; K110-D139 IonicContact NZ-OD2 3.88Å; K110-D139 PolarHBondContact NZ-OD2 3.08Å; K110-L142 HydrophobicContact CD-CB 4.27Å
111	A	79.5	Confident	78.5	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-52.2	-47	175	0	0	0	0	0	111.7	F101 S107 T108 L114 T115	F101-A111 HydrophobicContact CB-CB 3.34Å; F101-A111 HydrophobicContact CD1-CB 4.35Å; F101-A111 HydrophobicContact CD2-CB 3.49Å; F101-A111 VanDerWaalsContact CD2-CB 3.49Å; F101-A111 HydrophobicContact CE2-CB 4.33Å; F101-A111 HydrophobicContact CG-CB 3.49Å; F101-A111 VanDerWaalsContact CG-CB 3.49Å; S107-A111 WeakPolarHBondContact O-CB 3.48Å; S107-A111 PolarHBondContact O-N 3.24Å; T108-A111 WeakPolarHBondContact O-CB 3.47Å; T108-A111 PolarHBondContact O-N 3.44Å; A111-L114 PolarHBondContact O-N 3.35Å; A111-T115 PolarHBondContact O-N 3.32Å
112	V	76.9	Confident	78.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-45.6	179.7	179.6	0	0	0	0	110.8	L66 I79 L86 I98 T108 K110 L114 T115	L66-V112 HydrophobicContact CD1-CG1 4.29Å; L66-V112 HydrophobicContact CD2-CB 4.23Å; L66-V112 HydrophobicContact CD2-CG1 3.44Å; L66-V112 VanDerWaalsContact CD2-CG1 3.44Å; L66-V112 HydrophobicContact CD2-CG2 3.74Å; I79-V112 HydrophobicContact CG2-CB 3.93Å; I79-V112 HydrophobicContact CG2-CG1 3.31Å; L86-V112 HydrophobicContact CD1-CG1 3.56Å; L86-V112 HydrophobicContact CD2-CG1 3.41Å; L86-V112 VanDerWaalsContact CD2-CG1 3.41Å; L86-V112 HydrophobicContact CG-CG1 4.14Å; I98-V112 HydrophobicContact CD1-CG2 3.77Å; I98-V112 HydrophobicContact CG1-CG2 3.64Å; T108-V112 VanDerWaalsContact O-CG2 3.26Å; T108-V112 WeakPolarHBondContact O-CG2 3.47Å; T108-V112 PolarHBondContact O-N 3.23Å; K110-V112 VanDerWaalsContact C-N 3.26Å; K110-V112 PolarHBondContact O-N 2.95Å; V112-L114 PolarHBondContact O-N 3.39Å; V112-T115 WeakPolarHBondContact O-CB 3.41Å; V112-T115 WeakPolarHBondContact O-CG2 3.31Å; V112-T115 PolarHBondContact O-N 2.99Å; V112-T115 VanDerWaalsContact O-N 3.16Å; V112-T115 PolarHBondContact O-OG1 2.88Å
113	R	76.4	Confident	78.6	Confident	107 Å²	107	49.5 Å²	49.5	40%	0.404	28%	0.284	S	S	.	.	H	α-helix	trans	-59.2	-36	175.9	-74.1	174.8	-173.7	-176.9	1.9	112.9	I79 N83 A109 K110 T115	I79-R113 HydrophobicContact CB-CG 4.23Å; I79-R113 HydrophobicContact CG1-CG 3.9Å; I79-R113 HydrophobicContact CG2-CG 3.98Å; N83-R113 PolarHBondContact ND2-O 3.39Å; A109-R113 VanDerWaalsContact O-CG 3.3Å; A109-R113 WeakPolarHBondContact O-CG 3.41Å; A109-R113 PolarHBondContact O-N 3.3Å; A109-R113 VanDerWaalsContact O-N 3.17Å; K110-R113 PolarHBondContact O-N 2.94Å; R113-T115 VanDerWaalsContact C-N 3.32Å
114	L	75.7	Confident	78.8	Confident	23 Å²	23	43.4 Å²	43.4	12%	0.12	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.1	-178.2	-66.5	176.5	0	0	0	113.9	F101 K110 A111 V112 L116 L142 L149	F101-L114 HydrophobicContact CE1-CD1 4.32Å; F101-L114 HydrophobicContact CZ-CB 4.11Å; K110-L114 HydrophobicContact CD-CD1 4.35Å; K110-L114 HydrophobicContact CG-CD1 3.7Å; K110-L114 HydrophobicContact CG-CG 4.15Å; K110-L114 WeakPolarHBondContact O-CB 3.42Å; K110-L114 WeakPolarHBondContact O-CG 3.43Å; K110-L114 PolarHBondContact O-N 3.24Å; A111-L114 PolarHBondContact O-N 3.35Å; V112-L114 PolarHBondContact O-N 3.39Å; L114-L116 WeakPolarHBondContact O-CG 3.49Å; L114-L116 PolarHBondContact O-N 3.14Å; L114-L142 HydrophobicContact CD1-CB 3.86Å; L114-L142 HydrophobicContact CD1-CD1 3.98Å; L114-L142 HydrophobicContact CD1-CG 4.43Å; L114-L149 HydrophobicContact CB-CD1 4.18Å; L114-L149 HydrophobicContact CD1-CD1 4.05Å; L114-L149 HydrophobicContact CG-CD1 4.49Å
115	T	66.8	Low	79	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.043	25%	0.249	C	C	.	.			trans	-47.9	98.3	-171.3	33.7	0	0	0	0	112	N83 L86 M89 A97 A111 V112 R113	N83-T115 PolarHBondContact ND2-OG1 3.35Å; N83-T115 VanDerWaalsContact ND2-OG1 3.13Å; L86-T115 HydrophobicContact CD2-CG2 3.88Å; L86-T115 WeakPolarHBondContact CD2-OG1 3.35Å; L86-T115 WeakPolarHBondContact CG-OG1 3.48Å; M89-T115 HydrophobicContact CE-CG2 4.15Å; M89-T115 HydrophobicContact SD-CG2 4.08Å; A97-T115 HydrophobicContact CB-CG2 3.94Å; A111-T115 PolarHBondContact O-N 3.32Å; V112-T115 WeakPolarHBondContact O-CB 3.41Å; V112-T115 WeakPolarHBondContact O-CG2 3.31Å; V112-T115 PolarHBondContact O-N 2.99Å; V112-T115 VanDerWaalsContact O-N 3.16Å; V112-T115 PolarHBondContact O-OG1 2.88Å; R113-T115 VanDerWaalsContact C-N 3.32Å
116	L	63.9	Low	79.2	Confident	67 Å²	67	48.6 Å²	48.6	35%	0.351	26%	0.255	S	S	.	.			trans	-116.3	166.1	169.4	-71.8	165.1	0	0	0	105.9	L114 P118 V121 L149 N150	L114-L116 WeakPolarHBondContact O-CG 3.49Å; L114-L116 PolarHBondContact O-N 3.14Å; L116-P118 WeakPolarHBondContact O-CD 3.3Å; L116-V121 HydrophobicContact CB-CG2 4.04Å; L116-L149 HydrophobicContact CD1-CB 3.76Å; L116-L149 HydrophobicContact CD1-CD1 4.24Å; L116-N150 WeakPolarHBondContact CD1-OD1 3.46Å
117	A	63.9	Low	79.6	Confident	64 Å²	64	50.4 Å²	50.4	53%	0.529	26%	0.263	S	S	.	.			trans	-44.4	112.5	179.8	0	0	0	0	0	111.5	E119 S120 V121	A117-E119 VanDerWaalsContact C-N 3.29Å; A117-E119 PolarHBondContact O-N 3.25Å; A117-S120 PolarHBondContact O-N 3.05Å; A117-V121 PolarHBondContact O-N 3.3Å
118	P	68.2	Low	80.1	Confident	35 Å²	35	48 Å²	48	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-40.8	-165.6	18.7	-30.8	0	0	0	111.7	L100 L116 S120 V121 H122	L100-P118 HydrophobicContact CD1-CB 3.69Å; L100-P118 WeakPolarHBondContact CD1-O 3.47Å; L116-P118 WeakPolarHBondContact O-CD 3.3Å; P118-S120 PolarHBondContact O-N 3.18Å; P118-V121 PolarHBondContact O-N 3.16Å; P118-H122 PolarHBondContact O-N 3.41Å
119	E	72.7	Confident	80.7	Confident	132 Å²	132	48 Å²	48	62%	0.617	25%	0.246	S	C	*	.	H	α-helix	trans	-60	-45.1	-178.7	-64.9	-55.9	149.7	0	0	113.5	A117 V121 H122 I123	A117-E119 VanDerWaalsContact C-N 3.29Å; A117-E119 PolarHBondContact O-N 3.25Å; E119-V121 VanDerWaalsContact C-N 3.29Å; E119-V121 PolarHBondContact O-N 3.06Å; E119-H122 PolarHBondContact O-N 3.15Å; E119-I123 WeakPolarHBondContact O-CG1 3.41Å; E119-I123 PolarHBondContact O-N 2.73Å; E119-I123 VanDerWaalsContact O-N 3.11Å
120	S	79.6	Confident	81.5	Confident	77 Å²	77	51 Å²	51	54%	0.538	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-40.1	178.5	-59.4	0	0	0	0	111.4	A117 P118 L124	A117-S120 PolarHBondContact O-N 3.05Å; P118-S120 PolarHBondContact O-N 3.18Å; S120-L124 WeakPolarHBondContact O-CB 3.12Å; S120-L124 PolarHBondContact O-N 2.78Å; S120-L124 VanDerWaalsContact O-N 3.14Å
121	V	83.3	Confident	82	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-42.1	176.9	173.3	0	0	0	0	111.2	L100 F101 L116 A117 P118 E119 I123 L124 L125 L149	L100-V121 HydrophobicContact CD2-CG1 4.24Å; F101-V121 HydrophobicContact CE1-CG1 3.77Å; F101-V121 HydrophobicContact CE2-CG1 4.32Å; F101-V121 HydrophobicContact CZ-CG1 3.62Å; L116-V121 HydrophobicContact CB-CG2 4.04Å; A117-V121 PolarHBondContact O-N 3.3Å; P118-V121 PolarHBondContact O-N 3.16Å; E119-V121 VanDerWaalsContact C-N 3.29Å; E119-V121 PolarHBondContact O-N 3.06Å; V121-I123 PolarHBondContact O-N 2.83Å; V121-L124 PolarHBondContact O-N 3.11Å; V121-L125 HydrophobicContact CG1-CD1 3.69Å; V121-L125 HydrophobicContact CG1-CG 4.07Å; V121-L125 WeakPolarHBondContact O-CB 3.44Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 3.46Å; V121-L149 HydrophobicContact CG1-CD1 4.48Å; V121-L149 HydrophobicContact CG1-CD2 3.95Å; V121-L149 HydrophobicContact CG2-CB 4.48Å; V121-L149 HydrophobicContact CG2-CD1 4.36Å; V121-L149 HydrophobicContact CG2-CD2 4.49Å
122	H	84.7	Confident	82.7	Confident	58 Å²	58	54.2 Å²	54.2	27%	0.269	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-49.6	177.8	-170.9	69.9	0	0	0	111.6	L100 F104 P118 E119 L124 L125 R126	L100-H122 HydrophobicContact CD1-CB 3.77Å; L100-H122 HydrophobicContact CD2-CB 4.31Å; L100-H122 HydrophobicContact CG-CB 4.13Å; F104-H122 AromaticContact CE2-CE1 3.94Å; F104-H122 AromaticContact CE2-ND1 3.45Å; F104-H122 WeakPolarHBondContact CE2-ND1 3.37Å; F104-H122 AromaticContact CZ-CE1 3.89Å; F104-H122 AromaticContact CZ-ND1 3.78Å; P118-H122 PolarHBondContact O-N 3.41Å; E119-H122 PolarHBondContact O-N 3.15Å; H122-L124 VanDerWaalsContact C-N 3.32Å; H122-L124 PolarHBondContact O-N 3.48Å; H122-L125 PolarHBondContact O-N 2.96Å; H122-R126 VanDerWaalsContact O-CB 3.24Å; H122-R126 WeakPolarHBondContact O-CB 3.28Å; H122-R126 PolarHBondContact O-N 2.89Å
123	I	87.7	Confident	83.5	Confident	95 Å²	95	54.3 Å²	54.3	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-47.2	-179.1	-66.8	166.2	0	0	0	109.8	E119 V121 H127 P153	E119-I123 WeakPolarHBondContact O-CG1 3.41Å; E119-I123 PolarHBondContact O-N 2.73Å; E119-I123 VanDerWaalsContact O-N 3.11Å; V121-I123 PolarHBondContact O-N 2.83Å; I123-H127 WeakPolarHBondContact O-CB 3.34Å; I123-H127 PolarHBondContact O-N 3.47Å; I123-P153 HydrophobicContact CG2-CG 4.2Å
124	L	91.3	Very high	84.3	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-46.4	-178.9	-179.1	70.1	0	0	0	112.9	S120 V121 H122 R126 H127 L128 V148 L149 V156	S120-L124 WeakPolarHBondContact O-CB 3.12Å; S120-L124 PolarHBondContact O-N 2.78Å; S120-L124 VanDerWaalsContact O-N 3.14Å; V121-L124 PolarHBondContact O-N 3.11Å; H122-L124 VanDerWaalsContact C-N 3.32Å; H122-L124 PolarHBondContact O-N 3.48Å; L124-R126 VanDerWaalsContact C-N 3.33Å; L124-R126 PolarHBondContact O-N 3.32Å; L124-H127 WeakPolarHBondContact O-CB 3.43Å; L124-H127 PolarHBondContact O-N 3.19Å; L124-H127 VanDerWaalsContact O-N 3.14Å; L124-L128 HydrophobicContact CG-CD1 4.46Å; L124-L128 WeakPolarHBondContact O-CG 3.17Å; L124-L128 PolarHBondContact O-N 3.41Å; L124-V148 WeakPolarHBondContact CD2-O 3.36Å; L124-L149 VanDerWaalsContact CD2-CA 3.5Å; L124-L149 HydrophobicContact CD2-CD2 4.23Å; L124-V156 HydrophobicContact CD1-CG2 3.63Å
125	L	91.2	Very high	85	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-40.7	179.3	-69.7	179	0	0	0	111.3	F101 F104 V121 H122 H127 L128 T129 F138 L142 L149	F101-L125 HydrophobicContact CD1-CD1 4.29Å; F101-L125 HydrophobicContact CE1-CD1 4.28Å; F104-L125 HydrophobicContact CB-CD1 4.05Å; F104-L125 HydrophobicContact CD1-CB 3.87Å; F104-L125 HydrophobicContact CD2-CB 3.89Å; F104-L125 HydrophobicContact CD2-CD1 3.46Å; F104-L125 VanDerWaalsContact CD2-CD1 3.46Å; F104-L125 HydrophobicContact CD2-CG 4.34Å; F104-L125 HydrophobicContact CE1-CB 3.69Å; F104-L125 HydrophobicContact CE2-CB 3.72Å; F104-L125 HydrophobicContact CE2-CD1 3.96Å; F104-L125 HydrophobicContact CE2-CG 4.5Å; F104-L125 HydrophobicContact CG-CB 3.95Å; F104-L125 HydrophobicContact CG-CD1 3.77Å; F104-L125 HydrophobicContact CG-CG 4.47Å; F104-L125 HydrophobicContact CZ-CB 3.61Å; V121-L125 HydrophobicContact CG1-CD1 3.69Å; V121-L125 HydrophobicContact CG1-CG 4.07Å; V121-L125 WeakPolarHBondContact O-CB 3.44Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 3.46Å; H122-L125 PolarHBondContact O-N 2.96Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 2.99Å; L125-L128 HydrophobicContact CD2-CD1 4.35Å; L125-L128 PolarHBondContact O-N 2.89Å; L125-T129 PolarHBondContact O-N 2.93Å; L125-T129 PolarHBondContact O-OG1 3.19Å; L125-F138 HydrophobicContact CB-CE2 4.41Å; L125-F138 HydrophobicContact CD2-CD1 4.25Å; L125-F138 HydrophobicContact CD2-CD2 4.36Å; L125-F138 HydrophobicContact CD2-CE1 4.24Å; L125-F138 HydrophobicContact CD2-CE2 4.36Å; L125-F138 HydrophobicContact CD2-CG 4.3Å; L125-F138 HydrophobicContact CD2-CZ 4.3Å; L125-F138 WeakPolarHBondContact O-CZ 3.45Å; L125-L142 HydrophobicContact CD2-CD1 4.46Å; L125-L149 HydrophobicContact CD2-CD2 4.14Å; L125-L149 HydrophobicContact CG-CD2 4.43Å
126	R	91.9	Very high	86.1	Confident	174 Å²	174	60 Å²	60	66%	0.657	33%	0.333	S	S	*	.	H	α-helix	trans	-61.3	-40	172.2	-178.2	-179.9	156.4	99.8	1.8	111.5	F104 H122 L124 T129 A130	F104-R126 HydrophobicContact CZ-CB 4.27Å; H122-R126 VanDerWaalsContact O-CB 3.24Å; H122-R126 WeakPolarHBondContact O-CB 3.28Å; H122-R126 PolarHBondContact O-N 2.89Å; L124-R126 VanDerWaalsContact C-N 3.33Å; L124-R126 PolarHBondContact O-N 3.32Å; R126-T129 PolarHBondContact O-N 3.07Å; R126-A130 PolarHBondContact O-N 3.37Å
127	H	93.8	Very high	87.4	Confident	46 Å²	46	59.4 Å²	59.4	21%	0.213	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-42.8	176.7	-163.7	74.7	0	0	0	112.1	I123 L124 L125 T129 A130 R131 P153 D157	I123-H127 WeakPolarHBondContact O-CB 3.34Å; I123-H127 PolarHBondContact O-N 3.47Å; L124-H127 WeakPolarHBondContact O-CB 3.43Å; L124-H127 PolarHBondContact O-N 3.19Å; L124-H127 VanDerWaalsContact O-N 3.14Å; L125-H127 VanDerWaalsContact C-N 3.3Å; L125-H127 PolarHBondContact O-N 2.99Å; H127-T129 VanDerWaalsContact C-N 3.33Å; H127-T129 PolarHBondContact O-N 3.17Å; H127-A130 WeakPolarHBondContact O-CB 3.35Å; H127-A130 PolarHBondContact O-N 2.83Å; H127-A130 VanDerWaalsContact O-N 3.14Å; H127-R131 PolarHBondContact O-N 3.15Å; H127-P153 PolarHBondContact NE2-O 3.47Å; H127-D157 IonicContact CD2-OD1 2.69Å; H127-D157 IonicContact CE1-OD1 3.28Å; H127-D157 IonicContact CE1-OD2 2.91Å; H127-D157 VanDerWaalsContact NE2-CG 3.3Å; H127-D157 IonicContact NE2-OD1 2.79Å; H127-D157 PolarHBondContact NE2-OD1 3.46Å; H127-D157 IonicContact NE2-OD2 3.62Å; H127-D157 PolarHBondContact NE2-OD2 3.12Å
128	L	94.2	Very high	88.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.6	-73.3	169.3	0	0	0	111.8	L124 L125 A130 R131 G132 L133 F138 M141 V148 V156 F160 M183	L124-L128 HydrophobicContact CG-CD1 4.46Å; L124-L128 WeakPolarHBondContact O-CG 3.17Å; L124-L128 PolarHBondContact O-N 3.41Å; L125-L128 HydrophobicContact CD2-CD1 4.35Å; L125-L128 PolarHBondContact O-N 2.89Å; L128-A130 VanDerWaalsContact C-N 3.33Å; L128-R131 PolarHBondContact O-N 3.42Å; L128-G132 PolarHBondContact O-N 3.14Å; L128-L133 HydrophobicContact CB-CB 4.42Å; L128-L133 HydrophobicContact CB-CD2 4.33Å; L128-L133 HydrophobicContact CD2-CD2 4.39Å; L128-L133 VanDerWaalsContact O-CB 3.29Å; L128-L133 WeakPolarHBondContact O-CB 3.32Å; L128-L133 PolarHBondContact O-N 2.93Å; L128-F138 HydrophobicContact CB-CE1 3.85Å; L128-F138 HydrophobicContact CB-CZ 3.85Å; L128-F138 HydrophobicContact CD1-CE1 4.09Å; L128-M141 HydrophobicContact CD1-CE 4.01Å; L128-V148 HydrophobicContact CD1-CG1 4.27Å; L128-V156 HydrophobicContact CD2-CG1 3.65Å; L128-V156 HydrophobicContact CD2-CG2 4.34Å; L128-F160 HydrophobicContact CD2-CE2 4.09Å; L128-M183 HydrophobicContact CD2-SD 4.16Å
129	T	94	Very high	89.7	Confident	56 Å²	56	56.7 Å²	56.7	34%	0.344	30%	0.303	S	S	.	.	H	α-helix	trans	-63.8	-38.5	173.1	-58	0	0	0	0	112	L125 R126 H127 R131 G132 L133 F138	L125-T129 PolarHBondContact O-N 2.93Å; L125-T129 PolarHBondContact O-OG1 3.19Å; R126-T129 PolarHBondContact O-N 3.07Å; H127-T129 VanDerWaalsContact C-N 3.33Å; H127-T129 PolarHBondContact O-N 3.17Å; T129-R131 VanDerWaalsContact C-N 3.28Å; T129-R131 PolarHBondContact O-N 3.26Å; T129-G132 WeakPolarHBondContact O-CA 3.26Å; T129-G132 PolarHBondContact O-N 3.42Å; T129-L133 WeakPolarHBondContact CA-O 3.35Å; T129-F138 WeakPolarHBondContact OG1-CE2 3.3Å; T129-F138 WeakPolarHBondContact OG1-CZ 3.07Å
130	A	94.2	Very high	90.6	Very high	83 Å²	83	54 Å²	54	69%	0.686	30%	0.296	S	S	*	.	H	α-helix	trans	-64.2	-31.3	175.1	0	0	0	0	0	112.7	R126 H127 L128 G132	R126-A130 PolarHBondContact O-N 3.37Å; H127-A130 WeakPolarHBondContact O-CB 3.35Å; H127-A130 PolarHBondContact O-N 2.83Å; H127-A130 VanDerWaalsContact O-N 3.14Å; L128-A130 VanDerWaalsContact C-N 3.33Å; A130-G132 PolarHBondContact O-N 3.26Å
131	R	92.6	Very high	91.2	Very high	68 Å²	68	50.3 Å²	50.3	26%	0.257	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	1.1	170.2	-73.4	-69.1	-169.1	153.4	-3.5	113.9	H127 L128 T129 D157 F160 D161	H127-R131 PolarHBondContact O-N 3.15Å; L128-R131 PolarHBondContact O-N 3.42Å; T129-R131 VanDerWaalsContact C-N 3.28Å; T129-R131 PolarHBondContact O-N 3.26Å; R131-D157 IonicContact CZ-OD1 2.73Å; R131-D157 IonicContact NE-OD1 2.86Å; R131-D157 PolarHBondContact NE-OD1 3.41Å; R131-D157 VanDerWaalsContact NH2-CB 3.26Å; R131-D157 IonicContact NH2-OD1 2.78Å; R131-D157 PolarHBondContact NH2-OD1 3.02Å; R131-F160 HydrophobicContact CB-CD1 4.31Å; R131-F160 HydrophobicContact CB-CD2 4.5Å; R131-F160 HydrophobicContact CB-CE1 4.07Å; R131-F160 HydrophobicContact CB-CE2 4.27Å; R131-F160 HydrophobicContact CB-CZ 4.04Å; R131-F160 HydrophobicContact CG-CD2 4.38Å; R131-F160 HydrophobicContact CG-CG 4.41Å; R131-D161 IonicContact CZ-OD1 3.94Å; R131-D161 IonicContact NH1-OD1 2.64Å; R131-D161 PolarHBondContact NH1-OD1 3.2Å; R131-D161 IonicContact NH2-OD1 2.86Å; R131-D161 PolarHBondContact NH2-OD1 3.4Å; R131-D161 VanDerWaalsContact NH2-OD1 3.11Å; R131-D161 IonicContact NH2-OD2 3.16Å
132	G	93.8	Very high	91.5	Very high	43 Å²	43	50.5 Å²	50.5	44%	0.443	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	5.4	174.3	0	0	0	0	0	115.1	L128 T129 A130 S134	L128-G132 PolarHBondContact O-N 3.14Å; T129-G132 WeakPolarHBondContact O-CA 3.26Å; T129-G132 PolarHBondContact O-N 3.42Å; A130-G132 PolarHBondContact O-N 3.26Å; G132-S134 PolarHBondContact O-N 2.74Å
133	L	93.7	Very high	91.7	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	28%	0.284	C	S	.	.			trans	-75.4	118.6	177.7	-172.2	55	0	0	0	110.6	L128 T129 H137 F138 M141 L173 V176	L128-L133 HydrophobicContact CB-CB 4.42Å; L128-L133 HydrophobicContact CB-CD2 4.33Å; L128-L133 HydrophobicContact CD2-CD2 4.39Å; L128-L133 VanDerWaalsContact O-CB 3.29Å; L128-L133 WeakPolarHBondContact O-CB 3.32Å; L128-L133 PolarHBondContact O-N 2.93Å; T129-L133 WeakPolarHBondContact CA-O 3.35Å; L133-H137 HydrophobicContact CD1-CB 4.19Å; L133-F138 HydrophobicContact CB-CE1 4.31Å; L133-F138 HydrophobicContact CD2-CD1 4.1Å; L133-F138 HydrophobicContact CD2-CE1 3.56Å; L133-F138 HydrophobicContact CG-CD1 4.34Å; L133-F138 HydrophobicContact CG-CE1 3.76Å; L133-F138 HydrophobicContact CG-CZ 4.47Å; L133-M141 HydrophobicContact CD2-CE 4.47Å; L133-M141 HydrophobicContact CD2-SD 3.6Å; L133-L173 HydrophobicContact CB-CD2 4.27Å; L133-V176 HydrophobicContact CD2-CG1 4.07Å
134	S	92.4	Very high	91.8	Very high	51 Å²	51	50.9 Å²	50.9	36%	0.357	28%	0.283	S	S	.	.			trans	-70.3	137.4	179.9	-179.4	0	0	0	0	111.5	G132 K136 H137	G132-S134 PolarHBondContact O-N 2.74Å; S134-K136 PolarHBondContact O-N 3.05Å; S134-K136 VanDerWaalsContact O-N 3.1Å; S134-K136 WeakPolarHBondContact OG-CG 3.29Å; S134-H137 PolarHBondContact O-N 3.23Å
135	T	90.3	Very high	91.8	Very high	54 Å²	54	51.2 Å²	51.2	33%	0.331	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-55.2	-29.7	178.5	55.6	0	0	0	0	113.2	F104 H137 F138	F104-T135 HydrophobicContact CD1-CG2 4.19Å; T135-H137 PolarHBondContact O-N 2.9Å; T135-F138 HydrophobicContact CG2-CD2 4.14Å; T135-F138 HydrophobicContact CG2-CE2 3.95Å; T135-F138 WeakPolarHBondContact O-CB 3.26Å; T135-F138 PolarHBondContact O-N 3.21Å
136	K	90.4	Very high	91.7	Very high	150 Å²	150	53.6 Å²	53.6	65%	0.652	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-57.7	-20.9	175.9	78.3	-170.3	-179.5	177.2	0	114.4	S134	S134-K136 PolarHBondContact O-N 3.05Å; S134-K136 VanDerWaalsContact O-N 3.1Å; S134-K136 WeakPolarHBondContact OG-CG 3.29Å
137	H	91.4	Very high	91.5	Very high	55 Å²	55	49.1 Å²	49.1	26%	0.255	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-93.5	-15.2	179.3	-64.5	-58.4	0	0	0	113.1	L133 S134 T135 D139 T140 M141	L133-H137 HydrophobicContact CD1-CB 4.19Å; S134-H137 PolarHBondContact O-N 3.23Å; T135-H137 PolarHBondContact O-N 2.9Å; H137-D139 PolarHBondContact O-N 3Å; H137-T140 PolarHBondContact O-N 2.92Å; H137-M141 WeakPolarHBondContact O-CB 3.22Å; H137-M141 PolarHBondContact O-N 3.47Å
138	F	91.7	Very high	91.4	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-41.4	-173	-71.9	-32.5	0	0	0	112.8	F104 V106 L125 L128 T129 L133 T135 T140 M141 L142	F104-F138 HydrophobicContact CB-CD2 3.8Å; F104-F138 HydrophobicContact CB-CE2 4.31Å; F104-F138 HydrophobicContact CD1-CD2 4.07Å; F104-F138 AromaticContact CD1-CE2 3.68Å; F104-F138 HydrophobicContact CD1-CE2 3.68Å; F104-F138 HydrophobicContact CE1-CE2 4.43Å; F104-F138 HydrophobicContact CG-CD2 4.3Å; F104-F138 HydrophobicContact CG-CE2 4.32Å; V106-F138 HydrophobicContact CG2-CB 3.9Å; L125-F138 HydrophobicContact CB-CE2 4.41Å; L125-F138 HydrophobicContact CD2-CD1 4.25Å; L125-F138 HydrophobicContact CD2-CD2 4.36Å; L125-F138 HydrophobicContact CD2-CE1 4.24Å; L125-F138 HydrophobicContact CD2-CE2 4.36Å; L125-F138 HydrophobicContact CD2-CG 4.3Å; L125-F138 HydrophobicContact CD2-CZ 4.3Å; L125-F138 WeakPolarHBondContact O-CZ 3.45Å; L128-F138 HydrophobicContact CB-CE1 3.85Å; L128-F138 HydrophobicContact CB-CZ 3.85Å; L128-F138 HydrophobicContact CD1-CE1 4.09Å; T129-F138 WeakPolarHBondContact OG1-CE2 3.3Å; T129-F138 WeakPolarHBondContact OG1-CZ 3.07Å; L133-F138 HydrophobicContact CB-CE1 4.31Å; L133-F138 HydrophobicContact CD2-CD1 4.1Å; L133-F138 HydrophobicContact CD2-CE1 3.56Å; L133-F138 HydrophobicContact CG-CD1 4.34Å; L133-F138 HydrophobicContact CG-CE1 3.76Å; L133-F138 HydrophobicContact CG-CZ 4.47Å; T135-F138 HydrophobicContact CG2-CD2 4.14Å; T135-F138 HydrophobicContact CG2-CE2 3.95Å; T135-F138 WeakPolarHBondContact O-CB 3.26Å; T135-F138 PolarHBondContact O-N 3.21Å; F138-T140 PolarHBondContact O-N 3.17Å; F138-M141 HydrophobicContact CD1-CE 3.74Å; F138-M141 HydrophobicContact CD1-SD 4.39Å; F138-M141 HydrophobicContact CE1-CE 4.19Å; F138-M141 PolarHBondContact O-N 3.25Å; F138-L142 VanDerWaalsContact O-CB 3.32Å; F138-L142 WeakPolarHBondContact O-CB 3.47Å; F138-L142 VanDerWaalsContact O-CG 3.26Å; F138-L142 WeakPolarHBondContact O-CG 3.44Å; F138-L142 PolarHBondContact O-N 2.66Å
139	D	89.4	Confident	91.1	Very high	42 Å²	42	47.4 Å²	47.4	23%	0.225	28%	0.283	C	S	.	.	H	α-helix	trans	-59.3	-47.7	177.3	-172.7	68.6	0	0	0	111.8	S107 K110 H137 G143	S107-D139 PolarHBondContact N-OD1 3.48Å; S107-D139 VanDerWaalsContact N-OD1 3.11Å; S107-D139 PolarHBondContact OG-OD1 3.48Å; K110-D139 PolarHBondContact NZ-O 2.89Å; K110-D139 IonicContact NZ-OD1 3.14Å; K110-D139 PolarHBondContact NZ-OD1 3.4Å; K110-D139 IonicContact NZ-OD2 3.88Å; K110-D139 PolarHBondContact NZ-OD2 3.08Å; H137-D139 PolarHBondContact O-N 3Å; D139-G143 PolarHBondContact O-N 3.36Å; D139-G143 VanDerWaalsContact O-N 3.08Å
140	T	91.2	Very high	90.8	Very high	76 Å²	76	49.8 Å²	49.8	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-68.4	-39.8	178.1	-52.9	0	0	0	0	112.3	H137 F138 G143 K144	H137-T140 PolarHBondContact O-N 2.92Å; F138-T140 PolarHBondContact O-N 3.17Å; T140-G143 PolarHBondContact O-N 3.4Å; T140-K144 WeakPolarHBondContact O-CG 3.13Å; T140-K144 PolarHBondContact O-N 2.96Å
141	M	92.6	Very high	90.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-50.7	-179.4	-175.7	-168.3	76.3	0	0	111.1	L128 L133 H137 F138 G143 K144 C145 V148 P180 M183	L128-M141 HydrophobicContact CD1-CE 4.01Å; L133-M141 HydrophobicContact CD2-CE 4.47Å; L133-M141 HydrophobicContact CD2-SD 3.6Å; H137-M141 WeakPolarHBondContact O-CB 3.22Å; H137-M141 PolarHBondContact O-N 3.47Å; F138-M141 HydrophobicContact CD1-CE 3.74Å; F138-M141 HydrophobicContact CD1-SD 4.39Å; F138-M141 HydrophobicContact CE1-CE 4.19Å; F138-M141 PolarHBondContact O-N 3.25Å; M141-G143 VanDerWaalsContact C-N 3.25Å; M141-G143 PolarHBondContact O-N 3.18Å; M141-K144 WeakPolarHBondContact O-CB 3.23Å; M141-K144 PolarHBondContact O-N 2.77Å; M141-C145 PolarHBondContact O-N 3.05Å; M141-V148 HydrophobicContact CE-CG1 4.25Å; M141-P180 HydrophobicContact CG-CB 3.49Å; M141-P180 VanDerWaalsContact CG-CB 3.49Å; M141-P180 HydrophobicContact CG-CG 3.68Å; M141-P180 WeakPolarHBondContact O-CG 3.38Å; M141-P180 HydrophobicContact SD-CB 4.34Å; M141-M183 HydrophobicContact SD-CE 4.4Å
142	L	90.2	Very high	90.7	Very high	5 Å²	5	48 Å²	48	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-26.6	179.4	-64.6	177.7	0	0	0	112.3	F101 V106 K110 L114 L125 F138 K144 S146 L149	F101-L142 HydrophobicContact CE1-CD1 4.12Å; V106-L142 HydrophobicContact CG1-CD1 4.4Å; V106-L142 HydrophobicContact CG2-CD1 3.81Å; K110-L142 HydrophobicContact CD-CB 4.27Å; L114-L142 HydrophobicContact CD1-CB 3.86Å; L114-L142 HydrophobicContact CD1-CD1 3.98Å; L114-L142 HydrophobicContact CD1-CG 4.43Å; L125-L142 HydrophobicContact CD2-CD1 4.46Å; F138-L142 VanDerWaalsContact O-CB 3.32Å; F138-L142 WeakPolarHBondContact O-CB 3.47Å; F138-L142 VanDerWaalsContact O-CG 3.26Å; F138-L142 WeakPolarHBondContact O-CG 3.44Å; F138-L142 PolarHBondContact O-N 2.66Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-S146 PolarHBondContact O-N 3.44Å; L142-L149 HydrophobicContact CD1-CD2 4.42Å; L142-L149 HydrophobicContact CD2-CD1 4.13Å; L142-L149 HydrophobicContact CD2-CD2 3.64Å; L142-L149 HydrophobicContact CD2-CG 3.69Å
143	G	87.8	Confident	90.7	Very high	52 Å²	52	48.1 Å²	48.1	54%	0.536	27%	0.274	S	S	.	.	H	α-helix	trans	-67.5	-27.4	169.7	0	0	0	0	0	113.7	D139 T140 M141	D139-G143 PolarHBondContact O-N 3.36Å; D139-G143 VanDerWaalsContact O-N 3.08Å; T140-G143 PolarHBondContact O-N 3.4Å; M141-G143 VanDerWaalsContact C-N 3.25Å; M141-G143 PolarHBondContact O-N 3.18Å
144	K	89.7	Confident	90.7	Very high	109 Å²	109	50.6 Å²	50.6	47%	0.474	30%	0.295	S	S	.	.	H	α-helix	trans	-87.8	-35.1	177.2	-72.2	174.5	175.2	179.3	0	112.9	T140 M141 L142 H178 P180	T140-K144 WeakPolarHBondContact O-CG 3.13Å; T140-K144 PolarHBondContact O-N 2.96Å; M141-K144 WeakPolarHBondContact O-CB 3.23Å; M141-K144 PolarHBondContact O-N 2.77Å; L142-K144 VanDerWaalsContact C-N 3.29Å; K144-H178 WeakPolarHBondContact CD-O 3.5Å; K144-H178 PolarHBondContact NZ-O 3.09Å; K144-P180 HydrophobicContact CB-CG 3.93Å
145	C	91.1	Very high	90.8	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.061	28%	0.283	C	S	.	.			trans	-154	100.3	-178	-174.2	0	0	0	0	110	M141 D147 V148 P180 T181	M141-C145 PolarHBondContact O-N 3.05Å; C145-D147 VanDerWaalsContact C-N 3.31Å; C145-V148 HydrophobicContact CB-CG2 4.17Å; C145-V148 WeakPolarHBondContact O-CG2 3.48Å; C145-P180 HydrophobicContact CB-CB 3.91Å; C145-P180 HydrophobicContact CB-CG 3.64Å; C145-T181 HydrophobicContact CB-CG2 4.04Å
146	S	88.8	Confident	91	Very high	49 Å²	49	47 Å²	47	34%	0.343	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-71.7	-26.4	173.4	51.1	0	0	0	0	112.7	L142 V148 L149	L142-S146 PolarHBondContact O-N 3.44Å; S146-V148 PolarHBondContact O-N 3.33Å; S146-L149 WeakPolarHBondContact O-CB 3.4Å; S146-L149 PolarHBondContact O-N 2.92Å
147	D	89.5	Confident	91.2	Very high	81 Å²	81	41.7 Å²	41.7	43%	0.433	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-62.2	-17.8	-176.7	-62	-31.6	0	0	0	113.3	C145 L149 N150 L184	C145-D147 VanDerWaalsContact C-N 3.31Å; D147-L149 PolarHBondContact O-N 3.45Å; D147-N150 WeakPolarHBondContact O-CB 3.29Å; D147-N150 PolarHBondContact O-N 2.78Å; D147-L184 HydrophobicContact CB-CD1 4.09Å; D147-L184 HydrophobicContact CB-CD2 4.07Å
148	V	90.4	Very high	91.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-53.7	-36.4	169.2	179	0	0	0	0	111.1	L124 L128 M141 C145 S146 N150 L151 P180 M183	L124-V148 WeakPolarHBondContact CD2-O 3.36Å; L128-V148 HydrophobicContact CD1-CG1 4.27Å; M141-V148 HydrophobicContact CE-CG1 4.25Å; C145-V148 HydrophobicContact CB-CG2 4.17Å; C145-V148 WeakPolarHBondContact O-CG2 3.48Å; S146-V148 PolarHBondContact O-N 3.33Å; V148-N150 PolarHBondContact O-N 2.91Å; V148-N150 VanDerWaalsContact O-N 3.16Å; V148-L151 HydrophobicContact CG1-CD1 4.38Å; V148-L151 VanDerWaalsContact O-CB 3.28Å; V148-L151 WeakPolarHBondContact O-CB 3.3Å; V148-L151 WeakPolarHBondContact O-CG 3.49Å; V148-L151 PolarHBondContact O-N 2.73Å; V148-P180 HydrophobicContact CG2-CB 3.75Å; V148-M183 HydrophobicContact CB-CE 4.09Å; V148-M183 HydrophobicContact CG1-CE 3.37Å; V148-M183 HydrophobicContact CG1-SD 4.3Å; V148-M183 HydrophobicContact CG2-CE 3.49Å; V148-M183 VanDerWaalsContact CG2-CE 3.49Å
149	L	88.5	Confident	91.6	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.047	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-64.4	-18.2	-180	-63.9	-176.6	0	0	0	113.9	F101 L114 L116 V121 L124 L125 L142 S146 D147 L151	F101-L149 HydrophobicContact CE1-CD1 4.23Å; F101-L149 HydrophobicContact CZ-CD1 4.08Å; L114-L149 HydrophobicContact CB-CD1 4.18Å; L114-L149 HydrophobicContact CD1-CD1 4.05Å; L114-L149 HydrophobicContact CG-CD1 4.49Å; L116-L149 HydrophobicContact CD1-CB 3.76Å; L116-L149 HydrophobicContact CD1-CD1 4.24Å; V121-L149 HydrophobicContact CG1-CD1 4.48Å; V121-L149 HydrophobicContact CG1-CD2 3.95Å; V121-L149 HydrophobicContact CG2-CB 4.48Å; V121-L149 HydrophobicContact CG2-CD1 4.36Å; V121-L149 HydrophobicContact CG2-CD2 4.49Å; L124-L149 VanDerWaalsContact CD2-CA 3.5Å; L124-L149 HydrophobicContact CD2-CD2 4.23Å; L125-L149 HydrophobicContact CD2-CD2 4.14Å; L125-L149 HydrophobicContact CG-CD2 4.43Å; L142-L149 HydrophobicContact CD1-CD2 4.42Å; L142-L149 HydrophobicContact CD2-CD1 4.13Å; L142-L149 HydrophobicContact CD2-CD2 3.64Å; L142-L149 HydrophobicContact CD2-CG 3.69Å; S146-L149 WeakPolarHBondContact O-CB 3.4Å; S146-L149 PolarHBondContact O-N 2.92Å; D147-L149 PolarHBondContact O-N 3.45Å; L149-L151 VanDerWaalsContact C-N 3.33Å
150	N	88.1	Confident	91.9	Very high	106 Å²	106	42 Å²	42	57%	0.567	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-89	-1.8	177.9	-61.2	-35.4	0	0	0	112.7	L116 D147 V148	L116-N150 WeakPolarHBondContact CD1-OD1 3.46Å; D147-N150 WeakPolarHBondContact O-CB 3.29Å; D147-N150 PolarHBondContact O-N 2.78Å; V148-N150 PolarHBondContact O-N 2.91Å; V148-N150 VanDerWaalsContact O-N 3.16Å
151	L	91.7	Very high	92.2	Very high	31 Å²	31	42 Å²	42	16%	0.162	24%	0.243	C	C	.	.			trans	-80.4	150	-179.8	-60.7	-178.1	0	0	0	111.8	V148 L149 R155 V156 M183 L184	V148-L151 HydrophobicContact CG1-CD1 4.38Å; V148-L151 VanDerWaalsContact O-CB 3.28Å; V148-L151 WeakPolarHBondContact O-CB 3.3Å; V148-L151 WeakPolarHBondContact O-CG 3.49Å; V148-L151 PolarHBondContact O-N 2.73Å; L149-L151 VanDerWaalsContact C-N 3.33Å; L151-R155 HydrophobicContact CD2-CG 3.98Å; L151-V156 HydrophobicContact CB-CG2 4.36Å; L151-M183 HydrophobicContact CD1-CB 3.56Å; L151-L184 HydrophobicContact CD1-CD2 4.29Å; L151-L184 HydrophobicContact CD2-CD2 4.03Å; L151-L184 HydrophobicContact CG-CD2 4.38Å
152	T	92.3	Very high	92.3	Very high	82 Å²	82	42.2 Å²	42.2	50%	0.503	25%	0.245	S	C	.	.			trans	-83.6	153.3	169.5	63.9	0	0	0	0	110.7	A154 R155 V156	T152-A154 PolarHBondContact O-N 3.09Å; T152-R155 WeakPolarHBondContact O-CB 3.25Å; T152-R155 PolarHBondContact O-N 3.29Å; T152-R155 WeakPolarHBondContact OG1-CB 3.49Å; T152-R155 PolarHBondContact OG1-N 3Å; T152-V156 PolarHBondContact O-N 3.28Å; T152-V156 VanDerWaalsContact O-N 3.09Å
153	P	92.8	Very high	92.6	Very high	46 Å²	46	42 Å²	42	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-53.7	-39.3	173.4	-28.8	36.5	0	0	0	113.2	I123 H127 R155 V156 D157	I123-P153 HydrophobicContact CG2-CG 4.2Å; H127-P153 PolarHBondContact NE2-O 3.47Å; P153-R155 VanDerWaalsContact C-N 3.3Å; P153-R155 PolarHBondContact O-N 3.29Å; P153-V156 WeakPolarHBondContact O-CB 3.32Å; P153-V156 PolarHBondContact O-N 3.47Å; P153-D157 VanDerWaalsContact O-CG 3.28Å; P153-D157 PolarHBondContact O-N 3Å
154	A	94.1	Very high	93	Very high	55 Å²	55	42.6 Å²	42.6	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-36.5	175.9	0	0	0	0	0	112.7	T152 D157 Q158	T152-A154 PolarHBondContact O-N 3.09Å; A154-D157 PolarHBondContact O-N 2.92Å; A154-Q158 VanDerWaalsContact O-CG 3.3Å; A154-Q158 WeakPolarHBondContact O-CG 3.26Å; A154-Q158 PolarHBondContact O-N 3.04Å
155	R	94.2	Very high	93.2	Very high	29 Å²	29	42.1 Å²	42.1	11%	0.109	24%	0.238	C	C	.	.	H	α-helix	trans	-69.7	-39.3	175.9	179.1	51.5	177.9	-155	-12.3	112	L151 T152 P153 D157 T159 Y185 Q186	L151-R155 HydrophobicContact CD2-CG 3.98Å; T152-R155 WeakPolarHBondContact O-CB 3.25Å; T152-R155 PolarHBondContact O-N 3.29Å; T152-R155 WeakPolarHBondContact OG1-CB 3.49Å; T152-R155 PolarHBondContact OG1-N 3Å; P153-R155 VanDerWaalsContact C-N 3.3Å; P153-R155 PolarHBondContact O-N 3.29Å; R155-D157 VanDerWaalsContact C-N 3.31Å; R155-T159 PolarHBondContact O-N 2.93Å; R155-T159 VanDerWaalsContact O-N 3.12Å; R155-T159 PolarHBondContact O-OG1 3.49Å; R155-Y185 PolarHBondContact NH2-O 2.87Å; R155-Q186 VanDerWaalsContact NH2-CD 3.35Å
156	V	94.9	Very high	93.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-48.2	172.2	174	0	0	0	0	109.5	L124 L128 L151 T152 P153 Q158 T159 F160	L124-V156 HydrophobicContact CD1-CG2 3.63Å; L128-V156 HydrophobicContact CD2-CG1 3.65Å; L128-V156 HydrophobicContact CD2-CG2 4.34Å; L151-V156 HydrophobicContact CB-CG2 4.36Å; T152-V156 PolarHBondContact O-N 3.28Å; T152-V156 VanDerWaalsContact O-N 3.09Å; P153-V156 WeakPolarHBondContact O-CB 3.32Å; P153-V156 PolarHBondContact O-N 3.47Å; V156-Q158 PolarHBondContact O-N 3.35Å; V156-T159 PolarHBondContact O-N 3.37Å; V156-T159 VanDerWaalsContact O-N 3.17Å; V156-F160 HydrophobicContact CG1-CD2 3.63Å; V156-F160 HydrophobicContact CG1-CE2 3.72Å; V156-F160 WeakPolarHBondContact O-CD2 3.26Å; V156-F160 PolarHBondContact O-N 3.08Å
157	D	95.4	Very high	93.5	Very high	39 Å²	39	40.6 Å²	40.6	21%	0.209	22%	0.224	C	C	.	.	H	α-helix	trans	-57.1	-51.8	178.7	-70	-29.6	0	0	0	112.2	H127 R131 P153 A154 R155 T159 F160 D161	H127-D157 IonicContact CD2-OD1 2.69Å; H127-D157 IonicContact CE1-OD1 3.28Å; H127-D157 IonicContact CE1-OD2 2.91Å; H127-D157 VanDerWaalsContact NE2-CG 3.3Å; H127-D157 IonicContact NE2-OD1 2.79Å; H127-D157 PolarHBondContact NE2-OD1 3.46Å; H127-D157 IonicContact NE2-OD2 3.62Å; H127-D157 PolarHBondContact NE2-OD2 3.12Å; R131-D157 IonicContact CZ-OD1 2.73Å; R131-D157 IonicContact NE-OD1 2.86Å; R131-D157 PolarHBondContact NE-OD1 3.41Å; R131-D157 VanDerWaalsContact NH2-CB 3.26Å; R131-D157 IonicContact NH2-OD1 2.78Å; R131-D157 PolarHBondContact NH2-OD1 3.02Å; P153-D157 VanDerWaalsContact O-CG 3.28Å; P153-D157 PolarHBondContact O-N 3Å; A154-D157 PolarHBondContact O-N 2.92Å; R155-D157 VanDerWaalsContact C-N 3.31Å; D157-T159 PolarHBondContact O-N 3.38Å; D157-F160 PolarHBondContact O-N 2.78Å; D157-F160 VanDerWaalsContact O-N 3.12Å; D157-D161 WeakPolarHBondContact O-CB 3.28Å; D157-D161 PolarHBondContact O-N 3Å
158	Q	95.9	Very high	93.8	Very high	99 Å²	99	39.6 Å²	39.6	46%	0.463	22%	0.223	S	C	.	.	H	α-helix	trans	-54.5	-40.7	177.1	-73.9	171.4	1.3	0	0	112.9	A154 V156 A162 P187	A154-Q158 VanDerWaalsContact O-CG 3.3Å; A154-Q158 WeakPolarHBondContact O-CG 3.26Å; A154-Q158 PolarHBondContact O-N 3.04Å; V156-Q158 PolarHBondContact O-N 3.35Å; Q158-A162 VanDerWaalsContact O-CB 3.25Å; Q158-A162 WeakPolarHBondContact O-CB 3.49Å; Q158-A162 PolarHBondContact O-N 3.42Å; Q158-P187 HydrophobicContact CB-CG 4.05Å
159	T	95.2	Very high	94	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.9	-45.5	178.9	-50.3	0	0	0	0	110.9	R155 V156 D157 A162 L163 M183 L190	R155-T159 PolarHBondContact O-N 2.93Å; R155-T159 VanDerWaalsContact O-N 3.12Å; R155-T159 PolarHBondContact O-OG1 3.49Å; V156-T159 PolarHBondContact O-N 3.37Å; V156-T159 VanDerWaalsContact O-N 3.17Å; D157-T159 PolarHBondContact O-N 3.38Å; T159-A162 PolarHBondContact O-N 3.42Å; T159-L163 HydrophobicContact CG2-CD1 4.14Å; T159-L163 HydrophobicContact CG2-CG 4.44Å; T159-L163 WeakPolarHBondContact O-CB 3.47Å; T159-L163 VanDerWaalsContact O-CG 3.3Å; T159-L163 WeakPolarHBondContact O-CG 3.49Å; T159-L163 PolarHBondContact O-N 3.1Å; T159-M183 HydrophobicContact CG2-CB 4.39Å; T159-M183 HydrophobicContact CG2-CG 4.05Å; T159-L190 HydrophobicContact CG2-CD1 4.19Å
160	F	96.4	Very high	94.3	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-45.4	178.2	-93	-91.2	0	0	0	111.5	L128 R131 V156 D157 L163 L164 L173 V176	L128-F160 HydrophobicContact CD2-CE2 4.09Å; R131-F160 HydrophobicContact CB-CD1 4.31Å; R131-F160 HydrophobicContact CB-CD2 4.5Å; R131-F160 HydrophobicContact CB-CE1 4.07Å; R131-F160 HydrophobicContact CB-CE2 4.27Å; R131-F160 HydrophobicContact CB-CZ 4.04Å; R131-F160 HydrophobicContact CG-CD2 4.38Å; R131-F160 HydrophobicContact CG-CG 4.41Å; V156-F160 HydrophobicContact CG1-CD2 3.63Å; V156-F160 HydrophobicContact CG1-CE2 3.72Å; V156-F160 WeakPolarHBondContact O-CD2 3.26Å; V156-F160 PolarHBondContact O-N 3.08Å; D157-F160 PolarHBondContact O-N 2.78Å; D157-F160 VanDerWaalsContact O-N 3.12Å; F160-L163 PolarHBondContact O-N 2.99Å; F160-L164 WeakPolarHBondContact O-CB 3.1Å; F160-L164 WeakPolarHBondContact O-CD1 3.5Å; F160-L164 WeakPolarHBondContact O-CG 3.38Å; F160-L164 PolarHBondContact O-N 3.43Å; F160-L173 HydrophobicContact CE1-CD2 3.99Å; F160-L173 HydrophobicContact CZ-CD2 4.39Å; F160-V176 HydrophobicContact CE1-CG2 4.39Å; F160-V176 HydrophobicContact CE2-CG1 4.31Å; F160-V176 HydrophobicContact CE2-CG2 4.16Å; F160-V176 HydrophobicContact CZ-CB 4.29Å; F160-V176 HydrophobicContact CZ-CG1 4.11Å; F160-V176 HydrophobicContact CZ-CG2 3.93Å
161	D	95.9	Very high	94.6	Very high	76 Å²	76	48.9 Å²	48.9	41%	0.406	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-44.4	179.8	-61.7	-16.3	0	0	0	110.3	R131 D157 L163 L164 D165	R131-D161 IonicContact CZ-OD1 3.94Å; R131-D161 IonicContact NH1-OD1 2.64Å; R131-D161 PolarHBondContact NH1-OD1 3.2Å; R131-D161 IonicContact NH2-OD1 2.86Å; R131-D161 PolarHBondContact NH2-OD1 3.4Å; R131-D161 VanDerWaalsContact NH2-OD1 3.11Å; R131-D161 IonicContact NH2-OD2 3.16Å; D157-D161 WeakPolarHBondContact O-CB 3.28Å; D157-D161 PolarHBondContact O-N 3Å; D161-L163 PolarHBondContact O-N 3.02Å; D161-L164 PolarHBondContact O-N 3.11Å; D161-D165 PolarHBondContact O-N 3.19Å
162	A	94.7	Very high	94.8	Very high	5 Å²	5	47.4 Å²	47.4	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-40.3	174.5	0	0	0	0	0	113.1	Q158 T159 F166 P187	Q158-A162 VanDerWaalsContact O-CB 3.25Å; Q158-A162 WeakPolarHBondContact O-CB 3.49Å; Q158-A162 PolarHBondContact O-N 3.42Å; T159-A162 PolarHBondContact O-N 3.42Å; A162-F166 WeakPolarHBondContact O-CD2 3.43Å; A162-F166 WeakPolarHBondContact O-CE2 3.46Å; A162-P187 HydrophobicContact CB-CB 3.86Å
163	L	96.2	Very high	95	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.6	-34.9	176.1	-69.5	175.3	0	0	0	111.9	T159 F160 D161 D165 F166 F167 C172 V176 V182	T159-L163 HydrophobicContact CG2-CD1 4.14Å; T159-L163 HydrophobicContact CG2-CG 4.44Å; T159-L163 WeakPolarHBondContact O-CB 3.47Å; T159-L163 VanDerWaalsContact O-CG 3.3Å; T159-L163 WeakPolarHBondContact O-CG 3.49Å; T159-L163 PolarHBondContact O-N 3.1Å; F160-L163 PolarHBondContact O-N 2.99Å; D161-L163 PolarHBondContact O-N 3.02Å; L163-D165 VanDerWaalsContact C-N 3.26Å; L163-D165 PolarHBondContact O-N 3.24Å; L163-F166 PolarHBondContact O-N 3.04Å; L163-F166 VanDerWaalsContact O-N 3.12Å; L163-F167 HydrophobicContact CB-CD2 4.43Å; L163-F167 HydrophobicContact CD2-CD2 4.14Å; L163-F167 HydrophobicContact CD2-CE2 4.15Å; L163-F167 WeakPolarHBondContact O-CB 3.35Å; L163-F167 WeakPolarHBondContact O-CD2 3.22Å; L163-F167 PolarHBondContact O-N 2.82Å; L163-C172 HydrophobicContact CB-CB 4.46Å; L163-V176 HydrophobicContact CD1-CG2 4.07Å; L163-V182 HydrophobicContact CD1-CG1 4.33Å; L163-V182 HydrophobicContact CD1-CG2 4.26Å; L163-V182 HydrophobicContact CD2-CG2 4.24Å
164	L	96.2	Very high	95.1	Very high	66 Å²	66	46.7 Å²	46.7	35%	0.346	25%	0.245	S	C	.	.	H	α-helix	trans	-69.6	-21.9	-179.5	-76.6	167.3	0	0	0	113.2	F160 D161 F166 V169 C172	F160-L164 WeakPolarHBondContact O-CB 3.1Å; F160-L164 WeakPolarHBondContact O-CD1 3.5Å; F160-L164 WeakPolarHBondContact O-CG 3.38Å; F160-L164 PolarHBondContact O-N 3.43Å; D161-L164 PolarHBondContact O-N 3.11Å; L164-F166 PolarHBondContact O-N 2.84Å; L164-V169 HydrophobicContact CD2-CB 4.36Å; L164-V169 HydrophobicContact CD2-CG2 3.72Å; L164-C172 HydrophobicContact CD2-CB 4.44Å; L164-C172 VanDerWaalsContact CD2-SG 3.59Å
165	D	93.9	Very high	95.2	Very high	99 Å²	99	44 Å²	44	53%	0.529	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.6	170.2	-73.1	-10.6	0	0	0	112.8	D161 L163 R191	D161-D165 PolarHBondContact O-N 3.19Å; L163-D165 VanDerWaalsContact C-N 3.26Å; L163-D165 PolarHBondContact O-N 3.24Å; D165-R191 IonicContact OD2-CZ 3.93Å; D165-R191 IonicContact OD2-NH1 3.48Å; D165-R191 PolarHBondContact OD2-NH1 3.12Å; D165-R191 VanDerWaalsContact OD2-NH1 3.14Å; D165-R191 IonicContact OD2-NH2 3.9Å; D165-R191 PolarHBondContact OD2-NH2 2.92Å
166	F	91.8	Very high	95.2	Very high	17 Å²	17	42.7 Å²	42.7	8%	0.075	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-31.5	-172.1	-49.9	-44.1	0	0	0	113.1	A162 L163 L164 R191 Y194 N205	A162-F166 WeakPolarHBondContact O-CD2 3.43Å; A162-F166 WeakPolarHBondContact O-CE2 3.46Å; L163-F166 PolarHBondContact O-N 3.04Å; L163-F166 VanDerWaalsContact O-N 3.12Å; L164-F166 PolarHBondContact O-N 2.84Å; F166-R191 HydrophobicContact CE1-CG 4.24Å; F166-R191 HydrophobicContact CE2-CB 4.18Å; F166-R191 HydrophobicContact CZ-CB 3.68Å; F166-R191 HydrophobicContact CZ-CG 3.6Å; F166-Y194 HydrophobicContact CB-CD1 3.87Å; F166-Y194 HydrophobicContact CB-CD2 3.93Å; F166-Y194 HydrophobicContact CB-CE1 3.63Å; F166-Y194 HydrophobicContact CB-CE2 3.71Å; F166-Y194 HydrophobicContact CB-CG 4.01Å; F166-Y194 AromaticContact CD1-CD1 3.17Å; F166-Y194 HydrophobicContact CD1-CD1 3.17Å; F166-Y194 AromaticContact CD1-CE1 3.2Å; F166-Y194 HydrophobicContact CD1-CE1 3.2Å; F166-Y194 AromaticContact CD1-CG 3.98Å; F166-Y194 HydrophobicContact CD1-CG 3.98Å; F166-Y194 AromaticContact CD2-CD1 3.89Å; F166-Y194 HydrophobicContact CD2-CD1 3.89Å; F166-Y194 HydrophobicContact CD2-CD2 4.42Å; F166-Y194 HydrophobicContact CD2-CE1 4.47Å; F166-Y194 AromaticContact CD2-CG 3.86Å; F166-Y194 HydrophobicContact CD2-CG 3.86Å; F166-Y194 AromaticContact CE1-CD1 3.63Å; F166-Y194 HydrophobicContact CE1-CD1 3.63Å; F166-Y194 HydrophobicContact CE1-CE1 4.01Å; F166-Y194 HydrophobicContact CE1-CG 4.48Å; F166-Y194 HydrophobicContact CE2-CD1 4.29Å; F166-Y194 HydrophobicContact CE2-CG 4.38Å; F166-Y194 AromaticContact CG-CD1 3.33Å; F166-Y194 HydrophobicContact CG-CD1 3.33Å; F166-Y194 HydrophobicContact CG-CD2 4.1Å; F166-Y194 AromaticContact CG-CE1 3.5Å; F166-Y194 HydrophobicContact CG-CE1 3.5Å; F166-Y194 VanDerWaalsContact CG-CE1 3.5Å; F166-Y194 HydrophobicContact CG-CE2 4.26Å; F166-Y194 AromaticContact CG-CG 3.66Å; F166-Y194 HydrophobicContact CG-CG 3.66Å; F166-Y194 AromaticContact CG-CZ 3.97Å; F166-Y194 HydrophobicContact CZ-CD1 4.19Å; F166-N205 PolarHBondContact O-ND2 3.21Å
167	F	95.6	Very high	95.2	Very high	8 Å²	8	43 Å²	43	4%	0.035	22%	0.221	C	C	.	.	S	Bend	trans	-125.4	150.1	-168.2	-61.2	-68.3	0	0	0	111.2	L163 Q171 I175 Y194 N205 V208 A209 W213	L163-F167 HydrophobicContact CB-CD2 4.43Å; L163-F167 HydrophobicContact CD2-CD2 4.14Å; L163-F167 HydrophobicContact CD2-CE2 4.15Å; L163-F167 WeakPolarHBondContact O-CB 3.35Å; L163-F167 WeakPolarHBondContact O-CD2 3.22Å; L163-F167 PolarHBondContact O-N 2.82Å; F167-Q171 HydrophobicContact CB-CB 3.83Å; F167-Q171 HydrophobicContact CD1-CB 4.32Å; F167-Q171 HydrophobicContact CG-CB 4.38Å; F167-I175 HydrophobicContact CD1-CD1 4.29Å; F167-I175 HydrophobicContact CD2-CD1 3.74Å; F167-I175 HydrophobicContact CE1-CD1 4.37Å; F167-I175 HydrophobicContact CE2-CD1 3.84Å; F167-I175 HydrophobicContact CG-CD1 3.99Å; F167-I175 HydrophobicContact CZ-CD1 4.16Å; F167-Y194 HydrophobicContact CE1-CD2 4.39Å; F167-Y194 HydrophobicContact CE1-CE2 4.05Å; F167-Y194 HydrophobicContact CE2-CD2 4.11Å; F167-Y194 HydrophobicContact CE2-CE2 4.39Å; F167-Y194 AromaticContact CZ-CD2 3.66Å; F167-Y194 HydrophobicContact CZ-CD2 3.66Å; F167-Y194 AromaticContact CZ-CE2 3.78Å; F167-Y194 HydrophobicContact CZ-CE2 3.78Å; F167-N205 HydrophobicContact CD1-CB 4.16Å; F167-N205 HydrophobicContact CE1-CB 4.24Å; F167-N205 WeakPolarHBondContact CE1-O 3.49Å; F167-V208 HydrophobicContact CE1-CB 4.23Å; F167-V208 HydrophobicContact CE1-CG1 4.35Å; F167-V208 HydrophobicContact CZ-CB 4.24Å; F167-V208 HydrophobicContact CZ-CG1 3.85Å; F167-A209 HydrophobicContact CD1-CB 3.93Å; F167-A209 HydrophobicContact CE1-CB 3.79Å; F167-W213 HydrophobicContact CE2-CZ2 4.06Å; F167-W213 HydrophobicContact CZ-CZ2 4.28Å
168	S	95.2	Very high	95.1	Very high	61 Å²	61	44.3 Å²	44.3	43%	0.427	23%	0.226	S	C	.	.			trans	-63.8	155.2	167.5	62.9	0	0	0	0	110.9	K170 Q171 C172	S168-K170 PolarHBondContact O-N 2.86Å; S168-K170 VanDerWaalsContact O-N 3.09Å; S168-Q171 WeakPolarHBondContact O-CA 3.42Å; S168-Q171 WeakPolarHBondContact O-CB 3.29Å; S168-Q171 PolarHBondContact O-N 3.12Å; S168-Q171 WeakPolarHBondContact OG-CG 3.41Å; S168-Q171 PolarHBondContact OG-N 3.08Å; S168-Q171 PolarHBondContact OG-OE1 2.73Å; S168-C172 PolarHBondContact O-N 2.86Å; S168-C172 PolarHBondContact O-SG 3.07Å; S168-C172 VanDerWaalsContact O-SG 3.35Å
169	V	95.5	Very high	95	Very high	90 Å²	90	41.3 Å²	41.3	55%	0.545	21%	0.212	S	C	.	.	H	α-helix	trans	-47.7	-43.6	174.9	178.7	0	0	0	0	111.8	L164 Q171 C172 L173	L164-V169 HydrophobicContact CD2-CB 4.36Å; L164-V169 HydrophobicContact CD2-CG2 3.72Å; V169-Q171 VanDerWaalsContact C-N 3.34Å; V169-Q171 PolarHBondContact O-N 3.32Å; V169-C172 PolarHBondContact O-N 3.42Å; V169-L173 HydrophobicContact CG1-CD1 3.99Å; V169-L173 HydrophobicContact CG1-CG 4.35Å; V169-L173 WeakPolarHBondContact O-CB 3.37Å; V169-L173 VanDerWaalsContact O-CG 3.29Å; V169-L173 WeakPolarHBondContact O-CG 3.23Å; V169-L173 PolarHBondContact O-N 3.26Å
170	K	94.7	Very high	94.9	Very high	174 Å²	174	41.4 Å²	41.4	76%	0.757	21%	0.212	S	C	*	.	H	α-helix	trans	-61.8	-40.6	178.7	-174.2	179.1	179.4	-179.5	0	112.4	S168 F174	S168-K170 PolarHBondContact O-N 2.86Å; S168-K170 VanDerWaalsContact O-N 3.09Å; K170-F174 WeakPolarHBondContact O-CB 3.18Å; K170-F174 PolarHBondContact O-N 3.43Å
171	Q	95	Very high	94.9	Very high	45 Å²	45	42.8 Å²	42.8	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-71.5	-40.5	176.7	-75.3	167.1	-48.9	0	0	111.4	F167 S168 V169 L173 F174 I175 A209	F167-Q171 HydrophobicContact CB-CB 3.83Å; F167-Q171 HydrophobicContact CD1-CB 4.32Å; F167-Q171 HydrophobicContact CG-CB 4.38Å; S168-Q171 WeakPolarHBondContact O-CA 3.42Å; S168-Q171 WeakPolarHBondContact O-CB 3.29Å; S168-Q171 PolarHBondContact O-N 3.12Å; S168-Q171 WeakPolarHBondContact OG-CG 3.41Å; S168-Q171 PolarHBondContact OG-N 3.08Å; S168-Q171 PolarHBondContact OG-OE1 2.73Å; V169-Q171 VanDerWaalsContact C-N 3.34Å; V169-Q171 PolarHBondContact O-N 3.32Å; Q171-L173 PolarHBondContact O-N 3.07Å; Q171-F174 WeakPolarHBondContact O-CB 3.33Å; Q171-F174 PolarHBondContact O-N 2.79Å; Q171-I175 VanDerWaalsContact O-CG1 3.25Å; Q171-I175 WeakPolarHBondContact O-CG1 3.29Å; Q171-I175 PolarHBondContact O-N 3.3Å; Q171-A209 HydrophobicContact CB-CB 4.23Å; Q171-A209 HydrophobicContact CG-CB 4.2Å
172	C	95.8	Very high	94.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-49.9	173.6	-60.5	0	0	0	0	111.1	L163 L164 S168 V169 F174 I175 V176	L163-C172 HydrophobicContact CB-CB 4.46Å; L164-C172 HydrophobicContact CD2-CB 4.44Å; L164-C172 VanDerWaalsContact CD2-SG 3.59Å; S168-C172 PolarHBondContact O-N 2.86Å; S168-C172 PolarHBondContact O-SG 3.07Å; S168-C172 VanDerWaalsContact O-SG 3.35Å; V169-C172 PolarHBondContact O-N 3.42Å; C172-F174 VanDerWaalsContact C-N 3.29Å; C172-F174 PolarHBondContact O-N 3.37Å; C172-I175 PolarHBondContact O-N 2.98Å; C172-V176 WeakPolarHBondContact O-CG2 3.41Å; C172-V176 PolarHBondContact O-N 3.11Å
173	L	96	Very high	94.9	Very high	35 Å²	35	39 Å²	39	18%	0.183	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-37.1	177.5	-67.8	175.1	0	0	0	112	L133 F160 V169 Q171 S177	L133-L173 HydrophobicContact CB-CD2 4.27Å; F160-L173 HydrophobicContact CE1-CD2 3.99Å; F160-L173 HydrophobicContact CZ-CD2 4.39Å; V169-L173 HydrophobicContact CG1-CD1 3.99Å; V169-L173 HydrophobicContact CG1-CG 4.35Å; V169-L173 WeakPolarHBondContact O-CB 3.37Å; V169-L173 VanDerWaalsContact O-CG 3.29Å; V169-L173 WeakPolarHBondContact O-CG 3.23Å; V169-L173 PolarHBondContact O-N 3.26Å; Q171-L173 PolarHBondContact O-N 3.07Å; L173-S177 VanDerWaalsContact O-CB 3.23Å; L173-S177 WeakPolarHBondContact O-CB 3.49Å; L173-S177 PolarHBondContact O-N 2.96Å; L173-S177 PolarHBondContact O-OG 3.02Å
174	F	95.1	Very high	94.9	Very high	77 Å²	77	42.1 Å²	42.1	34%	0.338	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-50.5	173.3	178.3	-91	0	0	0	111.6	K170 Q171 C172 V176 S177 H178	K170-F174 WeakPolarHBondContact O-CB 3.18Å; K170-F174 PolarHBondContact O-N 3.43Å; Q171-F174 WeakPolarHBondContact O-CB 3.33Å; Q171-F174 PolarHBondContact O-N 2.79Å; C172-F174 VanDerWaalsContact C-N 3.29Å; C172-F174 PolarHBondContact O-N 3.37Å; F174-V176 PolarHBondContact O-N 3Å; F174-S177 PolarHBondContact O-N 3.02Å; F174-S177 PolarHBondContact O-OG 3.01Å; F174-H178 AromaticContact CD2-CE1 3.54Å; F174-H178 AromaticContact CD2-ND1 3.58Å; F174-H178 AromaticContact CE2-CD2 3.82Å; F174-H178 AromaticContact CE2-CE1 3.5Å; F174-H178 VanDerWaalsContact CE2-CE1 3.5Å; F174-H178 WeakPolarHBondContact CE2-CE1 3.39Å; F174-H178 AromaticContact CE2-CG 3.86Å; F174-H178 AromaticContact CE2-ND1 3.66Å; F174-H178 AromaticContact CE2-NE2 3.61Å; F174-H178 HydrophobicContact CZ-CB 4.5Å; F174-H178 AromaticContact CZ-CG 3.97Å; F174-H178 WeakPolarHBondContact O-CB 3.16Å; F174-H178 PolarHBondContact O-N 3.42Å; F174-H178 PolarHBondContact O-ND1 3.48Å
175	I	95.5	Very high	94.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-50.9	179.8	-65.3	162.5	0	0	0	109.9	F167 Q171 C172 S177 H178 H179 V182 A209 F214	F167-I175 HydrophobicContact CD1-CD1 4.29Å; F167-I175 HydrophobicContact CD2-CD1 3.74Å; F167-I175 HydrophobicContact CE1-CD1 4.37Å; F167-I175 HydrophobicContact CE2-CD1 3.84Å; F167-I175 HydrophobicContact CG-CD1 3.99Å; F167-I175 HydrophobicContact CZ-CD1 4.16Å; Q171-I175 VanDerWaalsContact O-CG1 3.25Å; Q171-I175 WeakPolarHBondContact O-CG1 3.29Å; Q171-I175 PolarHBondContact O-N 3.3Å; C172-I175 PolarHBondContact O-N 2.98Å; I175-S177 PolarHBondContact O-N 2.69Å; I175-H178 PolarHBondContact O-N 3.08Å; I175-H179 CarbonylContact O-C 3.43Å; I175-H179 VanDerWaalsContact O-CA 3.28Å; I175-H179 WeakPolarHBondContact O-CA 3.08Å; I175-H179 WeakPolarHBondContact O-CB 3Å; I175-H179 PolarHBondContact O-N 3.18Å; I175-V182 HydrophobicContact CG2-CB 4.2Å; I175-V182 HydrophobicContact CG2-CG1 4.06Å; I175-V182 HydrophobicContact CG2-CG2 4.14Å; I175-A209 HydrophobicContact CD1-CB 3.98Å; I175-A209 HydrophobicContact CG1-CB 4.22Å; I175-F214 HydrophobicContact CG2-CE1 4.18Å
176	V	95.3	Very high	94.8	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-40.5	-177.8	173.4	0	0	0	0	112	L133 F160 L163 C172 F174 P180 V182 M183	L133-V176 HydrophobicContact CD2-CG1 4.07Å; F160-V176 HydrophobicContact CE1-CG2 4.39Å; F160-V176 HydrophobicContact CE2-CG1 4.31Å; F160-V176 HydrophobicContact CE2-CG2 4.16Å; F160-V176 HydrophobicContact CZ-CB 4.29Å; F160-V176 HydrophobicContact CZ-CG1 4.11Å; F160-V176 HydrophobicContact CZ-CG2 3.93Å; L163-V176 HydrophobicContact CD1-CG2 4.07Å; C172-V176 WeakPolarHBondContact O-CG2 3.41Å; C172-V176 PolarHBondContact O-N 3.11Å; F174-V176 PolarHBondContact O-N 3Å; V176-P180 VanDerWaalsContact O-CA 3.29Å; V176-P180 WeakPolarHBondContact O-CA 3.37Å; V176-V182 HydrophobicContact CG2-CG1 4.12Å; V176-M183 HydrophobicContact CG1-CE 3.72Å; V176-M183 HydrophobicContact CG1-SD 3.75Å
177	S	94	Very high	94.9	Very high	7 Å²	7	43.2 Å²	43.2	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-71.4	-36.5	179.4	55.7	0	0	0	0	113.4	L173 F174 I175	L173-S177 VanDerWaalsContact O-CB 3.23Å; L173-S177 WeakPolarHBondContact O-CB 3.49Å; L173-S177 PolarHBondContact O-N 2.96Å; L173-S177 PolarHBondContact O-OG 3.02Å; F174-S177 PolarHBondContact O-N 3.02Å; F174-S177 PolarHBondContact O-OG 3.01Å; I175-S177 PolarHBondContact O-N 2.69Å
178	H	92.8	Very high	94.9	Very high	67 Å²	67	48.6 Å²	48.6	31%	0.31	25%	0.245	S	C	.	.	H	α-helix	trans	-91.4	-28.8	-175.9	-68.6	67.4	0	0	0	112.7	K144 F174 I175	K144-H178 WeakPolarHBondContact CD-O 3.5Å; K144-H178 PolarHBondContact NZ-O 3.09Å; F174-H178 AromaticContact CD2-CE1 3.54Å; F174-H178 AromaticContact CD2-ND1 3.58Å; F174-H178 AromaticContact CE2-CD2 3.82Å; F174-H178 AromaticContact CE2-CE1 3.5Å; F174-H178 VanDerWaalsContact CE2-CE1 3.5Å; F174-H178 WeakPolarHBondContact CE2-CE1 3.39Å; F174-H178 AromaticContact CE2-CG 3.86Å; F174-H178 AromaticContact CE2-ND1 3.66Å; F174-H178 AromaticContact CE2-NE2 3.61Å; F174-H178 HydrophobicContact CZ-CB 4.5Å; F174-H178 AromaticContact CZ-CG 3.97Å; F174-H178 WeakPolarHBondContact O-CB 3.16Å; F174-H178 PolarHBondContact O-N 3.42Å; F174-H178 PolarHBondContact O-ND1 3.48Å; I175-H178 PolarHBondContact O-N 3.08Å
179	H	93.8	Very high	94.9	Very high	36 Å²	36	48.4 Å²	48.4	17%	0.167	24%	0.24	C	C	.	.			trans	-136.3	66.6	-177.8	-50.6	-66.5	0	0	0	111.7	I175 T181 V182 R212 F214	I175-H179 CarbonylContact O-C 3.43Å; I175-H179 VanDerWaalsContact O-CA 3.28Å; I175-H179 WeakPolarHBondContact O-CA 3.08Å; I175-H179 WeakPolarHBondContact O-CB 3Å; I175-H179 PolarHBondContact O-N 3.18Å; H179-T181 PolarHBondContact O-N 3.17Å; H179-V182 WeakPolarHBondContact O-CB 3.41Å; H179-V182 VanDerWaalsContact O-CG1 3.3Å; H179-V182 WeakPolarHBondContact O-CG1 3.22Å; H179-V182 PolarHBondContact O-N 3Å; H179-R212 VanDerWaalsContact CE1-CG 3.41Å; H179-R212 WeakPolarHBondContact CE1-CG 3.41Å; H179-R212 WeakPolarHBondContact ND1-CG 3.29Å; H179-F214 HydrophobicContact CB-CE1 4.22Å; H179-F214 HydrophobicContact CB-CE2 4.05Å; H179-F214 HydrophobicContact CB-CZ 3.34Å; H179-F214 AromaticContact CG-CZ 3.86Å
180	P	94.5	Very high	94.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.013	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-58.3	-23.3	-177.6	17	-29.5	0	0	0	114.9	M141 K144 C145 V148 V176 V182 M183	M141-P180 HydrophobicContact CG-CB 3.49Å; M141-P180 VanDerWaalsContact CG-CB 3.49Å; M141-P180 HydrophobicContact CG-CG 3.68Å; M141-P180 WeakPolarHBondContact O-CG 3.38Å; M141-P180 HydrophobicContact SD-CB 4.34Å; K144-P180 HydrophobicContact CB-CG 3.93Å; C145-P180 HydrophobicContact CB-CB 3.91Å; C145-P180 HydrophobicContact CB-CG 3.64Å; V148-P180 HydrophobicContact CG2-CB 3.75Å; V176-P180 VanDerWaalsContact O-CA 3.29Å; V176-P180 WeakPolarHBondContact O-CA 3.37Å; P180-V182 PolarHBondContact O-N 2.92Å; P180-V182 VanDerWaalsContact O-N 3.07Å; P180-M183 HydrophobicContact CB-CE 4.05Å; P180-M183 WeakPolarHBondContact O-CE 3.48Å; P180-M183 PolarHBondContact O-N 3.49Å
181	T	94.8	Very high	94.9	Very high	33 Å²	33	39.4 Å²	39.4	20%	0.202	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-55.2	-24.2	175.2	49.4	0	0	0	0	112.6	C145 H179 M183 L184 Y185 E215	C145-T181 HydrophobicContact CB-CG2 4.04Å; H179-T181 PolarHBondContact O-N 3.17Å; T181-M183 PolarHBondContact O-N 3.14Å; T181-M183 VanDerWaalsContact O-N 3.11Å; T181-L184 WeakPolarHBondContact O-CB 3.48Å; T181-L184 PolarHBondContact O-N 3.4Å; T181-Y185 WeakPolarHBondContact O-CD2 3.28Å; T181-Y185 WeakPolarHBondContact O-CE2 3.44Å; T181-E215 PolarHBondContact OG1-OE1 3.2Å
182	V	96.2	Very high	95	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-51.5	-34	174	74.5	0	0	0	0	112.8	L163 I175 V176 H179 P180 L184 Y185 L190 F214	L163-V182 HydrophobicContact CD1-CG1 4.33Å; L163-V182 HydrophobicContact CD1-CG2 4.26Å; L163-V182 HydrophobicContact CD2-CG2 4.24Å; I175-V182 HydrophobicContact CG2-CB 4.2Å; I175-V182 HydrophobicContact CG2-CG1 4.06Å; I175-V182 HydrophobicContact CG2-CG2 4.14Å; V176-V182 HydrophobicContact CG2-CG1 4.12Å; H179-V182 WeakPolarHBondContact O-CB 3.41Å; H179-V182 VanDerWaalsContact O-CG1 3.3Å; H179-V182 WeakPolarHBondContact O-CG1 3.22Å; H179-V182 PolarHBondContact O-N 3Å; P180-V182 PolarHBondContact O-N 2.92Å; P180-V182 VanDerWaalsContact O-N 3.07Å; V182-L184 PolarHBondContact O-N 3.05Å; V182-Y185 PolarHBondContact O-N 3.27Å; V182-L190 HydrophobicContact CG2-CD1 4.07Å; V182-L190 HydrophobicContact CG2-CD2 4.05Å; V182-F214 HydrophobicContact CB-CD1 4.29Å; V182-F214 HydrophobicContact CB-CD2 4.09Å; V182-F214 HydrophobicContact CB-CE1 4.34Å; V182-F214 HydrophobicContact CB-CE2 4.12Å; V182-F214 HydrophobicContact CB-CG 4.22Å; V182-F214 HydrophobicContact CB-CZ 4.3Å; V182-F214 HydrophobicContact CG2-CB 4.47Å; V182-F214 HydrophobicContact CG2-CD1 3.88Å; V182-F214 HydrophobicContact CG2-CD2 4.26Å; V182-F214 HydrophobicContact CG2-CE1 4.32Å; V182-F214 HydrophobicContact CG2-CG 3.91Å
183	M	95.3	Very high	95	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-73	-13.8	-178.3	-63.8	-177.8	-74.3	0	0	113.8	L128 M141 V148 L151 T159 V176 P180 T181	L128-M183 HydrophobicContact CD2-SD 4.16Å; M141-M183 HydrophobicContact SD-CE 4.4Å; V148-M183 HydrophobicContact CB-CE 4.09Å; V148-M183 HydrophobicContact CG1-CE 3.37Å; V148-M183 HydrophobicContact CG1-SD 4.3Å; V148-M183 HydrophobicContact CG2-CE 3.49Å; V148-M183 VanDerWaalsContact CG2-CE 3.49Å; L151-M183 HydrophobicContact CD1-CB 3.56Å; T159-M183 HydrophobicContact CG2-CB 4.39Å; T159-M183 HydrophobicContact CG2-CG 4.05Å; V176-M183 HydrophobicContact CG1-CE 3.72Å; V176-M183 HydrophobicContact CG1-SD 3.75Å; P180-M183 HydrophobicContact CB-CE 4.05Å; P180-M183 WeakPolarHBondContact O-CE 3.48Å; P180-M183 PolarHBondContact O-N 3.49Å; T181-M183 PolarHBondContact O-N 3.14Å; T181-M183 VanDerWaalsContact O-N 3.11Å
184	L	95.2	Very high	95	Very high	67 Å²	67	38.9 Å²	38.9	35%	0.351	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-83.1	-19.2	176.4	-52.5	-177.4	0	0	0	112	D147 L151 T181 V182	D147-L184 HydrophobicContact CB-CD1 4.09Å; D147-L184 HydrophobicContact CB-CD2 4.07Å; L151-L184 HydrophobicContact CD1-CD2 4.29Å; L151-L184 HydrophobicContact CD2-CD2 4.03Å; L151-L184 HydrophobicContact CG-CD2 4.38Å; T181-L184 WeakPolarHBondContact O-CB 3.48Å; T181-L184 PolarHBondContact O-N 3.4Å; V182-L184 PolarHBondContact O-N 3.05Å
185	Y	95.4	Very high	94.9	Very high	67 Å²	67	39 Å²	39	26%	0.263	19%	0.194	S	C	.	.	S	Bend	trans	-86.8	149.3	-177.8	-63.8	-87.2	0	0	0	112.3	R155 T181 V182 L190 F214	R155-Y185 PolarHBondContact NH2-O 2.87Å; T181-Y185 WeakPolarHBondContact O-CD2 3.28Å; T181-Y185 WeakPolarHBondContact O-CE2 3.44Å; V182-Y185 PolarHBondContact O-N 3.27Å; Y185-L190 HydrophobicContact CG-CD2 4.41Å; Y185-F214 HydrophobicContact CD2-CB 4.44Å; Y185-F214 HydrophobicContact CD2-CD2 4.04Å; Y185-F214 WeakPolarHBondContact CE1-O 3.37Å; Y185-F214 AromaticContact CE2-CD2 3.78Å; Y185-F214 HydrophobicContact CE2-CD2 3.78Å
186	Q	94.4	Very high	94.8	Very high	116 Å²	116	39.9 Å²	39.9	54%	0.542	20%	0.198	S	C	.	.			trans	-68.9	136.8	179.1	-65.6	-60.3	-23.9	0	0	111.6	R155 D188 D189 L190	R155-Q186 VanDerWaalsContact NH2-CD 3.35Å; Q186-D188 PolarHBondContact O-N 3.29Å; Q186-D189 HydrophobicContact CB-CB 4.32Å; Q186-D189 WeakPolarHBondContact O-CB 3.3Å; Q186-D189 PolarHBondContact O-N 3.27Å; Q186-L190 PolarHBondContact O-N 3.35Å
187	P	93.6	Very high	94.7	Very high	21 Å²	21	39.9 Å²	39.9	14%	0.136	20%	0.198	C	C	.	.	H	α-helix	trans	-48.4	-42.6	176.8	-33.5	37	0	0	0	114.3	Q158 A162 D189 L190 R191	Q158-P187 HydrophobicContact CB-CG 4.05Å; A162-P187 HydrophobicContact CB-CB 3.86Å; P187-D189 PolarHBondContact O-N 2.93Å; P187-L190 WeakPolarHBondContact O-CB 3.44Å; P187-L190 PolarHBondContact O-N 3.47Å; P187-R191 WeakPolarHBondContact O-CB 3.37Å; P187-R191 PolarHBondContact O-N 2.66Å
188	D	94.1	Very high	94.5	Very high	122 Å²	122	42.6 Å²	42.6	65%	0.652	21%	0.21	S	C	*	.	H	α-helix	trans	-69.1	-34.2	-179	-63.2	-24.8	0	0	0	112.7	Q186 S192	Q186-D188 PolarHBondContact O-N 3.29Å; D188-S192 WeakPolarHBondContact O-CB 3.41Å; D188-S192 PolarHBondContact O-N 2.82Å; D188-S192 PolarHBondContact O-OG 3.14Å
189	D	95.4	Very high	94.3	Very high	57 Å²	57	45 Å²	45	31%	0.305	23%	0.225	S	C	.	.	H	α-helix	trans	-70.2	-40.8	174.8	-176.6	50.9	0	0	0	110.6	Q186 P187 S192 K193	Q186-D189 HydrophobicContact CB-CB 4.32Å; Q186-D189 WeakPolarHBondContact O-CB 3.3Å; Q186-D189 PolarHBondContact O-N 3.27Å; P187-D189 PolarHBondContact O-N 2.93Å; D189-S192 PolarHBondContact O-N 3.3Å; D189-K193 VanDerWaalsContact CG-CE 3.45Å; D189-K193 WeakPolarHBondContact O-CG 3.43Å; D189-K193 PolarHBondContact O-N 3.41Å; D189-K193 VanDerWaalsContact O-N 3.11Å; D189-K193 WeakPolarHBondContact OD1-CE 3.41Å; D189-K193 IonicContact OD1-NZ 2.95Å; D189-K193 WeakPolarHBondContact OD2-CE 3.35Å; D189-K193 IonicContact OD2-NZ 3.43Å; D189-K193 PolarHBondContact OD2-NZ 3.01Å
190	L	96.2	Very high	94.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-47	173.2	-66	-180	0	0	0	111.3	T159 V182 Y185 Q186 P187 K193 Y194 W213 F214	T159-L190 HydrophobicContact CG2-CD1 4.19Å; V182-L190 HydrophobicContact CG2-CD1 4.07Å; V182-L190 HydrophobicContact CG2-CD2 4.05Å; Y185-L190 HydrophobicContact CG-CD2 4.41Å; Q186-L190 PolarHBondContact O-N 3.35Å; P187-L190 WeakPolarHBondContact O-CB 3.44Å; P187-L190 PolarHBondContact O-N 3.47Å; L190-K193 PolarHBondContact O-N 3.41Å; L190-Y194 WeakPolarHBondContact O-CB 3.43Å; L190-Y194 PolarHBondContact O-N 3.44Å; L190-W213 HydrophobicContact CB-CH2 4.06Å; L190-W213 HydrophobicContact CB-CZ3 4.4Å; L190-W213 HydrophobicContact CD2-CH2 3.93Å; L190-W213 HydrophobicContact CD2-CZ3 4.04Å; L190-W213 WeakPolarHBondContact O-CH2 3.43Å; L190-W213 WeakPolarHBondContact O-CZ3 2.98Å; L190-F214 HydrophobicContact CD2-CB 3.41Å; L190-F214 VanDerWaalsContact CD2-CB 3.41Å; L190-F214 HydrophobicContact CD2-CG 4.34Å
191	R	95.3	Very high	93.9	Very high	74 Å²	74	48.1 Å²	48.1	28%	0.279	24%	0.242	S	C	.	.	H	α-helix	trans	-58.8	-51.3	176.6	178.5	172.5	-45.9	-88.5	-1.8	111.7	D165 F166 P187 K193 Y194 E195	D165-R191 IonicContact OD2-CZ 3.93Å; D165-R191 IonicContact OD2-NH1 3.48Å; D165-R191 PolarHBondContact OD2-NH1 3.12Å; D165-R191 VanDerWaalsContact OD2-NH1 3.14Å; D165-R191 IonicContact OD2-NH2 3.9Å; D165-R191 PolarHBondContact OD2-NH2 2.92Å; F166-R191 HydrophobicContact CE1-CG 4.24Å; F166-R191 HydrophobicContact CE2-CB 4.18Å; F166-R191 HydrophobicContact CZ-CB 3.68Å; F166-R191 HydrophobicContact CZ-CG 3.6Å; P187-R191 WeakPolarHBondContact O-CB 3.37Å; P187-R191 PolarHBondContact O-N 2.66Å; R191-K193 VanDerWaalsContact C-N 3.3Å; R191-K193 PolarHBondContact O-N 2.86Å; R191-Y194 PolarHBondContact O-N 2.98Å; R191-Y194 VanDerWaalsContact O-N 3.16Å; R191-E195 WeakPolarHBondContact CD-OE1 3.19Å; R191-E195 HydrophobicContact CG-CG 4.17Å; R191-E195 VanDerWaalsContact CG-OE1 3.22Å; R191-E195 WeakPolarHBondContact CG-OE1 3.16Å; R191-E195 WeakPolarHBondContact O-CB 3.44Å; R191-E195 WeakPolarHBondContact O-CG 3.25Å; R191-E195 PolarHBondContact O-N 2.75Å
192	S	95.8	Very high	93.5	Very high	53 Å²	53	47.2 Å²	47.2	37%	0.371	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-41.8	-177	-58.2	0	0	0	0	112.1	D188 D189 F196	D188-S192 WeakPolarHBondContact O-CB 3.41Å; D188-S192 PolarHBondContact O-N 2.82Å; D188-S192 PolarHBondContact O-OG 3.14Å; D189-S192 PolarHBondContact O-N 3.3Å; S192-F196 WeakPolarHBondContact O-CB 3.43Å; S192-F196 PolarHBondContact O-N 2.64Å; S192-F196 VanDerWaalsContact O-N 3.11Å
193	K	96.5	Very high	93.2	Very high	5 Å²	5	47.4 Å²	47.4	2%	0.022	24%	0.241	C	C	.	.	H	α-helix	trans	-70.6	-41.1	176.4	-67.6	171.9	-168.2	169.4	0	112.4	D189 L190 R191 F196 L197 W213 F214 H216 L218 L221	D189-K193 VanDerWaalsContact CG-CE 3.45Å; D189-K193 WeakPolarHBondContact O-CG 3.43Å; D189-K193 PolarHBondContact O-N 3.41Å; D189-K193 VanDerWaalsContact O-N 3.11Å; D189-K193 WeakPolarHBondContact OD1-CE 3.41Å; D189-K193 IonicContact OD1-NZ 2.95Å; D189-K193 WeakPolarHBondContact OD2-CE 3.35Å; D189-K193 IonicContact OD2-NZ 3.43Å; D189-K193 PolarHBondContact OD2-NZ 3.01Å; L190-K193 PolarHBondContact O-N 3.41Å; R191-K193 VanDerWaalsContact C-N 3.3Å; R191-K193 PolarHBondContact O-N 2.86Å; K193-F196 PolarHBondContact O-N 3.12Å; K193-L197 WeakPolarHBondContact O-CG 3.37Å; K193-L197 PolarHBondContact O-N 3.22Å; K193-W213 HydrophobicContact CB-CE3 3.66Å; K193-W213 HydrophobicContact CB-CZ3 3.64Å; K193-W213 HydrophobicContact CD-CE3 4.27Å; K193-W213 HydrophobicContact CD-CZ3 4.35Å; K193-F214 PolarHBondContact NZ-O 3.42Å; K193-H216 WeakPolarHBondContact CD-O 3.47Å; K193-H216 WeakPolarHBondContact CE-O 3.43Å; K193-H216 PolarHBondContact NZ-O 2.91Å; K193-L218 HydrophobicContact CG-CB 4.14Å; K193-L218 HydrophobicContact CG-CD1 4.4Å; K193-L221 HydrophobicContact CB-CD1 4.08Å; K193-L221 HydrophobicContact CD-CD1 4.38Å; K193-L221 HydrophobicContact CG-CD1 4.04Å
194	Y	95.4	Very high	92.8	Very high	13 Å²	13	49 Å²	49	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-48.1	176.2	171.5	-93.7	0	0	0	111.2	F166 F167 L190 R191 F196 L197 H198 N205 V208	F166-Y194 HydrophobicContact CB-CD1 3.87Å; F166-Y194 HydrophobicContact CB-CD2 3.93Å; F166-Y194 HydrophobicContact CB-CE1 3.63Å; F166-Y194 HydrophobicContact CB-CE2 3.71Å; F166-Y194 HydrophobicContact CB-CG 4.01Å; F166-Y194 AromaticContact CD1-CD1 3.17Å; F166-Y194 HydrophobicContact CD1-CD1 3.17Å; F166-Y194 AromaticContact CD1-CE1 3.2Å; F166-Y194 HydrophobicContact CD1-CE1 3.2Å; F166-Y194 AromaticContact CD1-CG 3.98Å; F166-Y194 HydrophobicContact CD1-CG 3.98Å; F166-Y194 AromaticContact CD2-CD1 3.89Å; F166-Y194 HydrophobicContact CD2-CD1 3.89Å; F166-Y194 HydrophobicContact CD2-CD2 4.42Å; F166-Y194 HydrophobicContact CD2-CE1 4.47Å; F166-Y194 AromaticContact CD2-CG 3.86Å; F166-Y194 HydrophobicContact CD2-CG 3.86Å; F166-Y194 AromaticContact CE1-CD1 3.63Å; F166-Y194 HydrophobicContact CE1-CD1 3.63Å; F166-Y194 HydrophobicContact CE1-CE1 4.01Å; F166-Y194 HydrophobicContact CE1-CG 4.48Å; F166-Y194 HydrophobicContact CE2-CD1 4.29Å; F166-Y194 HydrophobicContact CE2-CG 4.38Å; F166-Y194 AromaticContact CG-CD1 3.33Å; F166-Y194 HydrophobicContact CG-CD1 3.33Å; F166-Y194 HydrophobicContact CG-CD2 4.1Å; F166-Y194 AromaticContact CG-CE1 3.5Å; F166-Y194 HydrophobicContact CG-CE1 3.5Å; F166-Y194 VanDerWaalsContact CG-CE1 3.5Å; F166-Y194 HydrophobicContact CG-CE2 4.26Å; F166-Y194 AromaticContact CG-CG 3.66Å; F166-Y194 HydrophobicContact CG-CG 3.66Å; F166-Y194 AromaticContact CG-CZ 3.97Å; F166-Y194 HydrophobicContact CZ-CD1 4.19Å; F167-Y194 HydrophobicContact CE1-CD2 4.39Å; F167-Y194 HydrophobicContact CE1-CE2 4.05Å; F167-Y194 HydrophobicContact CE2-CD2 4.11Å; F167-Y194 HydrophobicContact CE2-CE2 4.39Å; F167-Y194 AromaticContact CZ-CD2 3.66Å; F167-Y194 HydrophobicContact CZ-CD2 3.66Å; F167-Y194 AromaticContact CZ-CE2 3.78Å; F167-Y194 HydrophobicContact CZ-CE2 3.78Å; L190-Y194 WeakPolarHBondContact O-CB 3.43Å; L190-Y194 PolarHBondContact O-N 3.44Å; R191-Y194 PolarHBondContact O-N 2.98Å; R191-Y194 VanDerWaalsContact O-N 3.16Å; Y194-F196 VanDerWaalsContact C-N 3.32Å; Y194-F196 PolarHBondContact O-N 3.41Å; Y194-L197 PolarHBondContact O-N 3.49Å; Y194-L197 VanDerWaalsContact O-N 3.12Å; Y194-H198 HydrophobicContact CD1-CB 4.41Å; Y194-H198 HydrophobicContact CE1-CB 3.9Å; Y194-H198 HydrophobicContact CE2-CB 4.09Å; Y194-H198 AromaticContact CZ-CG 3.76Å; Y194-H198 VanDerWaalsContact O-CB 3.32Å; Y194-H198 WeakPolarHBondContact O-CB 3.43Å; Y194-H198 PolarHBondContact O-N 3.19Å; Y194-H198 PolarHBondContact OH-CD2 3.49Å; Y194-N205 VanDerWaalsContact OH-CG 3.28Å; Y194-N205 PolarHBondContact OH-ND2 2.95Å; Y194-N205 PolarHBondContact OH-OD1 2.96Å; Y194-V208 HydrophobicContact CD2-CG1 4.06Å
195	E	93.2	Very high	92.4	Very high	78 Å²	78	48.1 Å²	48.1	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-43.7	178.2	-75.9	176.1	-179.7	0	0	111.3	R191 L197 H198 L199	R191-E195 WeakPolarHBondContact CD-OE1 3.19Å; R191-E195 HydrophobicContact CG-CG 4.17Å; R191-E195 VanDerWaalsContact CG-OE1 3.22Å; R191-E195 WeakPolarHBondContact CG-OE1 3.16Å; R191-E195 WeakPolarHBondContact O-CB 3.44Å; R191-E195 WeakPolarHBondContact O-CG 3.25Å; R191-E195 PolarHBondContact O-N 2.75Å; E195-L197 PolarHBondContact O-N 2.95Å; E195-H198 PolarHBondContact O-N 3.42Å; E195-L199 HydrophobicContact CB-CD1 4.1Å; E195-L199 HydrophobicContact CG-CD1 4.16Å; E195-L199 WeakPolarHBondContact O-CA 3.36Å; E195-L199 WeakPolarHBondContact O-CB 3.39Å; E195-L199 WeakPolarHBondContact O-CG 3.36Å; E195-L199 PolarHBondContact O-N 3.07Å
196	F	94.2	Very high	92.1	Very high	20 Å²	20	47.9 Å²	47.9	9%	0.088	26%	0.255	C	S	.	.	I	π-helix	trans	-56.8	-51.2	172.8	171.2	-102	0	0	0	111.9	S192 K193 Y194 H198 N200 I201 L218 L221 E222 F225	S192-F196 WeakPolarHBondContact O-CB 3.43Å; S192-F196 PolarHBondContact O-N 2.64Å; S192-F196 VanDerWaalsContact O-N 3.11Å; K193-F196 PolarHBondContact O-N 3.12Å; Y194-F196 VanDerWaalsContact C-N 3.32Å; Y194-F196 PolarHBondContact O-N 3.41Å; F196-H198 PolarHBondContact O-N 2.88Å; F196-N200 HydrophobicContact CD2-CB 3.95Å; F196-N200 HydrophobicContact CE2-CB 4.24Å; F196-N200 WeakPolarHBondContact O-CA 3.42Å; F196-N200 VanDerWaalsContact O-CB 3.27Å; F196-N200 WeakPolarHBondContact O-CB 3.39Å; F196-N200 PolarHBondContact O-N 3.06Å; F196-I201 HydrophobicContact CD1-CG1 4.28Å; F196-I201 HydrophobicContact CE1-CD1 4.19Å; F196-I201 HydrophobicContact CE1-CG1 3.71Å; F196-I201 HydrophobicContact CE2-CD1 4.01Å; F196-I201 HydrophobicContact CE2-CG1 4.13Å; F196-I201 HydrophobicContact CZ-CD1 3.59Å; F196-I201 HydrophobicContact CZ-CG1 3.62Å; F196-I201 PolarHBondContact O-N 3.41Å; F196-I201 VanDerWaalsContact O-N 3.07Å; F196-L218 HydrophobicContact CB-CD1 3.67Å; F196-L218 HydrophobicContact CD1-CD1 4.08Å; F196-L218 HydrophobicContact CD2-CD1 4.47Å; F196-L218 HydrophobicContact CG-CD1 3.8Å; F196-L221 HydrophobicContact CD1-CB 4.05Å; F196-L221 HydrophobicContact CE1-CB 3.79Å; F196-E222 HydrophobicContact CD2-CG 3.98Å; F196-E222 HydrophobicContact CE1-CG 4.4Å; F196-E222 HydrophobicContact CE2-CB 4.39Å; F196-E222 HydrophobicContact CE2-CG 3.65Å; F196-E222 HydrophobicContact CZ-CB 4.27Å; F196-E222 HydrophobicContact CZ-CG 3.88Å; F196-F225 HydrophobicContact CE1-CD2 4.02Å; F196-F225 HydrophobicContact CZ-CB 4.14Å; F196-F225 HydrophobicContact CZ-CD2 4.45Å
197	L	93.6	Very high	91.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-67.1	-36.4	-178	-69.6	175.4	0	0	0	113.2	K193 Y194 E195 I201 G202 L203 V208 W213 L221 F225 L254	K193-L197 WeakPolarHBondContact O-CG 3.37Å; K193-L197 PolarHBondContact O-N 3.22Å; Y194-L197 PolarHBondContact O-N 3.49Å; Y194-L197 VanDerWaalsContact O-N 3.12Å; E195-L197 PolarHBondContact O-N 2.95Å; L197-I201 WeakPolarHBondContact O-CB 3.41Å; L197-G202 PolarHBondContact O-N 2.77Å; L197-L203 HydrophobicContact CB-CD1 4.33Å; L197-L203 HydrophobicContact CD2-CD1 4.05Å; L197-L203 WeakPolarHBondContact O-CB 3.5Å; L197-L203 PolarHBondContact O-N 3.46Å; L197-V208 HydrophobicContact CB-CG2 4.23Å; L197-V208 HydrophobicContact CD1-CG1 4.19Å; L197-W213 HydrophobicContact CD1-CB 3.48Å; L197-W213 VanDerWaalsContact CD1-CB 3.48Å; L197-W213 HydrophobicContact CD1-CD2 4.32Å; L197-W213 HydrophobicContact CD1-CG 3.91Å; L197-L221 HydrophobicContact CD1-CD1 4.37Å; L197-L221 HydrophobicContact CG-CD1 4.49Å; L197-F225 HydrophobicContact CD2-CD2 4.23Å; L197-F225 HydrophobicContact CD2-CE2 3.58Å; L197-F225 HydrophobicContact CD2-CZ 4.18Å; L197-L254 HydrophobicContact CD1-CD2 4.49Å; L197-L254 HydrophobicContact CD2-CD1 4.11Å
198	H	89.9	Confident	91.6	Very high	64 Å²	64	45.3 Å²	45.3	30%	0.296	24%	0.241	S	C	.	.	I	π-helix	trans	-85.3	-50.4	-176.1	-171.2	56.6	0	0	0	112.2	Y194 E195 F196 G202 L203 N205	Y194-H198 HydrophobicContact CD1-CB 4.41Å; Y194-H198 HydrophobicContact CE1-CB 3.9Å; Y194-H198 HydrophobicContact CE2-CB 4.09Å; Y194-H198 AromaticContact CZ-CG 3.76Å; Y194-H198 VanDerWaalsContact O-CB 3.32Å; Y194-H198 WeakPolarHBondContact O-CB 3.43Å; Y194-H198 PolarHBondContact O-N 3.19Å; Y194-H198 PolarHBondContact OH-CD2 3.49Å; E195-H198 PolarHBondContact O-N 3.42Å; F196-H198 PolarHBondContact O-N 2.88Å; H198-G202 VanDerWaalsContact O-CA 3.31Å; H198-G202 WeakPolarHBondContact O-CA 3.41Å; H198-G202 PolarHBondContact O-N 2.96Å; H198-L203 PolarHBondContact ND1-O 3.32Å; H198-N205 PolarHBondContact CE1-OD1 3.34Å; H198-N205 PolarHBondContact ND1-OD1 3.42Å
199	L	88.1	Confident	91.4	Very high	118 Å²	118	39.6 Å²	39.6	62%	0.618	21%	0.212	S	C	*	.	I	π-helix	trans	-85.4	-42.5	-173.5	-53.7	179	0	0	0	112.4	E195	E195-L199 HydrophobicContact CB-CD1 4.1Å; E195-L199 HydrophobicContact CG-CD1 4.16Å; E195-L199 WeakPolarHBondContact O-CA 3.36Å; E195-L199 WeakPolarHBondContact O-CB 3.39Å; E195-L199 WeakPolarHBondContact O-CG 3.36Å; E195-L199 PolarHBondContact O-N 3.07Å
200	N	89.5	Confident	91	Very high	97 Å²	97	43.9 Å²	43.9	52%	0.519	23%	0.23	S	C	.	.	I	π-helix	trans	-88.5	-37	-174.8	-59.4	21.8	0	0	0	111.9	F196 I236	F196-N200 HydrophobicContact CD2-CB 3.95Å; F196-N200 HydrophobicContact CE2-CB 4.24Å; F196-N200 WeakPolarHBondContact O-CA 3.42Å; F196-N200 VanDerWaalsContact O-CB 3.27Å; F196-N200 WeakPolarHBondContact O-CB 3.39Å; F196-N200 PolarHBondContact O-N 3.06Å; N200-I236 WeakPolarHBondContact O-CG2 3.41Å
201	I	89.9	Confident	90.6	Very high	6 Å²	6	44.1 Å²	44.1	3%	0.031	23%	0.231	C	C	.	.	S	Bend	trans	-95.9	-22.8	-177.4	-57.1	-51.9	0	0	0	112.3	F196 L197 L203 F225 Y234 I236	F196-I201 HydrophobicContact CD1-CG1 4.28Å; F196-I201 HydrophobicContact CE1-CD1 4.19Å; F196-I201 HydrophobicContact CE1-CG1 3.71Å; F196-I201 HydrophobicContact CE2-CD1 4.01Å; F196-I201 HydrophobicContact CE2-CG1 4.13Å; F196-I201 HydrophobicContact CZ-CD1 3.59Å; F196-I201 HydrophobicContact CZ-CG1 3.62Å; F196-I201 PolarHBondContact O-N 3.41Å; F196-I201 VanDerWaalsContact O-N 3.07Å; L197-I201 WeakPolarHBondContact O-CB 3.41Å; I201-L203 HydrophobicContact CG2-CD1 4.18Å; I201-L203 HydrophobicContact CG2-CG 3.93Å; I201-F225 HydrophobicContact CB-CD1 4.44Å; I201-F225 HydrophobicContact CD1-CB 3.63Å; I201-F225 HydrophobicContact CD1-CD1 3.96Å; I201-F225 HydrophobicContact CD1-CG 3.79Å; I201-F225 HydrophobicContact CG1-CB 4.28Å; I201-F225 HydrophobicContact CG1-CD1 4.08Å; I201-F225 HydrophobicContact CG1-CD2 4.27Å; I201-F225 HydrophobicContact CG1-CG 3.94Å; I201-F225 HydrophobicContact CG2-CD1 3.47Å; I201-F225 VanDerWaalsContact CG2-CD1 3.47Å; I201-F225 HydrophobicContact CG2-CE1 3.32Å; I201-F225 HydrophobicContact CG2-CG 4.17Å; I201-F225 HydrophobicContact CG2-CZ 3.91Å; I201-Y234 HydrophobicContact CG2-CE1 3.68Å; I201-I236 HydrophobicContact CD1-CD1 4.35Å
202	G	86.9	Confident	90.4	Very high	14 Å²	14	44.9 Å²	44.9	14%	0.144	23%	0.234	C	C	.	.			trans	79.1	29.2	177.9	0	0	0	0	0	113.9	L197 H198 Q242	L197-G202 PolarHBondContact O-N 2.77Å; H198-G202 VanDerWaalsContact O-CA 3.31Å; H198-G202 WeakPolarHBondContact O-CA 3.41Å; H198-G202 PolarHBondContact O-N 2.96Å; G202-Q242 PolarHBondContact O-NE2 3.13Å
203	L	88.3	Confident	90.3	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.217	C	C	.	.			trans	-80.3	140.9	174.8	-66.3	174.6	0	0	0	111.8	L197 H198 I201 V208 F225 Y234 L254	L197-L203 HydrophobicContact CB-CD1 4.33Å; L197-L203 HydrophobicContact CD2-CD1 4.05Å; L197-L203 WeakPolarHBondContact O-CB 3.5Å; L197-L203 PolarHBondContact O-N 3.46Å; H198-L203 PolarHBondContact ND1-O 3.32Å; I201-L203 HydrophobicContact CG2-CD1 4.18Å; I201-L203 HydrophobicContact CG2-CG 3.93Å; L203-V208 HydrophobicContact CB-CG2 3.76Å; L203-V208 HydrophobicContact CD1-CG2 4.46Å; L203-F225 HydrophobicContact CD1-CZ 4.08Å; L203-Y234 WeakPolarHBondContact CD2-OH 3.42Å; L203-L254 HydrophobicContact CD1-CB 4.34Å; L203-L254 HydrophobicContact CD1-CD1 3.81Å; L203-L254 HydrophobicContact CD1-CD2 3.92Å; L203-L254 HydrophobicContact CD1-CG 4.25Å
204	S	86.9	Confident	90.2	Very high	33 Å²	33	42.1 Å²	42.1	23%	0.231	22%	0.216	C	C	.	.			trans	-72.2	152.8	173.7	65.1	0	0	0	0	112.1	S206 Q207 V208	S204-S206 PolarHBondContact O-N 3.32Å; S204-S206 VanDerWaalsContact O-N 3.13Å; S204-S206 PolarHBondContact OG-OG 2.9Å; S204-Q207 WeakPolarHBondContact O-CB 3.47Å; S204-Q207 PolarHBondContact O-N 3.11Å; S204-Q207 VanDerWaalsContact OG-CG 3.32Å; S204-Q207 WeakPolarHBondContact OG-CG 3.46Å; S204-Q207 PolarHBondContact OG-N 2.9Å; S204-Q207 PolarHBondContact OG-OE1 2.92Å; S204-V208 WeakPolarHBondContact O-CG2 3.2Å; S204-V208 PolarHBondContact O-N 3.38Å
205	N	88.4	Confident	90.2	Very high	48 Å²	48	44.8 Å²	44.8	26%	0.257	23%	0.228	S	C	.	.	H	α-helix	trans	-57.1	-33.4	178.2	-61.7	1.1	0	0	0	112.3	F166 F167 Y194 H198 V208 A209	F166-N205 PolarHBondContact O-ND2 3.21Å; F167-N205 HydrophobicContact CD1-CB 4.16Å; F167-N205 HydrophobicContact CE1-CB 4.24Å; F167-N205 WeakPolarHBondContact CE1-O 3.49Å; Y194-N205 VanDerWaalsContact OH-CG 3.28Å; Y194-N205 PolarHBondContact OH-ND2 2.95Å; Y194-N205 PolarHBondContact OH-OD1 2.96Å; H198-N205 PolarHBondContact CE1-OD1 3.34Å; H198-N205 PolarHBondContact ND1-OD1 3.42Å; N205-V208 PolarHBondContact O-N 3.32Å; N205-A209 WeakPolarHBondContact O-CB 3.36Å; N205-A209 PolarHBondContact O-N 2.69Å
206	S	87.6	Confident	90.3	Very high	62 Å²	62	42.1 Å²	42.1	43%	0.434	22%	0.216	S	C	.	.	H	α-helix	trans	-64.1	-40.5	174.1	41.1	0	0	0	0	113.4	S204 Q210	S204-S206 PolarHBondContact O-N 3.32Å; S204-S206 VanDerWaalsContact O-N 3.13Å; S204-S206 PolarHBondContact OG-OG 2.9Å; S206-Q210 WeakPolarHBondContact O-CG 3.48Å; S206-Q210 PolarHBondContact O-N 3.32Å
207	Q	87.4	Confident	90.3	Very high	83 Å²	83	43.9 Å²	43.9	39%	0.388	23%	0.231	S	C	.	.	H	α-helix	trans	-69.1	-41.1	177.7	-72.5	165.5	-59.5	0	0	110.9	S204	S204-Q207 WeakPolarHBondContact O-CB 3.47Å; S204-Q207 PolarHBondContact O-N 3.11Å; S204-Q207 VanDerWaalsContact OG-CG 3.32Å; S204-Q207 WeakPolarHBondContact OG-CG 3.46Å; S204-Q207 PolarHBondContact OG-N 2.9Å; S204-Q207 PolarHBondContact OG-OE1 2.92Å
208	V	91.5	Very high	90.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-46.5	179.7	-175.5	0	0	0	0	110.6	F167 Y194 L197 L203 S204 N205 Q210 S211 W213	F167-V208 HydrophobicContact CE1-CB 4.23Å; F167-V208 HydrophobicContact CE1-CG1 4.35Å; F167-V208 HydrophobicContact CZ-CB 4.24Å; F167-V208 HydrophobicContact CZ-CG1 3.85Å; Y194-V208 HydrophobicContact CD2-CG1 4.06Å; L197-V208 HydrophobicContact CB-CG2 4.23Å; L197-V208 HydrophobicContact CD1-CG1 4.19Å; L203-V208 HydrophobicContact CB-CG2 3.76Å; L203-V208 HydrophobicContact CD1-CG2 4.46Å; S204-V208 WeakPolarHBondContact O-CG2 3.2Å; S204-V208 PolarHBondContact O-N 3.38Å; N205-V208 PolarHBondContact O-N 3.32Å; V208-Q210 PolarHBondContact O-N 3.41Å; V208-Q210 VanDerWaalsContact O-N 3.13Å; V208-S211 PolarHBondContact O-N 3.46Å; V208-S211 VanDerWaalsContact O-N 3.14Å; V208-S211 PolarHBondContact O-OG 3.15Å; V208-W213 HydrophobicContact CG1-CD2 4.14Å; V208-W213 HydrophobicContact CG1-CG 3.93Å; V208-W213 PolarHBondContact O-NE1 3.09Å
209	A	89.8	Confident	90.4	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-22.3	-178.1	0	0	0	0	0	114.9	F167 Q171 I175 N205	F167-A209 HydrophobicContact CD1-CB 3.93Å; F167-A209 HydrophobicContact CE1-CB 3.79Å; Q171-A209 HydrophobicContact CB-CB 4.23Å; Q171-A209 HydrophobicContact CG-CB 4.2Å; I175-A209 HydrophobicContact CD1-CB 3.98Å; I175-A209 HydrophobicContact CG1-CB 4.22Å; N205-A209 WeakPolarHBondContact O-CB 3.36Å; N205-A209 PolarHBondContact O-N 2.69Å
210	Q	87.5	Confident	90.6	Very high	146 Å²	146	43.8 Å²	43.8	68%	0.682	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	5.8	-179.4	-69.8	179	0.3	0	0	113.8	S206 V208	S206-Q210 WeakPolarHBondContact O-CG 3.48Å; S206-Q210 PolarHBondContact O-N 3.32Å; V208-Q210 PolarHBondContact O-N 3.41Å; V208-Q210 VanDerWaalsContact O-N 3.13Å
211	S	86.5	Confident	90.9	Very high	5 Å²	5	39.2 Å²	39.2	4%	0.035	21%	0.211	C	C	.	.	S	Bend	trans	-123.8	166.7	-177.4	75	0	0	0	0	112.3	V208 W213 L254	V208-S211 PolarHBondContact O-N 3.46Å; V208-S211 VanDerWaalsContact O-N 3.14Å; V208-S211 PolarHBondContact O-OG 3.15Å; S211-W213 VanDerWaalsContact C-N 3.3Å; S211-W213 PolarHBondContact O-N 2.95Å; S211-L254 WeakPolarHBondContact OG-CD2 3.32Å
212	R	91.3	Very high	91.1	Very high	91 Å²	91	42.1 Å²	42.1	34%	0.343	22%	0.224	S	C	.	.			trans	-95.7	39.1	178.3	-65.3	177.8	-64.4	162.3	-3.6	112.7	H179 F214 E215 H216 D259	H179-R212 VanDerWaalsContact CE1-CG 3.41Å; H179-R212 WeakPolarHBondContact CE1-CG 3.41Å; H179-R212 WeakPolarHBondContact ND1-CG 3.29Å; R212-F214 HydrophobicContact CB-CZ 4.31Å; R212-F214 HydrophobicContact CG-CZ 4.38Å; R212-F214 PolarHBondContact O-N 2.89Å; R212-F214 VanDerWaalsContact O-N 3.1Å; R212-E215 HydrophobicContact CB-CB 4.49Å; R212-E215 HydrophobicContact CB-CG 4.1Å; R212-E215 WeakPolarHBondContact CD-OE2 3.44Å; R212-E215 IonicContact CZ-OE2 3.05Å; R212-E215 IonicContact NE-OE2 2.84Å; R212-E215 IonicContact NH1-OE2 3.69Å; R212-E215 PolarHBondContact NH1-OE2 3.19Å; R212-E215 WeakPolarHBondContact O-CB 3.33Å; R212-E215 PolarHBondContact O-N 2.88Å; R212-H216 PolarHBondContact O-CD2 2.99Å; R212-D259 IonicContact CZ-OD2 3.89Å; R212-D259 IonicContact NE-OD2 3.71Å; R212-D259 PolarHBondContact NE-OD2 3.44Å; R212-D259 VanDerWaalsContact NH2-CG 3.33Å; R212-D259 IonicContact NH2-OD1 3.19Å; R212-D259 IonicContact NH2-OD2 3.88Å; R212-D259 PolarHBondContact NH2-OD2 2.96Å
213	W	94.5	Very high	91.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53.2	-33.5	-176.1	58.3	-86.9	0	0	0	114.4	F167 L190 K193 L197 V208 S211 E215 H216 I258	F167-W213 HydrophobicContact CE2-CZ2 4.06Å; F167-W213 HydrophobicContact CZ-CZ2 4.28Å; L190-W213 HydrophobicContact CB-CH2 4.06Å; L190-W213 HydrophobicContact CB-CZ3 4.4Å; L190-W213 HydrophobicContact CD2-CH2 3.93Å; L190-W213 HydrophobicContact CD2-CZ3 4.04Å; L190-W213 WeakPolarHBondContact O-CH2 3.43Å; L190-W213 WeakPolarHBondContact O-CZ3 2.98Å; K193-W213 HydrophobicContact CB-CE3 3.66Å; K193-W213 HydrophobicContact CB-CZ3 3.64Å; K193-W213 HydrophobicContact CD-CE3 4.27Å; K193-W213 HydrophobicContact CD-CZ3 4.35Å; L197-W213 HydrophobicContact CD1-CB 3.48Å; L197-W213 VanDerWaalsContact CD1-CB 3.48Å; L197-W213 HydrophobicContact CD1-CD2 4.32Å; L197-W213 HydrophobicContact CD1-CG 3.91Å; V208-W213 HydrophobicContact CG1-CD2 4.14Å; V208-W213 HydrophobicContact CG1-CG 3.93Å; V208-W213 PolarHBondContact O-NE1 3.09Å; S211-W213 VanDerWaalsContact C-N 3.3Å; S211-W213 PolarHBondContact O-N 2.95Å; W213-E215 VanDerWaalsContact C-N 3.26Å; W213-E215 PolarHBondContact O-N 2.86Å; W213-H216 PolarHBondContact O-N 2.86Å; W213-I258 HydrophobicContact CB-CD1 4.14Å
214	F	94.6	Very high	91.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-68.3	-22.3	179.4	47.9	-91.9	0	0	0	113.2	I175 H179 V182 Y185 L190 K193 R212 H216	I175-F214 HydrophobicContact CG2-CE1 4.18Å; H179-F214 HydrophobicContact CB-CE1 4.22Å; H179-F214 HydrophobicContact CB-CE2 4.05Å; H179-F214 HydrophobicContact CB-CZ 3.34Å; H179-F214 AromaticContact CG-CZ 3.86Å; V182-F214 HydrophobicContact CB-CD1 4.29Å; V182-F214 HydrophobicContact CB-CD2 4.09Å; V182-F214 HydrophobicContact CB-CE1 4.34Å; V182-F214 HydrophobicContact CB-CE2 4.12Å; V182-F214 HydrophobicContact CB-CG 4.22Å; V182-F214 HydrophobicContact CB-CZ 4.3Å; V182-F214 HydrophobicContact CG2-CB 4.47Å; V182-F214 HydrophobicContact CG2-CD1 3.88Å; V182-F214 HydrophobicContact CG2-CD2 4.26Å; V182-F214 HydrophobicContact CG2-CE1 4.32Å; V182-F214 HydrophobicContact CG2-CG 3.91Å; Y185-F214 HydrophobicContact CD2-CB 4.44Å; Y185-F214 HydrophobicContact CD2-CD2 4.04Å; Y185-F214 WeakPolarHBondContact CE1-O 3.37Å; Y185-F214 AromaticContact CE2-CD2 3.78Å; Y185-F214 HydrophobicContact CE2-CD2 3.78Å; L190-F214 HydrophobicContact CD2-CB 3.41Å; L190-F214 VanDerWaalsContact CD2-CB 3.41Å; L190-F214 HydrophobicContact CD2-CG 4.34Å; K193-F214 PolarHBondContact NZ-O 3.42Å; R212-F214 HydrophobicContact CB-CZ 4.31Å; R212-F214 HydrophobicContact CG-CZ 4.38Å; R212-F214 PolarHBondContact O-N 2.89Å; R212-F214 VanDerWaalsContact O-N 3.1Å; F214-H216 PolarHBondContact O-N 2.9Å
215	E	94.5	Very high	92.2	Very high	69 Å²	69	41 Å²	41	32%	0.322	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-73.1	-15.6	177.7	-61.7	-175.9	174.8	0	0	113	T181 R212 W213	T181-E215 PolarHBondContact OG1-OE1 3.2Å; R212-E215 HydrophobicContact CB-CB 4.49Å; R212-E215 HydrophobicContact CB-CG 4.1Å; R212-E215 WeakPolarHBondContact CD-OE2 3.44Å; R212-E215 IonicContact CZ-OE2 3.05Å; R212-E215 IonicContact NE-OE2 2.84Å; R212-E215 IonicContact NH1-OE2 3.69Å; R212-E215 PolarHBondContact NH1-OE2 3.19Å; R212-E215 WeakPolarHBondContact O-CB 3.33Å; R212-E215 PolarHBondContact O-N 2.88Å; W213-E215 VanDerWaalsContact C-N 3.26Å; W213-E215 PolarHBondContact O-N 2.86Å
216	H	95	Very high	92.5	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.097	22%	0.216	C	C	.	.	S	Bend	trans	-100.1	147.9	179.6	-57.2	-79.7	0	0	0	110.6	K193 R212 W213 F214 K220 L221 I258 D259	K193-H216 WeakPolarHBondContact CD-O 3.47Å; K193-H216 WeakPolarHBondContact CE-O 3.43Å; K193-H216 PolarHBondContact NZ-O 2.91Å; R212-H216 PolarHBondContact O-CD2 2.99Å; W213-H216 PolarHBondContact O-N 2.86Å; F214-H216 PolarHBondContact O-N 2.9Å; H216-K220 HydrophobicContact CB-CD 4.32Å; H216-K220 PolarHBondContact CE1-NZ 3.37Å; H216-K220 PolarHBondContact ND1-NZ 3.02Å; H216-L221 HydrophobicContact CB-CD2 3.93Å; H216-L221 HydrophobicContact CB-CG 4.18Å; H216-I258 PolarHBondContact CE1-O 3.28Å; H216-I258 PolarHBondContact NE2-O 3.33Å; H216-D259 IonicContact CD2-OD1 2.75Å; H216-D259 IonicContact CE1-OD1 2.72Å; H216-D259 IonicContact NE2-OD1 3.59Å; H216-D259 PolarHBondContact NE2-OD1 3.22Å
217	S	94.2	Very high	92.8	Very high	58 Å²	58	39.2 Å²	39.2	41%	0.406	20%	0.195	S	C	.	.			trans	-67.6	149.3	171.4	66.7	0	0	0	0	110.3	S219 K220 L221	S217-S219 PolarHBondContact O-N 2.81Å; S217-S219 PolarHBondContact OG-OG 3.31Å; S217-K220 PolarHBondContact O-N 2.99Å; S217-K220 WeakPolarHBondContact OG-CB 3.29Å; S217-K220 PolarHBondContact OG-N 2.82Å; S217-L221 PolarHBondContact O-N 2.82Å; S217-L221 VanDerWaalsContact O-N 3.12Å
218	L	94.1	Very high	93.2	Very high	47 Å²	47	35.2 Å²	35.2	25%	0.246	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-41.6	174.7	177.8	59.4	0	0	0	111.4	K193 F196 K220 L221 E222	K193-L218 HydrophobicContact CG-CB 4.14Å; K193-L218 HydrophobicContact CG-CD1 4.4Å; F196-L218 HydrophobicContact CB-CD1 3.67Å; F196-L218 HydrophobicContact CD1-CD1 4.08Å; F196-L218 HydrophobicContact CD2-CD1 4.47Å; F196-L218 HydrophobicContact CG-CD1 3.8Å; L218-K220 VanDerWaalsContact C-N 3.28Å; L218-K220 PolarHBondContact O-N 3.43Å; L218-L221 WeakPolarHBondContact O-CB 3.45Å; L218-L221 PolarHBondContact O-N 3.11Å; L218-L221 VanDerWaalsContact O-N 3.14Å; L218-E222 HydrophobicContact CD1-CG 4.19Å; L218-E222 HydrophobicContact CG-CG 4.32Å; L218-E222 WeakPolarHBondContact O-CG 3.37Å; L218-E222 PolarHBondContact O-N 3.49Å
219	S	91.7	Very high	93.3	Very high	70 Å²	70	37 Å²	37	49%	0.49	19%	0.189	S	C	.	.	H	α-helix	trans	-58.3	-36.6	176.6	55.8	0	0	0	0	113.8	S217 L223	S217-S219 PolarHBondContact O-N 2.81Å; S217-S219 PolarHBondContact OG-OG 3.31Å; S219-L223 WeakPolarHBondContact O-CB 3.39Å; S219-L223 PolarHBondContact O-N 3.36Å
220	K	93.3	Very high	93.4	Very high	63 Å²	63	44.4 Å²	44.4	27%	0.274	22%	0.216	S	C	.	.	H	α-helix	trans	-72.3	-40.3	177.6	-177.3	179.7	175.5	-165.6	0	110.8	H216 S217 L218 L223 R224	H216-K220 HydrophobicContact CB-CD 4.32Å; H216-K220 PolarHBondContact CE1-NZ 3.37Å; H216-K220 PolarHBondContact ND1-NZ 3.02Å; S217-K220 PolarHBondContact O-N 2.99Å; S217-K220 WeakPolarHBondContact OG-CB 3.29Å; S217-K220 PolarHBondContact OG-N 2.82Å; L218-K220 VanDerWaalsContact C-N 3.28Å; L218-K220 PolarHBondContact O-N 3.43Å; K220-L223 PolarHBondContact O-N 2.98Å; K220-R224 WeakPolarHBondContact O-CG 3.36Å; K220-R224 PolarHBondContact O-N 3.48Å
221	L	95.5	Very high	93.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-51.7	174.5	-61.9	176.7	0	0	0	110.4	K193 F196 L197 H216 S217 L218 L223 R224 F225 I258	K193-L221 HydrophobicContact CB-CD1 4.08Å; K193-L221 HydrophobicContact CD-CD1 4.38Å; K193-L221 HydrophobicContact CG-CD1 4.04Å; F196-L221 HydrophobicContact CD1-CB 4.05Å; F196-L221 HydrophobicContact CE1-CB 3.79Å; L197-L221 HydrophobicContact CD1-CD1 4.37Å; L197-L221 HydrophobicContact CG-CD1 4.49Å; H216-L221 HydrophobicContact CB-CD2 3.93Å; H216-L221 HydrophobicContact CB-CG 4.18Å; S217-L221 PolarHBondContact O-N 2.82Å; S217-L221 VanDerWaalsContact O-N 3.12Å; L218-L221 WeakPolarHBondContact O-CB 3.45Å; L218-L221 PolarHBondContact O-N 3.11Å; L218-L221 VanDerWaalsContact O-N 3.14Å; L221-L223 PolarHBondContact O-N 3.16Å; L221-R224 PolarHBondContact O-N 2.94Å; L221-F225 WeakPolarHBondContact O-CD2 3.36Å; L221-F225 PolarHBondContact O-N 3.06Å; L221-I258 HydrophobicContact CD2-CB 4.22Å; L221-I258 HydrophobicContact CD2-CG2 3.52Å
222	E	93.6	Very high	93.9	Very high	67 Å²	67	43 Å²	43	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-54.7	-49.5	176.7	-72.2	177.3	153.1	0	0	112	F196 L218 R224 E226	F196-E222 HydrophobicContact CD2-CG 3.98Å; F196-E222 HydrophobicContact CE1-CG 4.4Å; F196-E222 HydrophobicContact CE2-CB 4.39Å; F196-E222 HydrophobicContact CE2-CG 3.65Å; F196-E222 HydrophobicContact CZ-CB 4.27Å; F196-E222 HydrophobicContact CZ-CG 3.88Å; L218-E222 HydrophobicContact CD1-CG 4.19Å; L218-E222 HydrophobicContact CG-CG 4.32Å; L218-E222 WeakPolarHBondContact O-CG 3.37Å; L218-E222 PolarHBondContact O-N 3.49Å; E222-R224 PolarHBondContact O-N 3.31Å; E222-E226 WeakPolarHBondContact O-CB 3.17Å; E222-E226 PolarHBondContact O-N 3.25Å
223	L	94.1	Very high	94	Very high	24 Å²	24	39.8 Å²	39.8	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-48.6	-179.9	169.5	67.4	0	0	0	112.7	S219 K220 L221 C227 F280 M281 L284	S219-L223 WeakPolarHBondContact O-CB 3.39Å; S219-L223 PolarHBondContact O-N 3.36Å; K220-L223 PolarHBondContact O-N 2.98Å; L221-L223 PolarHBondContact O-N 3.16Å; L223-C227 VanDerWaalsContact O-CB 3.3Å; L223-C227 WeakPolarHBondContact O-CB 3.2Å; L223-C227 PolarHBondContact O-N 3.1Å; L223-F280 HydrophobicContact CD1-CD1 3.85Å; L223-F280 HydrophobicContact CD1-CE1 3.96Å; L223-M281 HydrophobicContact CD1-CB 4.31Å; L223-M281 HydrophobicContact CD1-CG 3.89Å; L223-M281 HydrophobicContact CD2-CB 4.33Å; L223-M281 HydrophobicContact CD2-CG 3.56Å; L223-M281 HydrophobicContact CD2-SD 3.76Å; L223-M281 HydrophobicContact CG-CG 4.23Å; L223-L284 VanDerWaalsContact CA-CD2 3.5Å; L223-L284 HydrophobicContact CB-CD2 3.89Å; L223-L284 HydrophobicContact CD1-CB 4.11Å; L223-L284 HydrophobicContact CD1-CD2 3.46Å; L223-L284 VanDerWaalsContact CD1-CD2 3.46Å; L223-L284 HydrophobicContact CD1-CG 4.41Å; L223-L284 HydrophobicContact CG-CD2 4.3Å
224	R	96.1	Very high	93.9	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-42.2	-176.9	-71	-160.4	179.9	-172.4	-1.8	111.6	K220 L221 E222 C227 A228 I257 I258 T260 D262 F265	K220-R224 WeakPolarHBondContact O-CG 3.36Å; K220-R224 PolarHBondContact O-N 3.48Å; L221-R224 PolarHBondContact O-N 2.94Å; E222-R224 PolarHBondContact O-N 3.31Å; R224-C227 PolarHBondContact O-N 3.48Å; R224-A228 WeakPolarHBondContact O-CB 3.36Å; R224-A228 PolarHBondContact O-N 3.45Å; R224-I257 HydrophobicContact CB-CG2 3.89Å; R224-I257 WeakPolarHBondContact CD-O 3.49Å; R224-I257 PolarHBondContact NH1-O 3.14Å; R224-I258 PolarHBondContact NH1-O 2.95Å; R224-T260 VanDerWaalsContact CZ-O 3.3Å; R224-T260 PolarHBondContact NH1-O 3.5Å; R224-T260 PolarHBondContact NH1-OG1 3.04Å; R224-T260 PolarHBondContact NH2-O 2.99Å; R224-D262 IonicContact CZ-OD1 2.78Å; R224-D262 IonicContact NE-OD1 3.41Å; R224-D262 IonicContact NH2-OD1 3.04Å; R224-D262 PolarHBondContact NH2-OD1 3.39Å; R224-F265 HydrophobicContact CB-CE1 4.2Å; R224-F265 HydrophobicContact CB-CE2 4.04Å; R224-F265 HydrophobicContact CB-CZ 3.79Å; R224-F265 HydrophobicContact CG-CD1 4.25Å; R224-F265 HydrophobicContact CG-CE1 4.03Å; R224-F265 HydrophobicContact CG-CE2 4.4Å; R224-F265 HydrophobicContact CG-CZ 4.11Å; R224-F265 VanDerWaalsContact O-CZ 3.24Å; R224-F265 WeakPolarHBondContact O-CZ 3.47Å
225	F	95.2	Very high	93.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-67.6	-41.3	176.9	-85.2	-76.9	0	0	0	112.6	F196 L197 I201 L203 L221 C227 A228 C229 Y234 L254 I257 I258	F196-F225 HydrophobicContact CE1-CD2 4.02Å; F196-F225 HydrophobicContact CZ-CB 4.14Å; F196-F225 HydrophobicContact CZ-CD2 4.45Å; L197-F225 HydrophobicContact CD2-CD2 4.23Å; L197-F225 HydrophobicContact CD2-CE2 3.58Å; L197-F225 HydrophobicContact CD2-CZ 4.18Å; I201-F225 HydrophobicContact CB-CD1 4.44Å; I201-F225 HydrophobicContact CD1-CB 3.63Å; I201-F225 HydrophobicContact CD1-CD1 3.96Å; I201-F225 HydrophobicContact CD1-CG 3.79Å; I201-F225 HydrophobicContact CG1-CB 4.28Å; I201-F225 HydrophobicContact CG1-CD1 4.08Å; I201-F225 HydrophobicContact CG1-CD2 4.27Å; I201-F225 HydrophobicContact CG1-CG 3.94Å; I201-F225 HydrophobicContact CG2-CD1 3.47Å; I201-F225 VanDerWaalsContact CG2-CD1 3.47Å; I201-F225 HydrophobicContact CG2-CE1 3.32Å; I201-F225 HydrophobicContact CG2-CG 4.17Å; I201-F225 HydrophobicContact CG2-CZ 3.91Å; L203-F225 HydrophobicContact CD1-CZ 4.08Å; L221-F225 WeakPolarHBondContact O-CD2 3.36Å; L221-F225 PolarHBondContact O-N 3.06Å; F225-C227 VanDerWaalsContact C-N 3.34Å; F225-C227 PolarHBondContact O-N 3.12Å; F225-A228 PolarHBondContact O-N 3.02Å; F225-C229 WeakPolarHBondContact O-CB 3.27Å; F225-C229 PolarHBondContact O-N 3.43Å; F225-C229 PolarHBondContact O-SG 3.22Å; F225-Y234 HydrophobicContact CD1-CD1 4.26Å; F225-Y234 HydrophobicContact CD1-CD2 4.43Å; F225-Y234 HydrophobicContact CD1-CE1 4.29Å; F225-Y234 HydrophobicContact CD1-CE2 4.46Å; F225-Y234 HydrophobicContact CD1-CG 4.35Å; F225-Y234 HydrophobicContact CE1-CD1 4.46Å; F225-Y234 HydrophobicContact CE1-CD2 4.06Å; F225-Y234 HydrophobicContact CE1-CE1 4.2Å; F225-Y234 AromaticContact CE1-CE2 3.76Å; F225-Y234 HydrophobicContact CE1-CE2 3.76Å; F225-Y234 HydrophobicContact CE1-CG 4.41Å; F225-Y234 AromaticContact CE1-CZ 3.85Å; F225-L254 HydrophobicContact CE2-CD1 3.81Å; F225-L254 HydrophobicContact CZ-CD1 3.63Å; F225-I257 HydrophobicContact CD1-CD1 4.11Å; F225-I257 HydrophobicContact CD2-CG2 4.23Å; F225-I257 HydrophobicContact CE1-CD1 3.32Å; F225-I257 HydrophobicContact CE1-CG2 4.36Å; F225-I257 HydrophobicContact CE2-CG2 3.98Å; F225-I257 HydrophobicContact CZ-CB 4.41Å; F225-I257 HydrophobicContact CZ-CD1 3.57Å; F225-I257 HydrophobicContact CZ-CG2 4.04Å; F225-I258 HydrophobicContact CE2-CG2 4.26Å
226	E	93.7	Very high	93.2	Very high	71 Å²	71	45.4 Å²	45.4	33%	0.332	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-43.7	175.4	-178.5	78.1	-171.7	0	0	111.1	E222 C229 R230 F280 L284	E222-E226 WeakPolarHBondContact O-CB 3.17Å; E222-E226 PolarHBondContact O-N 3.25Å; E226-C229 PolarHBondContact O-N 2.9Å; E226-R230 WeakPolarHBondContact O-CB 3.46Å; E226-R230 WeakPolarHBondContact O-CG 3.35Å; E226-R230 PolarHBondContact O-N 3.46Å; E226-R230 IonicContact OE1-CZ 2.61Å; E226-R230 IonicContact OE1-NE 3.11Å; E226-R230 PolarHBondContact OE1-NE 3.33Å; E226-R230 IonicContact OE1-NH2 2.68Å; E226-R230 PolarHBondContact OE1-NH2 2.86Å; E226-F280 HydrophobicContact CB-CZ 4.47Å; E226-F280 HydrophobicContact CG-CE1 4.36Å; E226-F280 HydrophobicContact CG-CZ 3.85Å; E226-L284 HydrophobicContact CB-CD2 4.33Å; E226-L284 HydrophobicContact CG-CD1 4.06Å; E226-L284 HydrophobicContact CG-CD2 4.45Å
227	C	95.3	Very high	92.3	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-49.5	176.4	-176.4	0	0	0	0	111.2	L223 R224 F225 C229 R230 C231 F265 Y277 F280	L223-C227 VanDerWaalsContact O-CB 3.3Å; L223-C227 WeakPolarHBondContact O-CB 3.2Å; L223-C227 PolarHBondContact O-N 3.1Å; R224-C227 PolarHBondContact O-N 3.48Å; F225-C227 VanDerWaalsContact C-N 3.34Å; F225-C227 PolarHBondContact O-N 3.12Å; C227-C229 VanDerWaalsContact C-N 3.31Å; C227-C229 PolarHBondContact O-N 3.38Å; C227-R230 PolarHBondContact O-N 3.31Å; C227-C231 WeakPolarHBondContact O-CB 3.41Å; C227-C231 PolarHBondContact O-N 3.21Å; C227-C231 PolarHBondContact O-SG 2.96Å; C227-C231 VanDerWaalsContact O-SG 3.39Å; C227-F265 HydrophobicContact CB-CE1 4.17Å; C227-F265 HydrophobicContact CB-CZ 4.25Å; C227-Y277 HydrophobicContact CB-CD2 4.5Å; C227-Y277 HydrophobicContact CB-CE2 4.17Å; C227-F280 HydrophobicContact CB-CD1 3.72Å; C227-F280 HydrophobicContact CB-CE1 3.51Å; C227-F280 HydrophobicContact CB-CZ 4.18Å
228	A	95.8	Very high	91	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-39.8	179.1	0	0	0	0	0	112.1	R224 F225 G232 A233 Y234 F265	R224-A228 WeakPolarHBondContact O-CB 3.36Å; R224-A228 PolarHBondContact O-N 3.45Å; F225-A228 PolarHBondContact O-N 3.02Å; A228-G232 PolarHBondContact O-N 3.48Å; A228-A233 HydrophobicContact CB-CB 4.44Å; A228-A233 WeakPolarHBondContact O-CA 3.34Å; A228-A233 WeakPolarHBondContact O-CB 3.32Å; A228-A233 PolarHBondContact O-N 2.96Å; A228-Y234 PolarHBondContact O-N 3.33Å; A228-Y234 VanDerWaalsContact O-N 3.1Å; A228-F265 HydrophobicContact CB-CE2 4.48Å; A228-F265 HydrophobicContact CB-CZ 4.33Å
229	C	93.4	Very high	89.5	Confident	37 Å²	37	49.4 Å²	49.4	25%	0.25	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-44.7	175.7	-65.9	0	0	0	0	112	F225 E226 C227 C231 G232 Y234	F225-C229 WeakPolarHBondContact O-CB 3.27Å; F225-C229 PolarHBondContact O-N 3.43Å; F225-C229 PolarHBondContact O-SG 3.22Å; E226-C229 PolarHBondContact O-N 2.9Å; C227-C229 VanDerWaalsContact C-N 3.31Å; C227-C229 PolarHBondContact O-N 3.38Å; C229-C231 VanDerWaalsContact C-N 3.34Å; C229-C231 PolarHBondContact O-N 3.48Å; C229-G232 PolarHBondContact O-N 2.98Å; C229-Y234 WeakPolarHBondContact CA-O 2.99Å
230	R	92.3	Very high	87.8	Confident	158 Å²	158	55.8 Å²	55.8	60%	0.596	29%	0.287	S	S	*	.	H	α-helix	trans	-70.3	-29.4	-179.4	-74.5	-176.5	-176.1	-152.1	7.4	114	E226 C227 G232 F280	E226-R230 WeakPolarHBondContact O-CB 3.46Å; E226-R230 WeakPolarHBondContact O-CG 3.35Å; E226-R230 PolarHBondContact O-N 3.46Å; E226-R230 IonicContact OE1-CZ 2.61Å; E226-R230 IonicContact OE1-NE 3.11Å; E226-R230 PolarHBondContact OE1-NE 3.33Å; E226-R230 IonicContact OE1-NH2 2.68Å; E226-R230 PolarHBondContact OE1-NH2 2.86Å; C227-R230 PolarHBondContact O-N 3.31Å; R230-G232 PolarHBondContact O-N 2.96Å; R230-F280 VanDerWaalsContact CD-CE2 3.5Å
231	C	93.3	Very high	86	Confident	54 Å²	54	55.7 Å²	55.7	37%	0.365	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-3.1	171.4	-67.3	0	0	0	0	112.6	C227 C229 A233 C270	C227-C231 WeakPolarHBondContact O-CB 3.41Å; C227-C231 PolarHBondContact O-N 3.21Å; C227-C231 PolarHBondContact O-SG 2.96Å; C227-C231 VanDerWaalsContact O-SG 3.39Å; C229-C231 VanDerWaalsContact C-N 3.34Å; C229-C231 PolarHBondContact O-N 3.48Å; C231-A233 PolarHBondContact O-N 3.07Å; C231-C270 HydrophobicContact CB-CB 4.06Å
232	G	91.3	Very high	84.2	Confident	67 Å²	67	59.2 Å²	59.2	69%	0.691	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	11.5	-175	0	0	0	0	0	113.9	A228 C229 R230	A228-G232 PolarHBondContact O-N 3.48Å; C229-G232 PolarHBondContact O-N 2.98Å; R230-G232 PolarHBondContact O-N 2.96Å
233	A	92.4	Very high	82.3	Confident	24 Å²	24	66.5 Å²	66.5	20%	0.198	33%	0.329	C	S	.	.	S	Bend	trans	-79.9	-21.1	179.1	0	0	0	0	0	112.8	A228 C231 P252 V269	A228-A233 HydrophobicContact CB-CB 4.44Å; A228-A233 WeakPolarHBondContact O-CA 3.34Å; A228-A233 WeakPolarHBondContact O-CB 3.32Å; A228-A233 PolarHBondContact O-N 2.96Å; C231-A233 PolarHBondContact O-N 3.07Å; A233-P252 WeakPolarHBondContact O-CD 3.38Å; A233-V269 HydrophobicContact CB-CG1 4.49Å; A233-V269 WeakPolarHBondContact CB-O 3.23Å
234	Y	93.5	Very high	80.5	Confident	12 Å²	12	69.7 Å²	69.7	5%	0.047	34%	0.343	C	S	.	.			trans	-134.1	132.5	177	-165.8	-83.7	0	0	0	110.2	I201 L203 F225 A228 C229 I236 N251 P252 I257	I201-Y234 HydrophobicContact CG2-CE1 3.68Å; L203-Y234 WeakPolarHBondContact CD2-OH 3.42Å; F225-Y234 HydrophobicContact CD1-CD1 4.26Å; F225-Y234 HydrophobicContact CD1-CD2 4.43Å; F225-Y234 HydrophobicContact CD1-CE1 4.29Å; F225-Y234 HydrophobicContact CD1-CE2 4.46Å; F225-Y234 HydrophobicContact CD1-CG 4.35Å; F225-Y234 HydrophobicContact CE1-CD1 4.46Å; F225-Y234 HydrophobicContact CE1-CD2 4.06Å; F225-Y234 HydrophobicContact CE1-CE1 4.2Å; F225-Y234 AromaticContact CE1-CE2 3.76Å; F225-Y234 HydrophobicContact CE1-CE2 3.76Å; F225-Y234 HydrophobicContact CE1-CG 4.41Å; F225-Y234 AromaticContact CE1-CZ 3.85Å; A228-Y234 PolarHBondContact O-N 3.33Å; A228-Y234 VanDerWaalsContact O-N 3.1Å; C229-Y234 WeakPolarHBondContact CA-O 2.99Å; Y234-I236 HydrophobicContact CD1-CG1 4.42Å; Y234-I236 HydrophobicContact CE1-CG1 4.41Å; Y234-N251 HydrophobicContact CD2-CB 3.92Å; Y234-N251 HydrophobicContact CE2-CB 3.71Å; Y234-P252 HydrophobicContact CD2-CG 4.07Å; Y234-I257 HydrophobicContact CD2-CD1 3.65Å; Y234-I257 HydrophobicContact CE2-CD1 3.89Å
235	E	89	Confident	78.8	Confident	91 Å²	91	73.2 Å²	73.2	43%	0.425	37%	0.372	S	S	.	.			trans	-109	123	173.4	-170.8	175.2	179.7	0	0	109.7	L237 N251	E235-L237 HydrophobicContact CG-CD2 4.47Å; E235-L237 PolarHBondContact O-N 2.67Å; E235-N251 PolarHBondContact N-OD1 3.14Å; E235-N251 PolarHBondContact O-ND2 3.36Å
236	I	85.3	Confident	77.1	Confident	85 Å²	85	78.1 Å²	78.1	44%	0.436	40%	0.395	S	S	.	.			trans	-72	112.7	174	-62.9	171.7	0	0	0	107.6	N200 I201 Y234	N200-I236 WeakPolarHBondContact O-CG2 3.41Å; I201-I236 HydrophobicContact CD1-CD1 4.35Å; Y234-I236 HydrophobicContact CD1-CG1 4.42Å; Y234-I236 HydrophobicContact CE1-CG1 4.41Å
237	L	74.6	Confident	75.4	Confident	13 Å²	13	76.1 Å²	76.1	7%	0.068	39%	0.387	C	S	.	.			trans	-82	124.6	-177.7	-55.5	178.2	0	0	0	110	E235 Q241 L247 A248	E235-L237 HydrophobicContact CG-CD2 4.47Å; E235-L237 PolarHBondContact O-N 2.67Å; L237-Q241 HydrophobicContact CB-CB 4.22Å; L237-Q241 HydrophobicContact CD2-CB 4.28Å; L237-L247 HydrophobicContact CD2-CB 3.6Å; L237-L247 HydrophobicContact CD2-CD1 4.27Å; L237-L247 HydrophobicContact CD2-CG 4.5Å; L237-A248 HydrophobicContact CD1-CB 3.77Å
238	D	68.3	Low	73.7	Confident	97 Å²	97	78 Å²	78	52%	0.519	40%	0.403	S	S	.	.			trans	-68.2	158.5	165.7	-172.7	14.9	0	0	0	110.3	R240 Q241 Q242	D238-R240 PolarHBondContact O-N 3.4Å; D238-Q241 CarbonylContact O-C 3.53Å; D238-Q241 WeakPolarHBondContact O-CA 3.36Å; D238-Q241 WeakPolarHBondContact O-CB 3.38Å; D238-Q241 PolarHBondContact O-N 2.79Å; D238-Q242 PolarHBondContact O-N 3.44Å
239	V	61.2	Low	72.4	Confident	99 Å²	99	86.6 Å²	86.6	60%	0.6	44%	0.44	S	S	*	.	H	α-helix	trans	-51.5	-33.3	-179.8	-178.5	0	0	0	0	111.8
240	R	57.2	Low	71.7	Confident	205 Å²	205	92 Å²	92	77%	0.774	46%	0.461	S	S	*	.	H	α-helix	trans	-70.6	-40.7	174.7	-68.9	-177.3	176.9	-172.1	0.3	112.9	D238	D238-R240 PolarHBondContact O-N 3.4Å
241	Q	54.9	Low	71.6	Confident	60 Å²	60	85.6 Å²	85.6	28%	0.28	44%	0.439	S	S	.	.	H	α-helix	trans	-74.9	-28	178.6	-68.3	176.2	-14.5	0	0	112	L237 D238 R243 Q244 L247	L237-Q241 HydrophobicContact CB-CB 4.22Å; L237-Q241 HydrophobicContact CD2-CB 4.28Å; D238-Q241 CarbonylContact O-C 3.53Å; D238-Q241 WeakPolarHBondContact O-CA 3.36Å; D238-Q241 WeakPolarHBondContact O-CB 3.38Å; D238-Q241 PolarHBondContact O-N 2.79Å; Q241-R243 PolarHBondContact O-N 3.48Å; Q241-Q244 CarbonylContact O-C 3.53Å; Q241-Q244 VanDerWaalsContact O-CA 3.3Å; Q241-Q244 WeakPolarHBondContact O-CA 3.21Å; Q241-Q244 VanDerWaalsContact O-CB 3.22Å; Q241-Q244 WeakPolarHBondContact O-CB 3.46Å; Q241-Q244 PolarHBondContact O-N 3.48Å; Q241-L247 HydrophobicContact CB-CD1 3.94Å; Q241-L247 HydrophobicContact CG-CD1 4.13Å
242	Q	57.4	Low	71.5	Confident	75 Å²	75	84.5 Å²	84.5	35%	0.35	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-29.4	177	-137.4	173	12.1	0	0	112.5	G202 D238 Q244	G202-Q242 PolarHBondContact O-NE2 3.13Å; D238-Q242 PolarHBondContact O-N 3.44Å; Q242-Q244 VanDerWaalsContact C-N 3.26Å; Q242-Q244 PolarHBondContact O-N 3.13Å
243	R	54.1	Low	71.5	Confident	220 Å²	220	87.4 Å²	87.4	83%	0.83	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-23.6	171.5	-61.1	-172.8	-169.8	-154.1	1.5	112.7	Q241 A245	Q241-R243 PolarHBondContact O-N 3.48Å; R243-A245 VanDerWaalsContact C-N 3.26Å; R243-A245 PolarHBondContact O-N 2.91Å
244	Q	56.2	Low	71.5	Confident	92 Å²	92	86.7 Å²	86.7	43%	0.43	42%	0.417	S	S	.	.			trans	-81.8	78.4	172.9	-55.8	-178.3	22.8	0	0	108.5	Q241 Q242 H246 L247	Q241-Q244 CarbonylContact O-C 3.53Å; Q241-Q244 VanDerWaalsContact O-CA 3.3Å; Q241-Q244 WeakPolarHBondContact O-CA 3.21Å; Q241-Q244 VanDerWaalsContact O-CB 3.22Å; Q241-Q244 WeakPolarHBondContact O-CB 3.46Å; Q241-Q244 PolarHBondContact O-N 3.48Å; Q242-Q244 VanDerWaalsContact C-N 3.26Å; Q242-Q244 PolarHBondContact O-N 3.13Å; Q244-H246 PolarHBondContact O-N 2.77Å; Q244-H246 PolarHBondContact OE1-CE1 3.46Å; Q244-H246 VanDerWaalsContact OE1-CE1 3.28Å; Q244-L247 HydrophobicContact CB-CD1 4.18Å; Q244-L247 PolarHBondContact O-N 2.79Å
245	A	60.3	Low	71.5	Confident	75 Å²	75	92.8 Å²	92.8	62%	0.62	44%	0.44	S	S	*	.	H	α-helix	trans	-51.4	-19	-176.7	0	0	0	0	0	114.8	R243 K249	R243-A245 VanDerWaalsContact C-N 3.26Å; R243-A245 PolarHBondContact O-N 2.91Å; A245-K249 PolarHBondContact O-N 3.44Å
246	H	60.4	Low	71.6	Confident	105 Å²	105	91.1 Å²	91.1	49%	0.486	43%	0.434	S	S	.	.	H	α-helix	trans	-67.1	-38.9	176	77.1	-87.5	0	0	0	113.1	Q244 K249 H250	Q244-H246 PolarHBondContact O-N 2.77Å; Q244-H246 PolarHBondContact OE1-CE1 3.46Å; Q244-H246 VanDerWaalsContact OE1-CE1 3.28Å; H246-K249 VanDerWaalsContact O-CB 3.27Å; H246-K249 WeakPolarHBondContact O-CB 3.44Å; H246-K249 PolarHBondContact O-N 3.12Å; H246-K249 VanDerWaalsContact O-N 3.16Å; H246-H250 PolarHBondContact O-CD2 3.39Å
247	L	57.4	Low	72.1	Confident	29 Å²	29	87 Å²	87	15%	0.152	41%	0.414	C	S	.	.	H	α-helix	trans	-67.5	-43	179	-67.7	165.8	0	0	0	110.9	L237 Q241 Q244 K249 H250	L237-L247 HydrophobicContact CD2-CB 3.6Å; L237-L247 HydrophobicContact CD2-CD1 4.27Å; L237-L247 HydrophobicContact CD2-CG 4.5Å; Q241-L247 HydrophobicContact CB-CD1 3.94Å; Q241-L247 HydrophobicContact CG-CD1 4.13Å; Q244-L247 HydrophobicContact CB-CD1 4.18Å; Q244-L247 PolarHBondContact O-N 2.79Å; L247-K249 PolarHBondContact O-N 3.4Å; L247-K249 VanDerWaalsContact O-N 3.12Å; L247-H250 PolarHBondContact O-N 2.95Å
248	A	60.5	Low	73	Confident	41 Å²	41	86.5 Å²	86.5	34%	0.339	41%	0.411	S	S	.	.	H	α-helix	trans	-60.8	-22.2	174.2	0	0	0	0	0	113.5	L237 H250	L237-A248 HydrophobicContact CD1-CB 3.77Å; A248-H250 VanDerWaalsContact C-N 3.32Å
249	K	67.5	Low	74.1	Confident	179 Å²	179	84.3 Å²	84.3	78%	0.778	40%	0.399	S	S	*	.	H	α-helix	trans	-75.1	-22	177.5	-163.1	179.6	177.7	-176.1	0	112.7	A245 H246 L247	A245-K249 PolarHBondContact O-N 3.44Å; H246-K249 VanDerWaalsContact O-CB 3.27Å; H246-K249 WeakPolarHBondContact O-CB 3.44Å; H246-K249 PolarHBondContact O-N 3.12Å; H246-K249 VanDerWaalsContact O-N 3.16Å; L247-K249 PolarHBondContact O-N 3.4Å; L247-K249 VanDerWaalsContact O-N 3.12Å
250	H	79.8	Confident	75.7	Confident	150 Å²	150	81.5 Å²	81.5	69%	0.694	38%	0.382	S	S	*	.	H	α-helix	trans	-88.2	-26.9	178.7	-69.3	-67.3	0	0	0	113	H246 L247 A248	H246-H250 PolarHBondContact O-CD2 3.39Å; L247-H250 PolarHBondContact O-N 2.95Å; A248-H250 VanDerWaalsContact C-N 3.32Å
251	N	89.9	Confident	77.5	Confident	24 Å²	24	75.1 Å²	75.1	13%	0.128	37%	0.369	C	S	.	.	S	Bend	trans	-65.5	135.6	178	-79.2	-5.1	0	0	0	111.9	Y234 E235	Y234-N251 HydrophobicContact CD2-CB 3.92Å; Y234-N251 HydrophobicContact CE2-CB 3.71Å; E235-N251 PolarHBondContact N-OD1 3.14Å; E235-N251 PolarHBondContact O-ND2 3.36Å
252	P	91.4	Very high	79.5	Confident	32 Å²	32	75.1 Å²	75.1	21%	0.208	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-61.1	150.4	174.1	20.9	-29.1	0	0	0	110.9	A233 Y234 I257 V269	A233-P252 WeakPolarHBondContact O-CD 3.38Å; Y234-P252 HydrophobicContact CD2-CG 4.07Å; P252-I257 HydrophobicContact CB-CG1 4.24Å; P252-I257 HydrophobicContact CG-CD1 4.04Å; P252-I257 HydrophobicContact CG-CG1 4.07Å; P252-V269 HydrophobicContact CB-CG1 4.13Å; P252-V269 HydrophobicContact CG-CG1 3.81Å
253	K	91	Very high	81.3	Confident	127 Å²	127	75.9 Å²	75.9	55%	0.552	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-68.3	148.5	-179.7	-60.7	174.9	177.9	175.6	0	109.4	R255 D256 I257	K253-R255 HydrophobicContact CB-CG 4.23Å; K253-R255 PolarHBondContact O-N 2.95Å; K253-R255 VanDerWaalsContact O-N 3.13Å; K253-D256 WeakPolarHBondContact CB-OD2 3.4Å; K253-D256 PolarHBondContact N-OD2 3.07Å; K253-D256 WeakPolarHBondContact O-CA 3.4Å; K253-D256 WeakPolarHBondContact O-CB 3.34Å; K253-D256 PolarHBondContact O-N 2.88Å; K253-I257 PolarHBondContact O-N 3.01Å
254	L	92.5	Very high	83.4	Confident	9 Å²	9	66.4 Å²	66.4	5%	0.047	34%	0.343	C	S	.	.	H	α-helix	trans	-49.1	-45.9	178.4	177.4	56.3	0	0	0	112.1	L197 L203 S211 F225 D256 I257 I258	L197-L254 HydrophobicContact CD1-CD2 4.49Å; L197-L254 HydrophobicContact CD2-CD1 4.11Å; L203-L254 HydrophobicContact CD1-CB 4.34Å; L203-L254 HydrophobicContact CD1-CD1 3.81Å; L203-L254 HydrophobicContact CD1-CD2 3.92Å; L203-L254 HydrophobicContact CD1-CG 4.25Å; S211-L254 WeakPolarHBondContact OG-CD2 3.32Å; F225-L254 HydrophobicContact CE2-CD1 3.81Å; F225-L254 HydrophobicContact CZ-CD1 3.63Å; L254-D256 VanDerWaalsContact C-N 3.29Å; L254-D256 PolarHBondContact O-N 3.47Å; L254-I257 WeakPolarHBondContact O-CB 3.27Å; L254-I257 PolarHBondContact O-N 3.33Å; L254-I257 VanDerWaalsContact O-N 3.11Å; L254-I258 HydrophobicContact CD1-CD1 3.95Å; L254-I258 HydrophobicContact CD1-CG1 4.35Å; L254-I258 HydrophobicContact CD1-CG2 3.79Å; L254-I258 HydrophobicContact CG-CD1 3.89Å; L254-I258 HydrophobicContact CG-CG1 4.4Å; L254-I258 WeakPolarHBondContact O-CG1 3.31Å; L254-I258 PolarHBondContact O-N 3.07Å
255	R	91.8	Very high	85.3	Confident	140 Å²	140	62 Å²	62	53%	0.528	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-34.7	177.2	75.8	-175.3	-174.3	-178.3	3.3	113.8	K253 I257 I258 D259	K253-R255 HydrophobicContact CB-CG 4.23Å; K253-R255 PolarHBondContact O-N 2.95Å; K253-R255 VanDerWaalsContact O-N 3.13Å; R255-I257 PolarHBondContact O-N 3.41Å; R255-I258 PolarHBondContact O-N 3.05Å; R255-D259 HydrophobicContact CB-CB 4.45Å; R255-D259 WeakPolarHBondContact O-CA 3.5Å; R255-D259 WeakPolarHBondContact O-CB 3.43Å; R255-D259 PolarHBondContact O-N 2.84Å
256	D	92.7	Very high	87.1	Confident	56 Å²	56	58.5 Å²	58.5	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-72.7	-28.5	-178.5	-53.8	-29.5	0	0	0	109.7	K253 L254 T260 V269	K253-D256 WeakPolarHBondContact CB-OD2 3.4Å; K253-D256 PolarHBondContact N-OD2 3.07Å; K253-D256 WeakPolarHBondContact O-CA 3.4Å; K253-D256 WeakPolarHBondContact O-CB 3.34Å; K253-D256 PolarHBondContact O-N 2.88Å; L254-D256 VanDerWaalsContact C-N 3.29Å; L254-D256 PolarHBondContact O-N 3.47Å; D256-T260 VanDerWaalsContact O-CG2 3.23Å; D256-T260 WeakPolarHBondContact O-CG2 3.4Å; D256-T260 PolarHBondContact O-OG1 2.97Å; D256-V269 HydrophobicContact CB-CG2 4.43Å; D256-V269 WeakPolarHBondContact O-CG2 3.21Å
257	I	95.2	Very high	88.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-76.7	-45.9	173.5	-57.7	172.2	0	0	0	111.1	R224 F225 Y234 P252 K253 L254 R255 F265 V269	R224-I257 HydrophobicContact CB-CG2 3.89Å; R224-I257 WeakPolarHBondContact CD-O 3.49Å; R224-I257 PolarHBondContact NH1-O 3.14Å; F225-I257 HydrophobicContact CD1-CD1 4.11Å; F225-I257 HydrophobicContact CD2-CG2 4.23Å; F225-I257 HydrophobicContact CE1-CD1 3.32Å; F225-I257 HydrophobicContact CE1-CG2 4.36Å; F225-I257 HydrophobicContact CE2-CG2 3.98Å; F225-I257 HydrophobicContact CZ-CB 4.41Å; F225-I257 HydrophobicContact CZ-CD1 3.57Å; F225-I257 HydrophobicContact CZ-CG2 4.04Å; Y234-I257 HydrophobicContact CD2-CD1 3.65Å; Y234-I257 HydrophobicContact CE2-CD1 3.89Å; P252-I257 HydrophobicContact CB-CG1 4.24Å; P252-I257 HydrophobicContact CG-CD1 4.04Å; P252-I257 HydrophobicContact CG-CG1 4.07Å; K253-I257 PolarHBondContact O-N 3.01Å; L254-I257 WeakPolarHBondContact O-CB 3.27Å; L254-I257 PolarHBondContact O-N 3.33Å; L254-I257 VanDerWaalsContact O-N 3.11Å; R255-I257 PolarHBondContact O-N 3.41Å; I257-F265 HydrophobicContact CG2-CE2 3.96Å; I257-V269 HydrophobicContact CG1-CG1 4.38Å
258	I	94.1	Very high	90.7	Very high	1 Å²	1	64 Å²	64	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-103.9	-33.8	-166.7	71.1	175.8	0	0	0	115	W213 H216 L221 R224 F225 L254 R255	W213-I258 HydrophobicContact CB-CD1 4.14Å; H216-I258 PolarHBondContact CE1-O 3.28Å; H216-I258 PolarHBondContact NE2-O 3.33Å; L221-I258 HydrophobicContact CD2-CB 4.22Å; L221-I258 HydrophobicContact CD2-CG2 3.52Å; R224-I258 PolarHBondContact NH1-O 2.95Å; F225-I258 HydrophobicContact CE2-CG2 4.26Å; L254-I258 HydrophobicContact CD1-CD1 3.95Å; L254-I258 HydrophobicContact CD1-CG1 4.35Å; L254-I258 HydrophobicContact CD1-CG2 3.79Å; L254-I258 HydrophobicContact CG-CD1 3.89Å; L254-I258 HydrophobicContact CG-CG1 4.4Å; L254-I258 WeakPolarHBondContact O-CG1 3.31Å; L254-I258 PolarHBondContact O-N 3.07Å; R255-I258 PolarHBondContact O-N 3.05Å
259	D	91.5	Very high	92.4	Very high	51 Å²	51	62.8 Å²	62.8	27%	0.273	30%	0.302	S	S	.	.	S	Bend	trans	-96.8	14	-171.3	-76.9	-1.8	0	0	0	112.7	R212 H216 R255	R212-D259 IonicContact CZ-OD2 3.89Å; R212-D259 IonicContact NE-OD2 3.71Å; R212-D259 PolarHBondContact NE-OD2 3.44Å; R212-D259 VanDerWaalsContact NH2-CG 3.33Å; R212-D259 IonicContact NH2-OD1 3.19Å; R212-D259 IonicContact NH2-OD2 3.88Å; R212-D259 PolarHBondContact NH2-OD2 2.96Å; H216-D259 IonicContact CD2-OD1 2.75Å; H216-D259 IonicContact CE1-OD1 2.72Å; H216-D259 IonicContact NE2-OD1 3.59Å; H216-D259 PolarHBondContact NE2-OD1 3.22Å; R255-D259 HydrophobicContact CB-CB 4.45Å; R255-D259 WeakPolarHBondContact O-CA 3.5Å; R255-D259 WeakPolarHBondContact O-CB 3.43Å; R255-D259 PolarHBondContact O-N 2.84Å
260	T	93.6	Very high	93.7	Very high	41 Å²	41	54.6 Å²	54.6	25%	0.252	27%	0.267	S	S	.	.	S	Bend	trans	-103	156.7	176.5	51.3	0	0	0	0	111.7	R224 D256	R224-T260 VanDerWaalsContact CZ-O 3.3Å; R224-T260 PolarHBondContact NH1-O 3.5Å; R224-T260 PolarHBondContact NH1-OG1 3.04Å; R224-T260 PolarHBondContact NH2-O 2.99Å; D256-T260 VanDerWaalsContact O-CG2 3.23Å; D256-T260 WeakPolarHBondContact O-CG2 3.4Å; D256-T260 PolarHBondContact O-OG1 2.97Å
261	S	95.6	Very high	94.5	Very high	71 Å²	71	54.9 Å²	54.9	50%	0.497	27%	0.268	S	S	.	.			trans	-62.9	157	169.1	68.5	0	0	0	0	110.4	E263 A264 F265	S261-E263 PolarHBondContact O-N 2.93Å; S261-A264 PolarHBondContact O-N 3.46Å; S261-A264 VanDerWaalsContact O-N 3.16Å; S261-A264 VanDerWaalsContact OG-CB 3.3Å; S261-A264 WeakPolarHBondContact OG-CB 3.18Å; S261-A264 PolarHBondContact OG-N 2.93Å; S261-F265 WeakPolarHBondContact O-CB 3.43Å; S261-F265 PolarHBondContact O-N 3.46Å
262	D	96.2	Very high	94.8	Very high	59 Å²	59	55.2 Å²	55.2	32%	0.316	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-38.5	179.3	-72.3	-18.6	0	0	0	112.3	R224 F265 A266 M274 Y277	R224-D262 IonicContact CZ-OD1 2.78Å; R224-D262 IonicContact NE-OD1 3.41Å; R224-D262 IonicContact NH2-OD1 3.04Å; R224-D262 PolarHBondContact NH2-OD1 3.39Å; D262-F265 PolarHBondContact O-N 3.36Å; D262-A266 VanDerWaalsContact O-CB 3.3Å; D262-A266 WeakPolarHBondContact O-CB 3.39Å; D262-A266 PolarHBondContact O-N 2.88Å; D262-M274 HydrophobicContact CB-CE 3.74Å; D262-M274 HydrophobicContact CB-SD 4.19Å; D262-Y277 HydrophobicContact CB-CD1 4.21Å; D262-Y277 HydrophobicContact CB-CE1 3.77Å
263	E	96.3	Very high	95.1	Very high	91 Å²	91	56.1 Å²	56.1	43%	0.425	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-43.2	176.6	-177.6	-178.2	179.4	0	0	112.2	S261 R267 M274	S261-E263 PolarHBondContact O-N 2.93Å; E263-R267 VanDerWaalsContact CD-NH1 3.32Å; E263-R267 VanDerWaalsContact CG-CZ 3.4Å; E263-R267 PolarHBondContact O-N 2.93Å; E263-R267 VanDerWaalsContact O-N 3.09Å; E263-R267 IonicContact OE1-CZ 3.69Å; E263-R267 IonicContact OE1-NH1 3.52Å; E263-R267 PolarHBondContact OE1-NH1 2.97Å; E263-R267 IonicContact OE1-NH2 2.74Å; E263-R267 PolarHBondContact OE1-NH2 3.43Å; E263-M274 HydrophobicContact CB-SD 4.26Å
264	A	97	Very high	95.4	Very high	22 Å²	22	52.3 Å²	52.3	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-69	-39.2	177.3	0	0	0	0	0	111.6	S261 H268	S261-A264 PolarHBondContact O-N 3.46Å; S261-A264 VanDerWaalsContact O-N 3.16Å; S261-A264 VanDerWaalsContact OG-CB 3.3Å; S261-A264 WeakPolarHBondContact OG-CB 3.18Å; S261-A264 PolarHBondContact OG-N 2.93Å; A264-H268 WeakPolarHBondContact CA-ND1 3.36Å; A264-H268 VanDerWaalsContact O-CB 3.23Å; A264-H268 WeakPolarHBondContact O-CB 3.41Å; A264-H268 PolarHBondContact O-N 3.09Å; A264-H268 PolarHBondContact O-ND1 3.4Å
265	F	97.7	Very high	95.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-59.6	-52.8	173.2	170.8	-103.7	0	0	0	111	R224 C227 A228 I257 S261 D262 R267 V269 C270 Y277	R224-F265 HydrophobicContact CB-CE1 4.2Å; R224-F265 HydrophobicContact CB-CE2 4.04Å; R224-F265 HydrophobicContact CB-CZ 3.79Å; R224-F265 HydrophobicContact CG-CD1 4.25Å; R224-F265 HydrophobicContact CG-CE1 4.03Å; R224-F265 HydrophobicContact CG-CE2 4.4Å; R224-F265 HydrophobicContact CG-CZ 4.11Å; R224-F265 VanDerWaalsContact O-CZ 3.24Å; R224-F265 WeakPolarHBondContact O-CZ 3.47Å; C227-F265 HydrophobicContact CB-CE1 4.17Å; C227-F265 HydrophobicContact CB-CZ 4.25Å; A228-F265 HydrophobicContact CB-CE2 4.48Å; A228-F265 HydrophobicContact CB-CZ 4.33Å; I257-F265 HydrophobicContact CG2-CE2 3.96Å; S261-F265 WeakPolarHBondContact O-CB 3.43Å; S261-F265 PolarHBondContact O-N 3.46Å; D262-F265 PolarHBondContact O-N 3.36Å; F265-R267 PolarHBondContact O-N 3.44Å; F265-V269 HydrophobicContact CD2-CB 3.91Å; F265-V269 HydrophobicContact CD2-CG1 4.21Å; F265-V269 HydrophobicContact CD2-CG2 4.08Å; F265-V269 HydrophobicContact CE2-CB 4.08Å; F265-V269 HydrophobicContact CE2-CG1 3.92Å; F265-V269 WeakPolarHBondContact O-CA 3.24Å; F265-V269 VanDerWaalsContact O-CB 3.28Å; F265-V269 WeakPolarHBondContact O-CB 2.92Å; F265-V269 PolarHBondContact O-N 2.76Å; F265-C270 WeakPolarHBondContact CZ-SG 3.3Å; F265-C270 PolarHBondContact O-N 2.71Å; F265-C270 VanDerWaalsContact O-N 3.14Å; F265-Y277 HydrophobicContact CD1-CD2 4.31Å; F265-Y277 HydrophobicContact CD1-CE1 4.26Å; F265-Y277 AromaticContact CD1-CE2 3.79Å; F265-Y277 HydrophobicContact CD1-CE2 3.79Å; F265-Y277 AromaticContact CD1-CZ 3.75Å; F265-Y277 HydrophobicContact CE1-CD2 4.07Å; F265-Y277 AromaticContact CE1-CE2 3.47Å; F265-Y277 HydrophobicContact CE1-CE2 3.47Å; F265-Y277 VanDerWaalsContact CE1-CE2 3.47Å; F265-Y277 AromaticContact CE1-CZ 3.85Å
266	A	97.6	Very high	95.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-57.2	-50	-178.7	0	0	0	0	0	112.2	D262 C270 H271 I272 Y277	D262-A266 VanDerWaalsContact O-CB 3.3Å; D262-A266 WeakPolarHBondContact O-CB 3.39Å; D262-A266 PolarHBondContact O-N 2.88Å; A266-C270 CarbonylContact O-C 3.43Å; A266-C270 PolarHBondContact O-N 2.75Å; A266-H271 PolarHBondContact O-N 3.02Å; A266-I272 CarbonylContact C-O 3.3Å; A266-I272 VanDerWaalsContact C-O 3.3Å; A266-I272 HydrophobicContact CB-CG1 4.15Å; A266-I272 PolarHBondContact O-N 3.4Å; A266-Y277 HydrophobicContact CB-CD1 4.3Å; A266-Y277 HydrophobicContact CB-CG 4.05Å
267	R	96.8	Very high	95.9	Very high	118 Å²	118	53.2 Å²	53.2	45%	0.445	27%	0.269	S	S	.	.	I	π-helix	trans	-77.4	-44.1	-175.8	-67.9	-166.2	-160.8	115.5	6.3	114.2	E263 F265 H271	E263-R267 VanDerWaalsContact CD-NH1 3.32Å; E263-R267 VanDerWaalsContact CG-CZ 3.4Å; E263-R267 PolarHBondContact O-N 2.93Å; E263-R267 VanDerWaalsContact O-N 3.09Å; E263-R267 IonicContact OE1-CZ 3.69Å; E263-R267 IonicContact OE1-NH1 3.52Å; E263-R267 PolarHBondContact OE1-NH1 2.97Å; E263-R267 IonicContact OE1-NH2 2.74Å; E263-R267 PolarHBondContact OE1-NH2 3.43Å; F265-R267 PolarHBondContact O-N 3.44Å; R267-H271 WeakPolarHBondContact O-CA 3.39Å; R267-H271 PolarHBondContact O-ND1 2.91Å; R267-H271 VanDerWaalsContact O-ND1 3.13Å
268	H	95.8	Very high	96	Very high	133 Å²	133	59.7 Å²	59.7	62%	0.616	29%	0.294	S	S	*	.	I	π-helix	trans	-95	-25.7	-168.1	-50.9	118.9	0	0	0	113.2	A264	A264-H268 WeakPolarHBondContact CA-ND1 3.36Å; A264-H268 VanDerWaalsContact O-CB 3.23Å; A264-H268 WeakPolarHBondContact O-CB 3.41Å; A264-H268 PolarHBondContact O-N 3.09Å; A264-H268 PolarHBondContact O-ND1 3.4Å
269	V	96.2	Very high	96	Very high	15 Å²	15	63.6 Å²	63.6	9%	0.091	31%	0.314	C	S	.	.	I	π-helix	trans	-98.2	-52.9	176.9	-178.6	0	0	0	0	110	A233 P252 D256 I257 F265	A233-V269 HydrophobicContact CB-CG1 4.49Å; A233-V269 WeakPolarHBondContact CB-O 3.23Å; P252-V269 HydrophobicContact CB-CG1 4.13Å; P252-V269 HydrophobicContact CG-CG1 3.81Å; D256-V269 HydrophobicContact CB-CG2 4.43Å; D256-V269 WeakPolarHBondContact O-CG2 3.21Å; I257-V269 HydrophobicContact CG1-CG1 4.38Å; F265-V269 HydrophobicContact CD2-CB 3.91Å; F265-V269 HydrophobicContact CD2-CG1 4.21Å; F265-V269 HydrophobicContact CD2-CG2 4.08Å; F265-V269 HydrophobicContact CE2-CB 4.08Å; F265-V269 HydrophobicContact CE2-CG1 3.92Å; F265-V269 WeakPolarHBondContact O-CA 3.24Å; F265-V269 VanDerWaalsContact O-CB 3.28Å; F265-V269 WeakPolarHBondContact O-CB 2.92Å; F265-V269 PolarHBondContact O-N 2.76Å
270	C	96	Very high	96.1	Very high	6 Å²	6	62.5 Å²	62.5	4%	0.041	31%	0.307	C	S	.	.	S	Bend	trans	-91.9	-11.1	-173.9	-65.6	0	0	0	0	114.7	C231 F265 A266 I272	C231-C270 HydrophobicContact CB-CB 4.06Å; F265-C270 WeakPolarHBondContact CZ-SG 3.3Å; F265-C270 PolarHBondContact O-N 2.71Å; F265-C270 VanDerWaalsContact O-N 3.14Å; A266-C270 CarbonylContact O-C 3.43Å; A266-C270 PolarHBondContact O-N 2.75Å; C270-I272 HydrophobicContact CB-CD1 4.13Å; C270-I272 HydrophobicContact CB-CG1 3.86Å; C270-I272 PolarHBondContact O-N 3.06Å
271	H	96	Very high	96	Very high	156 Å²	156	62.7 Å²	62.7	72%	0.722	31%	0.305	S	S	*	.			trans	53.7	37.2	-175.9	-56.3	-55.2	0	0	0	114.4	A266 R267	A266-H271 PolarHBondContact O-N 3.02Å; R267-H271 WeakPolarHBondContact O-CA 3.39Å; R267-H271 PolarHBondContact O-ND1 2.91Å; R267-H271 VanDerWaalsContact O-ND1 3.13Å
272	I	97	Very high	95.8	Very high	32 Å²	32	65.4 Å²	65.4	16%	0.164	31%	0.313	C	S	.	.			trans	-118.5	161.2	175	62	176.6	0	0	0	110.8	A266 C270 E276 Y277	A266-I272 CarbonylContact C-O 3.3Å; A266-I272 VanDerWaalsContact C-O 3.3Å; A266-I272 HydrophobicContact CB-CG1 4.15Å; A266-I272 PolarHBondContact O-N 3.4Å; C270-I272 HydrophobicContact CB-CD1 4.13Å; C270-I272 HydrophobicContact CB-CG1 3.86Å; C270-I272 PolarHBondContact O-N 3.06Å; I272-E276 HydrophobicContact CB-CB 4.18Å; I272-E276 HydrophobicContact CD1-CB 4.38Å; I272-Y277 HydrophobicContact CD1-CD2 4.39Å
273	S	96.5	Very high	95.5	Very high	51 Å²	51	68 Å²	68	36%	0.357	33%	0.327	S	S	.	.			trans	-67.9	156.2	171.4	68.5	0	0	0	0	111.4	E275 E276 Y277	S273-E275 PolarHBondContact O-N 2.94Å; S273-E276 VanDerWaalsContact CB-OE2 3.32Å; S273-E276 WeakPolarHBondContact CB-OE2 3.4Å; S273-E276 PolarHBondContact N-OE2 3.35Å; S273-E276 PolarHBondContact O-N 3.01Å; S273-E276 WeakPolarHBondContact OG-CB 3.3Å; S273-E276 VanDerWaalsContact OG-CD 3.29Å; S273-E276 VanDerWaalsContact OG-CG 3.25Å; S273-E276 WeakPolarHBondContact OG-CG 3.3Å; S273-E276 PolarHBondContact OG-N 3.29Å; S273-E276 VanDerWaalsContact OG-N 3.15Å; S273-E276 PolarHBondContact OG-OE2 3.11Å; S273-Y277 PolarHBondContact O-N 3.24Å; S273-Y277 VanDerWaalsContact O-N 3.07Å
274	M	96.9	Very high	95	Very high	46 Å²	46	64.3 Å²	64.3	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-30.5	173.9	-176.2	59.4	-173.9	0	0	111.5	D262 E263 Y277 R278	D262-M274 HydrophobicContact CB-CE 3.74Å; D262-M274 HydrophobicContact CB-SD 4.19Å; E263-M274 HydrophobicContact CB-SD 4.26Å; M274-Y277 HydrophobicContact CE-CD1 4.49Å; M274-Y277 PolarHBondContact O-N 3.46Å; M274-Y277 HydrophobicContact SD-CD1 4.12Å; M274-R278 HydrophobicContact CE-CG 4.05Å; M274-R278 VanDerWaalsContact O-CG 3.26Å; M274-R278 WeakPolarHBondContact O-CG 3.32Å; M274-R278 PolarHBondContact O-N 2.86Å
275	E	96	Very high	94.4	Very high	118 Å²	118	69.4 Å²	69.4	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-68.9	-45.7	177.9	-171.5	57.5	-157	0	0	111.8	S273 Y277 R278 I279	S273-E275 PolarHBondContact O-N 2.94Å; E275-Y277 VanDerWaalsContact C-N 3.28Å; E275-Y277 PolarHBondContact O-N 2.93Å; E275-R278 PolarHBondContact O-N 3.47Å; E275-R278 VanDerWaalsContact O-N 3.13Å; E275-I279 HydrophobicContact CG-CD1 4.31Å; E275-I279 WeakPolarHBondContact O-CG1 3.49Å; E275-I279 PolarHBondContact O-N 2.88Å
276	E	95.9	Very high	93.7	Very high	105 Å²	105	72 Å²	72	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-59.5	-41.4	173.8	-72.6	161.9	134.9	0	0	111.5	I272 S273 I279 F280	I272-E276 HydrophobicContact CB-CB 4.18Å; I272-E276 HydrophobicContact CD1-CB 4.38Å; S273-E276 VanDerWaalsContact CB-OE2 3.32Å; S273-E276 WeakPolarHBondContact CB-OE2 3.4Å; S273-E276 PolarHBondContact N-OE2 3.35Å; S273-E276 PolarHBondContact O-N 3.01Å; S273-E276 WeakPolarHBondContact OG-CB 3.3Å; S273-E276 VanDerWaalsContact OG-CD 3.29Å; S273-E276 VanDerWaalsContact OG-CG 3.25Å; S273-E276 WeakPolarHBondContact OG-CG 3.3Å; S273-E276 PolarHBondContact OG-N 3.29Å; S273-E276 VanDerWaalsContact OG-N 3.15Å; S273-E276 PolarHBondContact OG-OE2 3.11Å; E276-I279 PolarHBondContact O-N 2.93Å; E276-F280 WeakPolarHBondContact O-CB 3.33Å; E276-F280 PolarHBondContact O-N 3.43Å
277	Y	97	Very high	93	Very high	1 Å²	1	73.9 Å²	73.9	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-41.6	175.2	-176.9	-120.3	0	0	0	112	C227 D262 F265 A266 I272 S273 M274 E275 I279 F280 M281	C227-Y277 HydrophobicContact CB-CD2 4.5Å; C227-Y277 HydrophobicContact CB-CE2 4.17Å; D262-Y277 HydrophobicContact CB-CD1 4.21Å; D262-Y277 HydrophobicContact CB-CE1 3.77Å; F265-Y277 HydrophobicContact CD1-CD2 4.31Å; F265-Y277 HydrophobicContact CD1-CE1 4.26Å; F265-Y277 AromaticContact CD1-CE2 3.79Å; F265-Y277 HydrophobicContact CD1-CE2 3.79Å; F265-Y277 AromaticContact CD1-CZ 3.75Å; F265-Y277 HydrophobicContact CE1-CD2 4.07Å; F265-Y277 AromaticContact CE1-CE2 3.47Å; F265-Y277 HydrophobicContact CE1-CE2 3.47Å; F265-Y277 VanDerWaalsContact CE1-CE2 3.47Å; F265-Y277 AromaticContact CE1-CZ 3.85Å; A266-Y277 HydrophobicContact CB-CD1 4.3Å; A266-Y277 HydrophobicContact CB-CG 4.05Å; I272-Y277 HydrophobicContact CD1-CD2 4.39Å; S273-Y277 PolarHBondContact O-N 3.24Å; S273-Y277 VanDerWaalsContact O-N 3.07Å; M274-Y277 HydrophobicContact CE-CD1 4.49Å; M274-Y277 PolarHBondContact O-N 3.46Å; M274-Y277 HydrophobicContact SD-CD1 4.12Å; E275-Y277 VanDerWaalsContact C-N 3.28Å; E275-Y277 PolarHBondContact O-N 2.93Å; Y277-I279 PolarHBondContact O-N 3.31Å; Y277-F280 WeakPolarHBondContact O-CB 3.47Å; Y277-F280 PolarHBondContact O-N 2.85Å; Y277-M281 HydrophobicContact CD1-CE 3.95Å; Y277-M281 HydrophobicContact CD1-SD 4.32Å; Y277-M281 HydrophobicContact CE1-CE 3.88Å; Y277-M281 HydrophobicContact CE1-CG 4.15Å; Y277-M281 HydrophobicContact CE1-SD 3.71Å; Y277-M281 HydrophobicContact CE2-CG 4.22Å; Y277-M281 WeakPolarHBondContact O-CG 3.46Å; Y277-M281 PolarHBondContact O-N 2.77Å
278	R	95.8	Very high	91.9	Very high	136 Å²	136	70.6 Å²	70.6	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-44.3	175.1	-72.3	174.9	86	100	4.1	112.3	M274 E275 F280 M281 L282	M274-R278 HydrophobicContact CE-CG 4.05Å; M274-R278 VanDerWaalsContact O-CG 3.26Å; M274-R278 WeakPolarHBondContact O-CG 3.32Å; M274-R278 PolarHBondContact O-N 2.86Å; E275-R278 PolarHBondContact O-N 3.47Å; E275-R278 VanDerWaalsContact O-N 3.13Å; R278-F280 VanDerWaalsContact C-N 3.28Å; R278-F280 PolarHBondContact O-N 3.13Å; R278-M281 HydrophobicContact CB-CE 4.3Å; R278-M281 HydrophobicContact CG-CE 3.87Å; R278-M281 WeakPolarHBondContact O-CB 3.36Å; R278-M281 PolarHBondContact O-N 2.85Å; R278-L282 WeakPolarHBondContact O-CG 3.26Å; R278-L282 PolarHBondContact O-N 3.47Å; R278-L282 VanDerWaalsContact O-N 3.12Å
279	I	94.2	Very high	91.1	Very high	83 Å²	83	68.7 Å²	68.7	43%	0.426	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-42.8	174.9	-66.3	167.4	0	0	0	109.9	E275 E276 Y277 M281 L282 L283	E275-I279 HydrophobicContact CG-CD1 4.31Å; E275-I279 WeakPolarHBondContact O-CG1 3.49Å; E275-I279 PolarHBondContact O-N 2.88Å; E276-I279 PolarHBondContact O-N 2.93Å; Y277-I279 PolarHBondContact O-N 3.31Å; I279-M281 PolarHBondContact O-N 2.8Å; I279-L282 PolarHBondContact O-N 2.99Å; I279-L283 HydrophobicContact CG2-CD1 3.97Å; I279-L283 HydrophobicContact CG2-CG 4.33Å; I279-L283 WeakPolarHBondContact O-CG 3.45Å; I279-L283 PolarHBondContact O-N 3.29Å
280	F	93.4	Very high	90.3	Very high	29 Å²	29	75 Å²	75	13%	0.127	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-45.3	176.4	-171.4	-93.6	0	0	0	112.5	L223 E226 C227 R230 E276 Y277 R278 L282 L283 L284	L223-F280 HydrophobicContact CD1-CD1 3.85Å; L223-F280 HydrophobicContact CD1-CE1 3.96Å; E226-F280 HydrophobicContact CB-CZ 4.47Å; E226-F280 HydrophobicContact CG-CE1 4.36Å; E226-F280 HydrophobicContact CG-CZ 3.85Å; C227-F280 HydrophobicContact CB-CD1 3.72Å; C227-F280 HydrophobicContact CB-CE1 3.51Å; C227-F280 HydrophobicContact CB-CZ 4.18Å; R230-F280 VanDerWaalsContact CD-CE2 3.5Å; E276-F280 WeakPolarHBondContact O-CB 3.33Å; E276-F280 PolarHBondContact O-N 3.43Å; Y277-F280 WeakPolarHBondContact O-CB 3.47Å; Y277-F280 PolarHBondContact O-N 2.85Å; R278-F280 VanDerWaalsContact C-N 3.28Å; R278-F280 PolarHBondContact O-N 3.13Å; F280-L282 VanDerWaalsContact C-N 3.33Å; F280-L282 PolarHBondContact O-N 2.74Å; F280-L283 PolarHBondContact O-N 3.31Å; F280-L284 HydrophobicContact CE1-CB 4.37Å; F280-L284 HydrophobicContact CE1-CD2 4.32Å; F280-L284 WeakPolarHBondContact O-CB 3.34Å; F280-L284 PolarHBondContact O-N 2.72Å
281	M	92.3	Very high	89.3	Confident	45 Å²	45	82.5 Å²	82.5	22%	0.222	40%	0.403	C	S	.	.	H	α-helix	trans	-57.2	-45.8	175.8	-66.6	-165.5	-80.3	0	0	111.9	L223 Y277 R278 I279 L284 H285	L223-M281 HydrophobicContact CD1-CB 4.31Å; L223-M281 HydrophobicContact CD1-CG 3.89Å; L223-M281 HydrophobicContact CD2-CB 4.33Å; L223-M281 HydrophobicContact CD2-CG 3.56Å; L223-M281 HydrophobicContact CD2-SD 3.76Å; L223-M281 HydrophobicContact CG-CG 4.23Å; Y277-M281 HydrophobicContact CD1-CE 3.95Å; Y277-M281 HydrophobicContact CD1-SD 4.32Å; Y277-M281 HydrophobicContact CE1-CE 3.88Å; Y277-M281 HydrophobicContact CE1-CG 4.15Å; Y277-M281 HydrophobicContact CE1-SD 3.71Å; Y277-M281 HydrophobicContact CE2-CG 4.22Å; Y277-M281 WeakPolarHBondContact O-CG 3.46Å; Y277-M281 PolarHBondContact O-N 2.77Å; R278-M281 HydrophobicContact CB-CE 4.3Å; R278-M281 HydrophobicContact CG-CE 3.87Å; R278-M281 WeakPolarHBondContact O-CB 3.36Å; R278-M281 PolarHBondContact O-N 2.85Å; I279-M281 PolarHBondContact O-N 2.8Å; M281-L284 PolarHBondContact O-N 2.89Å; M281-H285 VanDerWaalsContact O-CB 3.27Å; M281-H285 WeakPolarHBondContact O-CB 3.43Å; M281-H285 PolarHBondContact O-N 3.18Å
282	L	91.5	Very high	88.3	Confident	127 Å²	127	82.3 Å²	82.3	67%	0.665	40%	0.4	S	S	*	.	H	α-helix	trans	-63	-44.6	178.6	-68.4	173.1	0	0	0	111.6	R278 I279 F280 A286	R278-L282 WeakPolarHBondContact O-CG 3.26Å; R278-L282 PolarHBondContact O-N 3.47Å; R278-L282 VanDerWaalsContact O-N 3.12Å; I279-L282 PolarHBondContact O-N 2.99Å; F280-L282 VanDerWaalsContact C-N 3.33Å; F280-L282 PolarHBondContact O-N 2.74Å; L282-A286 WeakPolarHBondContact O-CB 3.5Å; L282-A286 PolarHBondContact O-N 3.47Å
283	L	89.5	Confident	87.3	Confident	113 Å²	113	84.8 Å²	84.8	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-64.9	-44.3	178.3	-70.7	175.1	0	0	0	112	I279 F280 A286 S287	I279-L283 HydrophobicContact CG2-CD1 3.97Å; I279-L283 HydrophobicContact CG2-CG 4.33Å; I279-L283 WeakPolarHBondContact O-CG 3.45Å; I279-L283 PolarHBondContact O-N 3.29Å; F280-L283 PolarHBondContact O-N 3.31Å; L283-A286 PolarHBondContact O-N 2.86Å; L283-S287 WeakPolarHBondContact O-CB 3.42Å; L283-S287 PolarHBondContact O-N 3.45Å
284	L	85.6	Confident	86.5	Confident	14 Å²	14	84.9 Å²	84.9	7%	0.073	41%	0.411	C	S	.	.	H	α-helix	trans	-65.6	-45.9	178.7	-171.6	67.7	0	0	0	110.7	L223 E226 F280 M281 A286 S287 L288	L223-L284 VanDerWaalsContact CA-CD2 3.5Å; L223-L284 HydrophobicContact CB-CD2 3.89Å; L223-L284 HydrophobicContact CD1-CB 4.11Å; L223-L284 HydrophobicContact CD1-CD2 3.46Å; L223-L284 VanDerWaalsContact CD1-CD2 3.46Å; L223-L284 HydrophobicContact CD1-CG 4.41Å; L223-L284 HydrophobicContact CG-CD2 4.3Å; E226-L284 HydrophobicContact CB-CD2 4.33Å; E226-L284 HydrophobicContact CG-CD1 4.06Å; E226-L284 HydrophobicContact CG-CD2 4.45Å; F280-L284 HydrophobicContact CE1-CB 4.37Å; F280-L284 HydrophobicContact CE1-CD2 4.32Å; F280-L284 WeakPolarHBondContact O-CB 3.34Å; F280-L284 PolarHBondContact O-N 2.72Å; M281-L284 PolarHBondContact O-N 2.89Å; L284-A286 VanDerWaalsContact C-N 3.32Å; L284-A286 PolarHBondContact O-N 3.47Å; L284-S287 PolarHBondContact O-N 2.85Å; L284-S287 VanDerWaalsContact O-N 3.09Å; L284-S287 PolarHBondContact O-OG 3.16Å; L284-L288 HydrophobicContact CG-CD1 4.15Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CG 3.35Å; L284-L288 PolarHBondContact O-N 3.28Å
285	H	83.9	Confident	85.4	Confident	130 Å²	130	85.6 Å²	85.6	60%	0.602	42%	0.424	S	S	*	.	H	α-helix	trans	-58.4	-44.6	177.2	-174.6	-114.2	0	0	0	111.7	M281 S287 L288 L289	M281-H285 VanDerWaalsContact O-CB 3.27Å; M281-H285 WeakPolarHBondContact O-CB 3.43Å; M281-H285 PolarHBondContact O-N 3.18Å; H285-S287 VanDerWaalsContact C-N 3.33Å; H285-S287 PolarHBondContact O-N 3.26Å; H285-L288 PolarHBondContact O-N 3.41Å; H285-L289 WeakPolarHBondContact O-CB 3.28Å; H285-L289 PolarHBondContact O-N 3.19Å
286	A	83.9	Confident	84.7	Confident	55 Å²	55	85 Å²	85	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-61.6	-40.4	174.6	0	0	0	0	0	112.2	L282 L283 L284 L289 K290	L282-A286 WeakPolarHBondContact O-CB 3.5Å; L282-A286 PolarHBondContact O-N 3.47Å; L283-A286 PolarHBondContact O-N 2.86Å; L284-A286 VanDerWaalsContact C-N 3.32Å; L284-A286 PolarHBondContact O-N 3.47Å; A286-L289 PolarHBondContact O-N 2.96Å; A286-K290 WeakPolarHBondContact O-CB 3.43Å; A286-K290 PolarHBondContact O-N 3.24Å
287	S	81.6	Confident	84.1	Confident	39 Å²	39	85 Å²	85	27%	0.273	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-40.5	178.1	81.7	0	0	0	0	112.7	L283 L284 H285 K290 R291	L283-S287 WeakPolarHBondContact O-CB 3.42Å; L283-S287 PolarHBondContact O-N 3.45Å; L284-S287 PolarHBondContact O-N 2.85Å; L284-S287 VanDerWaalsContact O-N 3.09Å; L284-S287 PolarHBondContact O-OG 3.16Å; H285-S287 VanDerWaalsContact C-N 3.33Å; H285-S287 PolarHBondContact O-N 3.26Å; S287-K290 PolarHBondContact O-N 2.91Å; S287-R291 WeakPolarHBondContact O-CG 3.39Å; S287-R291 PolarHBondContact O-N 3.36Å
288	L	74.9	Confident	83.2	Confident	48 Å²	48	92 Å²	92	25%	0.251	45%	0.451	S	S	.	.	H	α-helix	trans	-68.6	-40.8	177.1	-70.5	174.7	0	0	0	111	L284 H285 K290 R291 K292	L284-L288 HydrophobicContact CG-CD1 4.15Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CG 3.35Å; L284-L288 PolarHBondContact O-N 3.28Å; H285-L288 PolarHBondContact O-N 3.41Å; L288-K290 VanDerWaalsContact C-N 3.35Å; L288-R291 PolarHBondContact O-N 3.5Å; L288-K292 WeakPolarHBondContact O-CG 3.47Å; L288-K292 PolarHBondContact O-N 3.13Å
289	L	78.3	Confident	82.8	Confident	93 Å²	93	92.5 Å²	92.5	49%	0.487	45%	0.452	S	S	.	.	H	α-helix	trans	-61.9	-43.9	174.2	-173.5	63.5	0	0	0	111.1	H285 A286 R291 K292 I293	H285-L289 WeakPolarHBondContact O-CB 3.28Å; H285-L289 PolarHBondContact O-N 3.19Å; A286-L289 PolarHBondContact O-N 2.96Å; L289-R291 PolarHBondContact O-N 2.94Å; L289-K292 PolarHBondContact O-N 2.94Å; L289-I293 HydrophobicContact CG-CD1 4.14Å; L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 3.19Å
290	K	79.2	Confident	82	Confident	149 Å²	149	93.8 Å²	93.8	65%	0.648	46%	0.455	S	S	*	.	H	α-helix	trans	-60.2	-44.2	175.3	-170.3	174.8	-177.4	177	0	111.8	A286 S287 L288 K292 I293 T294	A286-K290 WeakPolarHBondContact O-CB 3.43Å; A286-K290 PolarHBondContact O-N 3.24Å; S287-K290 PolarHBondContact O-N 2.91Å; L288-K290 VanDerWaalsContact C-N 3.35Å; K290-K292 PolarHBondContact O-N 2.99Å; K290-I293 PolarHBondContact O-N 2.77Å; K290-T294 PolarHBondContact O-N 3.45Å; K290-T294 PolarHBondContact O-OG1 3.12Å; K290-T294 VanDerWaalsContact O-OG1 3.07Å
291	R	75.2	Confident	81.3	Confident	162 Å²	162	97.7 Å²	97.7	61%	0.611	48%	0.477	S	S	*	.	H	α-helix	trans	-59.9	-43	175.2	-73.4	175	-176.8	171.7	1.3	112	S287 L288 L289 T294 A295	S287-R291 WeakPolarHBondContact O-CG 3.39Å; S287-R291 PolarHBondContact O-N 3.36Å; L288-R291 PolarHBondContact O-N 3.5Å; L289-R291 PolarHBondContact O-N 2.94Å; R291-T294 PolarHBondContact O-N 3.44Å; R291-A295 VanDerWaalsContact O-CB 3.29Å; R291-A295 WeakPolarHBondContact O-CB 3.42Å; R291-A295 PolarHBondContact O-N 3.37Å
292	K	75	Confident	80.5	Confident	152 Å²	152	98.3 Å²	98.3	66%	0.661	49%	0.486	S	S	*	.	H	α-helix	trans	-63.1	-44.4	176.8	-74.6	178.7	179.1	-179.1	0	112.1	L288 L289 K290 A295 F296	L288-K292 WeakPolarHBondContact O-CG 3.47Å; L288-K292 PolarHBondContact O-N 3.13Å; L289-K292 PolarHBondContact O-N 2.94Å; K290-K292 PolarHBondContact O-N 2.99Å; K292-A295 PolarHBondContact O-N 3.43Å; K292-F296 WeakPolarHBondContact O-CB 3.47Å; K292-F296 PolarHBondContact O-N 2.75Å
293	I	76.3	Confident	79.8	Confident	84 Å²	84	96.6 Å²	96.6	43%	0.431	47%	0.473	S	S	.	.	H	α-helix	trans	-61.7	-50.2	176.8	-67.5	166.1	0	0	0	110.3	L289 K290 A295 F296 E297	L289-I293 HydrophobicContact CG-CD1 4.14Å; L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 3.19Å; K290-I293 PolarHBondContact O-N 2.77Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.34Å; I293-F296 WeakPolarHBondContact O-CB 3.38Å; I293-F296 PolarHBondContact O-N 2.98Å; I293-F296 VanDerWaalsContact O-N 3.15Å; I293-E297 HydrophobicContact CG2-CG 4.35Å; I293-E297 WeakPolarHBondContact O-CG 3.38Å; I293-E297 PolarHBondContact O-N 3.21Å
294	T	79	Confident	79.1	Confident	54 Å²	54	95.3 Å²	95.3	33%	0.331	47%	0.469	S	S	.	.	H	α-helix	trans	-63.8	-37.7	179.9	-55.1	0	0	0	0	112.3	K290 R291 E297 K298	K290-T294 PolarHBondContact O-N 3.45Å; K290-T294 PolarHBondContact O-OG1 3.12Å; K290-T294 VanDerWaalsContact O-OG1 3.07Å; R291-T294 PolarHBondContact O-N 3.44Å; T294-E297 PolarHBondContact O-N 3.1Å; T294-K298 WeakPolarHBondContact O-CB 3.4Å; T294-K298 WeakPolarHBondContact O-CG 3.3Å; T294-K298 PolarHBondContact O-N 2.89Å
295	A	75.6	Confident	78.3	Confident	60 Å²	60	102 Å²	102	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-42	174.3	0	0	0	0	0	111.6	R291 K292 I293 K298 W299	R291-A295 VanDerWaalsContact O-CB 3.29Å; R291-A295 WeakPolarHBondContact O-CB 3.42Å; R291-A295 PolarHBondContact O-N 3.37Å; K292-A295 PolarHBondContact O-N 3.43Å; I293-A295 VanDerWaalsContact C-N 3.33Å; I293-A295 PolarHBondContact O-N 3.34Å; A295-K298 PolarHBondContact O-N 3.45Å; A295-W299 WeakPolarHBondContact O-CB 3.22Å; A295-W299 PolarHBondContact O-N 3.39Å
296	F	80.3	Confident	77.6	Confident	107 Å²	107	99.8 Å²	99.8	47%	0.469	49%	0.488	S	S	.	.	H	α-helix	trans	-66.3	-40.5	176.6	-179.1	-115.1	0	0	0	112.8	K292 I293 W299 K300	K292-F296 WeakPolarHBondContact O-CB 3.47Å; K292-F296 PolarHBondContact O-N 2.75Å; I293-F296 WeakPolarHBondContact O-CB 3.38Å; I293-F296 PolarHBondContact O-N 2.98Å; I293-F296 VanDerWaalsContact O-N 3.15Å; F296-W299 HydrophobicContact CD2-CE3 4.17Å; F296-W299 HydrophobicContact CE2-CE3 4.08Å; F296-W299 HydrophobicContact CE2-CZ3 4.11Å; F296-W299 PolarHBondContact O-N 2.94Å; F296-K300 HydrophobicContact CD1-CD 4.34Å; F296-K300 HydrophobicContact CE1-CD 3.95Å; F296-K300 VanDerWaalsContact CE1-NZ 3.33Å; F296-K300 HydrophobicContact CZ-CD 4.24Å; F296-K300 HydrophobicContact CZ-CG 4.46Å; F296-K300 PolarHBondContact O-N 2.94Å
297	E	83	Confident	76.7	Confident	104 Å²	104	101.7 Å²	101.7	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-62.7	-44.7	173.9	-73	172	167.2	0	0	111.6	I293 T294 W299 K300 L301	I293-E297 HydrophobicContact CG2-CG 4.35Å; I293-E297 WeakPolarHBondContact O-CG 3.38Å; I293-E297 PolarHBondContact O-N 3.21Å; T294-E297 PolarHBondContact O-N 3.1Å; E297-W299 VanDerWaalsContact C-N 3.33Å; E297-W299 PolarHBondContact O-N 3.41Å; E297-K300 PolarHBondContact O-N 3.02Å; E297-L301 WeakPolarHBondContact O-CG 2.99Å; E297-L301 PolarHBondContact O-N 3.07Å
298	K	78.6	Confident	75.7	Confident	148 Å²	148	104.8 Å²	104.8	64%	0.643	51%	0.506	S	S	*	.	H	α-helix	trans	-60.5	-42.4	174	-76.7	-179.8	178.6	-175.9	0	111.9	T294 A295 L301 S302	T294-K298 WeakPolarHBondContact O-CB 3.4Å; T294-K298 WeakPolarHBondContact O-CG 3.3Å; T294-K298 PolarHBondContact O-N 2.89Å; A295-K298 PolarHBondContact O-N 3.45Å; K298-L301 PolarHBondContact O-N 2.78Å; K298-S302 PolarHBondContact O-N 3.37Å
299	W	86.7	Confident	74.9	Confident	146 Å²	146	108.9 Å²	108.9	55%	0.553	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-45.4	176.6	176.2	85	0	0	0	112	A295 F296 E297 L301 S302 K303	A295-W299 WeakPolarHBondContact O-CB 3.22Å; A295-W299 PolarHBondContact O-N 3.39Å; F296-W299 HydrophobicContact CD2-CE3 4.17Å; F296-W299 HydrophobicContact CE2-CE3 4.08Å; F296-W299 HydrophobicContact CE2-CZ3 4.11Å; F296-W299 PolarHBondContact O-N 2.94Å; E297-W299 VanDerWaalsContact C-N 3.33Å; E297-W299 PolarHBondContact O-N 3.41Å; W299-L301 VanDerWaalsContact C-N 3.32Å; W299-L301 PolarHBondContact O-N 3.09Å; W299-S302 WeakPolarHBondContact O-CB 3.27Å; W299-S302 PolarHBondContact O-N 3.14Å; W299-S302 VanDerWaalsContact O-N 3.14Å; W299-K303 HydrophobicContact CD2-CG 4.35Å; W299-K303 HydrophobicContact CH2-CG 4.35Å; W299-K303 HydrophobicContact CZ2-CD 4.46Å; W299-K303 HydrophobicContact CZ2-CG 3.9Å; W299-K303 PolarHBondContact O-N 3.28Å
300	K	78.6	Confident	73.9	Confident	110 Å²	110	109.1 Å²	109.1	48%	0.478	52%	0.523	S	S	.	.	H	α-helix	trans	-55.9	-47	173.8	-82.3	-177.7	168.4	174.9	0	111.6	F296 E297 S302 K303 V304	F296-K300 HydrophobicContact CD1-CD 4.34Å; F296-K300 HydrophobicContact CE1-CD 3.95Å; F296-K300 VanDerWaalsContact CE1-NZ 3.33Å; F296-K300 HydrophobicContact CZ-CD 4.24Å; F296-K300 HydrophobicContact CZ-CG 4.46Å; F296-K300 PolarHBondContact O-N 2.94Å; E297-K300 PolarHBondContact O-N 3.02Å; K300-S302 VanDerWaalsContact C-N 3.31Å; K300-S302 PolarHBondContact O-N 3.46Å; K300-K303 PolarHBondContact O-N 2.61Å; K300-V304 WeakPolarHBondContact O-CG2 3.5Å; K300-V304 PolarHBondContact O-N 2.87Å
301	L	78	Confident	72.7	Confident	112 Å²	112	104 Å²	104	59%	0.586	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-36.2	178.1	-70.9	169.6	0	0	0	112.3	E297 K298 W299 K305	E297-L301 WeakPolarHBondContact O-CG 2.99Å; E297-L301 PolarHBondContact O-N 3.07Å; K298-L301 PolarHBondContact O-N 2.78Å; W299-L301 VanDerWaalsContact C-N 3.32Å; W299-L301 PolarHBondContact O-N 3.09Å; L301-K305 WeakPolarHBondContact O-CG 3.11Å; L301-K305 PolarHBondContact O-N 3.15Å; L301-K305 VanDerWaalsContact O-N 3.17Å
302	S	76.4	Confident	71.8	Confident	58 Å²	58	101.3 Å²	101.3	41%	0.406	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-44	174.6	-163.6	0	0	0	0	112	K298 W299 K300 V304 K305 E306	K298-S302 PolarHBondContact O-N 3.37Å; W299-S302 WeakPolarHBondContact O-CB 3.27Å; W299-S302 PolarHBondContact O-N 3.14Å; W299-S302 VanDerWaalsContact O-N 3.14Å; K300-S302 VanDerWaalsContact C-N 3.31Å; K300-S302 PolarHBondContact O-N 3.46Å; S302-V304 PolarHBondContact O-N 3.31Å; S302-K305 WeakPolarHBondContact O-CB 3.49Å; S302-K305 PolarHBondContact O-N 3.03Å; S302-E306 PolarHBondContact O-N 2.8Å
303	K	76.7	Confident	70.7	Confident	91 Å²	91	98.2 Å²	98.2	40%	0.396	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-37.1	178.6	-75.2	-71.8	168.8	-157.2	0	113.1	W299 K300 K305 E306 T307	W299-K303 HydrophobicContact CD2-CG 4.35Å; W299-K303 HydrophobicContact CH2-CG 4.35Å; W299-K303 HydrophobicContact CZ2-CD 4.46Å; W299-K303 HydrophobicContact CZ2-CG 3.9Å; W299-K303 PolarHBondContact O-N 3.28Å; K300-K303 PolarHBondContact O-N 2.61Å; K303-K305 VanDerWaalsContact C-N 3.33Å; K303-E306 WeakPolarHBondContact CD-OE2 3.23Å; K303-E306 IonicContact NZ-OE2 2.78Å; K303-E306 PolarHBondContact NZ-OE2 2.68Å; K303-E306 PolarHBondContact O-N 2.84Å; K303-T307 PolarHBondContact O-N 3.48Å; K303-T307 PolarHBondContact O-OG1 2.86Å
304	V	74.8	Confident	69.6	Low	85 Å²	85	98.8 Å²	98.8	52%	0.515	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-42.7	172.7	174	0	0	0	0	110.6	K300 S302 T307 I308	K300-V304 WeakPolarHBondContact O-CG2 3.5Å; K300-V304 PolarHBondContact O-N 2.87Å; S302-V304 PolarHBondContact O-N 3.31Å; V304-T307 PolarHBondContact O-N 2.8Å; V304-I308 HydrophobicContact CG1-CD1 3.96Å; V304-I308 VanDerWaalsContact O-CG1 3.29Å; V304-I308 WeakPolarHBondContact O-CG1 3.41Å; V304-I308 PolarHBondContact O-N 3.32Å; V304-I308 VanDerWaalsContact O-N 3.08Å
305	K	69	Low	68.2	Low	155 Å²	155	102.4 Å²	102.4	67%	0.674	52%	0.516	S	S	*	.	H	α-helix	trans	-64.6	-42.5	176.6	-72.8	178.9	179	-174.9	0	112.8	L301 S302 K303 I308 F309	L301-K305 WeakPolarHBondContact O-CG 3.11Å; L301-K305 PolarHBondContact O-N 3.15Å; L301-K305 VanDerWaalsContact O-N 3.17Å; S302-K305 WeakPolarHBondContact O-CB 3.49Å; S302-K305 PolarHBondContact O-N 3.03Å; K303-K305 VanDerWaalsContact C-N 3.33Å; K305-I308 PolarHBondContact O-N 3.04Å; K305-F309 PolarHBondContact O-N 3.16Å
306	E	67.9	Low	67	Low	83 Å²	83	104.2 Å²	104.2	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-44.2	175	-78.6	169.9	-157.4	0	0	111.8	S302 K303 I308 F309 I310	S302-E306 PolarHBondContact O-N 2.8Å; K303-E306 WeakPolarHBondContact CD-OE2 3.23Å; K303-E306 IonicContact NZ-OE2 2.78Å; K303-E306 PolarHBondContact NZ-OE2 2.68Å; K303-E306 PolarHBondContact O-N 2.84Å; E306-I308 PolarHBondContact O-N 3.12Å; E306-F309 WeakPolarHBondContact O-CB 3.46Å; E306-F309 PolarHBondContact O-N 3Å; E306-F309 VanDerWaalsContact O-N 3.12Å; E306-I310 WeakPolarHBondContact O-CG1 3.32Å; E306-I310 PolarHBondContact O-N 2.94Å
307	T	65.1	Low	65.6	Low	96 Å²	96	104.7 Å²	104.7	59%	0.589	53%	0.528	S	S	*	.	H	α-helix	trans	-64.4	-39.6	178.3	-57	0	0	0	0	112.1	K303 V304 F309 I310 G311	K303-T307 PolarHBondContact O-N 3.48Å; K303-T307 PolarHBondContact O-OG1 2.86Å; V304-T307 PolarHBondContact O-N 2.8Å; T307-F309 VanDerWaalsContact C-N 3.28Å; T307-F309 PolarHBondContact O-N 3.19Å; T307-I310 PolarHBondContact O-N 3.04Å; T307-G311 PolarHBondContact O-N 2.86Å
308	I	61.7	Low	64	Low	103 Å²	103	109.7 Å²	109.7	53%	0.528	54%	0.542	S	S	.	.	H	α-helix	trans	-62.5	-39.1	173.5	-66.8	165.5	0	0	0	110.4	V304 K305 E306 N312	V304-I308 HydrophobicContact CG1-CD1 3.96Å; V304-I308 VanDerWaalsContact O-CG1 3.29Å; V304-I308 WeakPolarHBondContact O-CG1 3.41Å; V304-I308 PolarHBondContact O-N 3.32Å; V304-I308 VanDerWaalsContact O-N 3.08Å; K305-I308 PolarHBondContact O-N 3.04Å; E306-I308 PolarHBondContact O-N 3.12Å; I308-N312 PolarHBondContact O-N 3.3Å; I308-N312 VanDerWaalsContact O-N 3.09Å
309	F	56.6	Low	62.9	Low	135 Å²	135	109.8 Å²	109.8	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-69.7	-42.6	179.2	-155	-93.5	0	0	0	112.8	K305 E306 T307 N312 N313	K305-F309 PolarHBondContact O-N 3.16Å; E306-F309 WeakPolarHBondContact O-CB 3.46Å; E306-F309 PolarHBondContact O-N 3Å; E306-F309 VanDerWaalsContact O-N 3.12Å; T307-F309 VanDerWaalsContact C-N 3.28Å; T307-F309 PolarHBondContact O-N 3.19Å; F309-N312 PolarHBondContact O-N 3.31Å; F309-N313 PolarHBondContact O-N 2.99Å
310	I	59	Low	61.3	Low	98 Å²	98	106.6 Å²	106.6	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-66	-39.8	175.2	-64.5	167.9	0	0	0	110.8	E306 T307 N312 N313 N314	E306-I310 WeakPolarHBondContact O-CG1 3.32Å; E306-I310 PolarHBondContact O-N 2.94Å; T307-I310 PolarHBondContact O-N 3.04Å; I310-N312 VanDerWaalsContact C-N 3.27Å; I310-N312 PolarHBondContact O-N 3.47Å; I310-N313 PolarHBondContact O-N 3.1Å; I310-N314 WeakPolarHBondContact O-CB 3.25Å; I310-N314 PolarHBondContact O-N 2.95Å
311	G	54.2	Low	59.6	Low	41 Å²	41	108.6 Å²	108.6	42%	0.423	56%	0.559	S	S	.	*	H	α-helix	trans	-58.6	-40.3	174.4	0	0	0	0	0	112.3	T307 F315	T307-G311 PolarHBondContact O-N 2.86Å; G311-F315 PolarHBondContact O-N 2.96Å
312	N	54.6	Low	58	Low	106 Å²	106	113.9 Å²	113.9	57%	0.567	59%	0.587	S	S	*	*	H	α-helix	trans	-71.1	-40.7	176.2	-78	-5.7	0	0	0	112.7	I308 F309 I310 F315 V316	I308-N312 PolarHBondContact O-N 3.3Å; I308-N312 VanDerWaalsContact O-N 3.09Å; F309-N312 PolarHBondContact O-N 3.31Å; I310-N312 VanDerWaalsContact C-N 3.27Å; I310-N312 PolarHBondContact O-N 3.47Å; N312-F315 WeakPolarHBondContact O-CB 3.49Å; N312-F315 PolarHBondContact O-N 3.44Å; N312-V316 PolarHBondContact O-N 3.13Å
313	N	53.2	Low	57.1	Low	87 Å²	87	116.7 Å²	116.7	47%	0.465	60%	0.596	S	S	.	*	H	α-helix	trans	-68.8	-38.8	178.7	-80.7	-4.1	0	0	0	112.9	F309 I310 F315 V316 D317	F309-N313 PolarHBondContact O-N 2.99Å; I310-N313 PolarHBondContact O-N 3.1Å; N313-F315 PolarHBondContact O-N 3.44Å; N313-V316 PolarHBondContact O-N 3.28Å; N313-V316 VanDerWaalsContact O-N 3.1Å; N313-D317 PolarHBondContact O-N 3.28Å
314	N	51.9	Low	56.1	Low	95 Å²	95	118.1 Å²	118.1	51%	0.508	61%	0.606	S	S	.	*	H	α-helix	trans	-68	-19.2	174.7	-73.6	-20.8	0	0	0	113	I310	I310-N314 WeakPolarHBondContact O-CB 3.25Å; I310-N314 PolarHBondContact O-N 2.95Å
315	F	49.5	Very low	55	Low	131 Å²	131	119.9 Å²	119.9	58%	0.575	61%	0.611	S	S	*	*	H	α-helix	trans	-79	-25.8	173.4	-162.3	-99.4	0	0	0	112.4	G311 N312 N313 K319	G311-F315 PolarHBondContact O-N 2.96Å; N312-F315 WeakPolarHBondContact O-CB 3.49Å; N312-F315 PolarHBondContact O-N 3.44Å; N313-F315 PolarHBondContact O-N 3.44Å; F315-K319 HydrophobicContact CE1-CD 4.47Å
316	V	52.4	Low	54.2	Low	98 Å²	98	117.8 Å²	117.8	59%	0.594	61%	0.608	S	S	*	*	H	α-helix	trans	-75.2	-40.7	177.5	179.8	0	0	0	0	111	N312 N313 R318 K319	N312-V316 PolarHBondContact O-N 3.13Å; N313-V316 PolarHBondContact O-N 3.28Å; N313-V316 VanDerWaalsContact O-N 3.1Å; V316-R318 VanDerWaalsContact C-N 3.31Å; V316-R318 PolarHBondContact O-N 2.7Å; V316-K319 PolarHBondContact O-N 2.77Å
317	D	50.3	Low	53.4	Low	116 Å²	116	120 Å²	120	62%	0.62	62%	0.621	S	S	*	*	H	α-helix	trans	-72.8	-17.4	-178.9	-81.8	-21.8	0	0	0	114.7	N313 K319 S320	N313-D317 PolarHBondContact O-N 3.28Å; D317-K319 VanDerWaalsContact C-N 3.33Å; D317-S320 PolarHBondContact O-OG 3.22Å
318	R	49.4	Very low	52.6	Low	209 Å²	209	121.6 Å²	121.6	79%	0.789	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-8.8	174.2	-72	-168.2	-167.9	-172.7	4.1	114.1	V316	V316-R318 VanDerWaalsContact C-N 3.31Å; V316-R318 PolarHBondContact O-N 2.7Å
319	K	54.3	Low	51.9	Low	150 Å²	150	122.9 Å²	122.9	65%	0.652	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-1.6	178.9	-77.2	-167	175.2	-173.8	0	114.4	F315 V316 D317	F315-K319 HydrophobicContact CE1-CD 4.47Å; V316-K319 PolarHBondContact O-N 2.77Å; D317-K319 VanDerWaalsContact C-N 3.33Å
320	S	53.2	Low	51.6	Low	79 Å²	79	122 Å²	122	55%	0.552	63%	0.633	S	S	*	*	S	Bend	trans	-98.3	3.3	179.8	47.5	0	0	0	0	115.1	D317	D317-S320 PolarHBondContact O-OG 3.22Å
321	N	44.4	Very low	51	Low	152 Å²	152	124 Å²	124	81%	0.813	64%	0.644	S	S	*	*			trans	-124.7	33.3	177.7	-78.3	-31.6	0	0	0	114.1
322	L	44.2	Very low	50.7	Low	224 Å²	224	131.5 Å²	131.5	100%	1.173	66%	0.664	S	S	*	*			trans	-120.9	0	166.1	-83.5	164	0	0	0	109.2

Retrieved 322 of 322 residues in 317.3 ms (Link to these results)

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