A0A096MM29_PAPAN Loading...

BTB domain containing 19

AlphaFold DB , UniProt , Accession A0A096MM29, Species PAPAN (Papio anubis, Olive baboon), Gene BTBD19, Length 291 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	56.2	Low	81.5	Confident	242 Å²	242	147.2 Å²	147.2	100%	1.192	83%	0.831	S	S	*	*				0	105.6	0	-76.2	-173.2	-72	0	0	106.4
2	E	61.9	Low	82.3	Confident	187 Å²	187	141.2 Å²	141.2	87%	0.874	81%	0.813	S	S	*	*			trans	-61.7	138.9	168.5	-77.4	179.3	149.1	0	0	108.5	L4	E2-L4 PolarHBondContact O-N 2.97Å
3	P	67.3	Low	83.1	Confident	125 Å²	125	141.6 Å²	141.6	81%	0.812	80%	0.804	S	S	*	*			trans	-59.7	135.2	178.4	24.2	-31.2	0	0	0	109.7	G5	P3-G5 PolarHBondContact O-N 2.95Å
4	L	72.4	Confident	83.9	Confident	188 Å²	188	137.1 Å²	137.1	98%	0.984	78%	0.783	S	S	*	*			trans	-59.8	98.1	175.7	-80.2	154.2	0	0	0	109.5	E2	E2-L4 PolarHBondContact O-N 2.97Å
5	G	84	Confident	84.6	Confident	73 Å²	73	137.5 Å²	137.5	75%	0.753	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-88.8	136.8	170.3	0	0	0	0	0	110.9	P3	P3-G5 PolarHBondContact O-N 2.95Å
6	L	90.6	Very high	85.2	Confident	154 Å²	154	129.8 Å²	129.8	81%	0.806	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-99.5	122.2	169.6	179.7	67.5	0	0	0	109.2	V8	L6-V8 HydrophobicContact CD2-CG1 3.95Å; L6-V8 HydrophobicContact CG-CG1 4.04Å
7	V	90.8	Very high	85.8	Confident	113 Å²	113	125.2 Å²	125.2	69%	0.685	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-80.8	124.4	169.9	-178.7	0	0	0	0	108.6
8	V	92.9	Very high	86.3	Confident	115 Å²	115	121.4 Å²	121.4	70%	0.697	70%	0.699	S	S	*	*			trans	-117.4	141.2	174.9	-64	0	0	0	0	109.5	L6	L6-V8 HydrophobicContact CD2-CG1 3.95Å; L6-V8 HydrophobicContact CG-CG1 4.04Å
9	H	92.6	Very high	86.9	Confident	172 Å²	172	116.8 Å²	116.8	80%	0.796	67%	0.671	S	S	*	*			trans	-108.8	129.2	-177.3	-62.4	-78.6	0	0	0	111.1
10	G	92.7	Very high	87.3	Confident	76 Å²	76	114.9 Å²	114.9	78%	0.784	65%	0.653	S	S	*	*			trans	-75.3	172.9	168.4	0	0	0	0	0	112.2	A12	G10-A12 PolarHBondContact O-N 3.49Å
11	K	94.6	Very high	87.8	Confident	174 Å²	174	113 Å²	113	76%	0.757	65%	0.646	S	S	*	*			trans	-75.7	124.3	174.1	-63.4	-176.8	-179.3	-179	0	109.9	P14	K11-P14 HydrophobicContact CB-CG 4Å
12	A	91.6	Very high	89.7	Confident	75 Å²	75	103.5 Å²	103.5	62%	0.62	60%	0.6	S	S	*	*	H	α-helix	trans	-67.4	-38.4	-178.5	0	0	0	0	0	113.3	G10 F15 S16	G10-A12 PolarHBondContact O-N 3.49Å; A12-F15 WeakPolarHBondContact O-CB 3.36Å; A12-F15 PolarHBondContact O-N 3.1Å; A12-S16 WeakPolarHBondContact O-CB 3.44Å; A12-S16 PolarHBondContact O-N 2.9Å
13	E	92.4	Very high	91.4	Very high	147 Å²	147	96.1 Å²	96.1	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-61.5	-53.4	-176.5	-75.9	-61.9	153	0	0	113.7	F15 S16 A17	E13-F15 VanDerWaalsContact C-N 3.26Å; E13-F15 PolarHBondContact O-N 3.17Å; E13-S16 PolarHBondContact O-N 3.39Å; E13-A17 WeakPolarHBondContact O-CB 3.48Å; E13-A17 PolarHBondContact O-N 2.73Å
14	P	95	Very high	92.8	Very high	79 Å²	79	92.6 Å²	92.6	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-61.2	-34.4	175.6	-23.4	34.1	0	0	0	113.5	K11 A18	K11-P14 HydrophobicContact CB-CG 4Å; P14-A18 WeakPolarHBondContact O-CB 3.48Å; P14-A18 PolarHBondContact O-N 3.2Å
15	F	94.1	Very high	93.8	Very high	142 Å²	142	86.1 Å²	86.1	62%	0.623	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-49.8	176.4	172.5	-98.6	0	0	0	111.2	A12 E13 A17 A18 L19	A12-F15 WeakPolarHBondContact O-CB 3.36Å; A12-F15 PolarHBondContact O-N 3.1Å; E13-F15 VanDerWaalsContact C-N 3.26Å; E13-F15 PolarHBondContact O-N 3.17Å; F15-A17 PolarHBondContact O-N 3.24Å; F15-A18 PolarHBondContact O-N 3.02Å; F15-L19 HydrophobicContact CD1-CD1 4.22Å; F15-L19 HydrophobicContact CE1-CD1 3.53Å; F15-L19 HydrophobicContact CE2-CD1 4.16Å; F15-L19 HydrophobicContact CZ-CD1 3.51Å; F15-L19 HydrophobicContact CZ-CG 4.4Å; F15-L19 PolarHBondContact O-N 2.72Å; F15-L19 VanDerWaalsContact O-N 3.08Å
16	S	94.5	Very high	94.3	Very high	14 Å²	14	86.6 Å²	86.6	10%	0.098	50%	0.498	C	S	.	.	H	α-helix	trans	-61.4	-42.6	176.2	178.4	0	0	0	0	111.8	A12 E13 A18 L19 R20 T91	A12-S16 WeakPolarHBondContact O-CB 3.44Å; A12-S16 PolarHBondContact O-N 2.9Å; E13-S16 PolarHBondContact O-N 3.39Å; S16-A18 PolarHBondContact O-N 3.43Å; S16-L19 PolarHBondContact O-N 2.91Å; S16-R20 WeakPolarHBondContact O-CB 3.33Å; S16-R20 PolarHBondContact O-N 2.78Å; S16-T91 WeakPolarHBondContact OG-CB 3.07Å
17	A	95.3	Very high	94.4	Very high	52 Å²	52	86.8 Å²	86.8	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-40.1	176.4	0	0	0	0	0	112.8	E13 F15 R20 S21	E13-A17 WeakPolarHBondContact O-CB 3.48Å; E13-A17 PolarHBondContact O-N 2.73Å; F15-A17 PolarHBondContact O-N 3.24Å; A17-R20 PolarHBondContact O-N 2.75Å; A17-S21 PolarHBondContact O-N 3.38Å
18	A	95.5	Very high	94.5	Very high	57 Å²	57	89.2 Å²	89.2	47%	0.471	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-45	174.8	0	0	0	0	0	111.5	P14 F15 S16 S21	P14-A18 WeakPolarHBondContact O-CB 3.48Å; P14-A18 PolarHBondContact O-N 3.2Å; F15-A18 PolarHBondContact O-N 3.02Å; S16-A18 PolarHBondContact O-N 3.43Å; A18-S21 WeakPolarHBondContact O-CB 3.42Å; A18-S21 PolarHBondContact O-N 2.86Å; A18-S21 PolarHBondContact O-OG 3.16Å
19	L	96.4	Very high	94.5	Very high	34 Å²	34	85 Å²	85	18%	0.178	46%	0.463	C	S	.	.	H	α-helix	trans	-66	-37.7	176	-69	180	0	0	0	112.5	F15 S16 S21 L22 Y90 T91	F15-L19 HydrophobicContact CD1-CD1 4.22Å; F15-L19 HydrophobicContact CE1-CD1 3.53Å; F15-L19 HydrophobicContact CE2-CD1 4.16Å; F15-L19 HydrophobicContact CZ-CD1 3.51Å; F15-L19 HydrophobicContact CZ-CG 4.4Å; F15-L19 PolarHBondContact O-N 2.72Å; F15-L19 VanDerWaalsContact O-N 3.08Å; S16-L19 PolarHBondContact O-N 2.91Å; L19-S21 PolarHBondContact O-N 3.25Å; L19-L22 HydrophobicContact CD2-CD1 4.22Å; L19-L22 WeakPolarHBondContact O-CB 3.4Å; L19-L22 PolarHBondContact O-N 3.09Å; L19-Y90 WeakPolarHBondContact CD1-O 3.31Å; L19-Y90 WeakPolarHBondContact O-CD1 3.45Å; L19-T91 HydrophobicContact CB-CG2 4.48Å
20	R	96.2	Very high	94.5	Very high	79 Å²	79	81.2 Å²	81.2	30%	0.298	45%	0.448	S	S	.	.	H	α-helix	trans	-56.7	-35.5	175	-169	174.4	-77	97.2	2.2	112.2	S16 A17 L22 V23 E87 T91	S16-R20 WeakPolarHBondContact O-CB 3.33Å; S16-R20 PolarHBondContact O-N 2.78Å; A17-R20 PolarHBondContact O-N 2.75Å; R20-L22 PolarHBondContact O-N 3.18Å; R20-L22 VanDerWaalsContact O-N 3.16Å; R20-V23 WeakPolarHBondContact O-CB 3.22Å; R20-V23 WeakPolarHBondContact O-CG2 3.45Å; R20-V23 PolarHBondContact O-N 3.01Å; R20-V23 VanDerWaalsContact O-N 3.09Å; R20-E87 IonicContact CZ-OE1 3.06Å; R20-E87 IonicContact NE-OE1 3.08Å; R20-E87 PolarHBondContact NE-OE1 3.39Å; R20-E87 IonicContact NH2-OE1 3.87Å; R20-E87 PolarHBondContact NH2-OE1 2.95Å; R20-T91 HydrophobicContact CB-CG2 3.74Å; R20-T91 HydrophobicContact CG-CG2 4.34Å; R20-T91 PolarHBondContact NH2-OG1 3.1Å
21	S	96.4	Very high	94.4	Very high	74 Å²	74	78.4 Å²	78.4	52%	0.517	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14	178.3	79.2	0	0	0	0	114.6	A17 A18 L19 N25	A17-S21 PolarHBondContact O-N 3.38Å; A18-S21 WeakPolarHBondContact O-CB 3.42Å; A18-S21 PolarHBondContact O-N 2.86Å; A18-S21 PolarHBondContact O-OG 3.16Å; L19-S21 PolarHBondContact O-N 3.25Å; S21-N25 PolarHBondContact O-ND2 3.14Å
22	L	96.6	Very high	94.4	Very high	43 Å²	43	71.7 Å²	71.7	23%	0.225	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-11.4	176.2	-58.5	177.4	0	0	0	113	L19 R20 N24 N25 Y90	L19-L22 HydrophobicContact CD2-CD1 4.22Å; L19-L22 WeakPolarHBondContact O-CB 3.4Å; L19-L22 PolarHBondContact O-N 3.09Å; R20-L22 PolarHBondContact O-N 3.18Å; R20-L22 VanDerWaalsContact O-N 3.16Å; L22-N24 PolarHBondContact O-N 3.5Å; L22-N25 WeakPolarHBondContact O-CB 3.31Å; L22-N25 PolarHBondContact O-N 3.01Å; L22-Y90 HydrophobicContact CB-CD1 4.08Å; L22-Y90 HydrophobicContact CB-CE1 3.78Å
23	V	96.6	Very high	94.5	Very high	32 Å²	32	68.1 Å²	68.1	19%	0.194	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	126.9	178.9	176.2	0	0	0	0	109.2	R20 N25 L86 Y90	R20-V23 WeakPolarHBondContact O-CB 3.22Å; R20-V23 WeakPolarHBondContact O-CG2 3.45Å; R20-V23 PolarHBondContact O-N 3.01Å; R20-V23 VanDerWaalsContact O-N 3.09Å; V23-N25 PolarHBondContact O-N 3.41Å; V23-L86 HydrophobicContact CG1-CB 4.2Å; V23-Y90 HydrophobicContact CG2-CD1 3.95Å; V23-Y90 HydrophobicContact CG2-CD2 4.38Å; V23-Y90 HydrophobicContact CG2-CG 3.84Å
24	N	96.8	Very high	94.7	Very high	52 Å²	52	61.6 Å²	61.6	28%	0.278	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	36.4	-176.4	-163.3	24.6	0	0	0	113.9	L22 V42 F43 L83	L22-N24 PolarHBondContact O-N 3.5Å; N24-V42 HydrophobicContact CB-CG1 4.4Å; N24-V42 WeakPolarHBondContact OD1-CA 3.42Å; N24-F43 VanDerWaalsContact CA-O 3.31Å; N24-F43 WeakPolarHBondContact CA-O 3.28Å; N24-F43 PolarHBondContact N-O 3.1Å; N24-F43 PolarHBondContact OD1-N 3.37Å; N24-L83 HydrophobicContact CB-CD2 3.73Å
25	N	95.2	Very high	94.7	Very high	51 Å²	51	57.8 Å²	57.8	27%	0.273	31%	0.306	S	S	.	.			trans	-105	119.2	-179.9	-167	-33.3	0	0	0	110.1	S21 L22 V23 R27 S29	S21-N25 PolarHBondContact O-ND2 3.14Å; L22-N25 WeakPolarHBondContact O-CB 3.31Å; L22-N25 PolarHBondContact O-N 3.01Å; V23-N25 PolarHBondContact O-N 3.41Å; N25-R27 PolarHBondContact O-N 3.2Å; N25-R27 VanDerWaalsContact O-N 3.13Å; N25-R27 WeakPolarHBondContact OD1-CB 3.33Å; N25-R27 PolarHBondContact OD1-N 3.34Å; N25-S29 WeakPolarHBondContact O-CB 3.4Å; N25-S29 PolarHBondContact O-OG 3.34Å
26	P	93.9	Very high	94.5	Very high	83 Å²	83	51.4 Å²	51.4	54%	0.539	28%	0.281	S	S	.	.	S	Bend	trans	-60.6	-24.4	178.5	-22.1	31.2	0	0	0	113.6	Y28 S29 F43	P26-Y28 PolarHBondContact O-N 2.65Å; P26-S29 PolarHBondContact O-N 3.45Å; P26-F43 HydrophobicContact CB-CD1 4.22Å; P26-F43 HydrophobicContact CB-CD2 4.29Å; P26-F43 HydrophobicContact CB-CE1 4.35Å; P26-F43 HydrophobicContact CB-CE2 4.42Å; P26-F43 HydrophobicContact CB-CG 4.19Å; P26-F43 HydrophobicContact CB-CZ 4.45Å; P26-F43 HydrophobicContact CG-CD2 3.74Å; P26-F43 HydrophobicContact CG-CE2 3.86Å; P26-F43 HydrophobicContact CG-CG 4.11Å; P26-F43 HydrophobicContact CG-CZ 4.32Å
27	R	93.3	Very high	94.3	Very high	158 Å²	158	59.7 Å²	59.7	60%	0.596	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	123.3	-178.3	-166.8	-175.6	174.1	163.2	-4.3	110.1	N25 S29	N25-R27 PolarHBondContact O-N 3.2Å; N25-R27 VanDerWaalsContact O-N 3.13Å; N25-R27 WeakPolarHBondContact OD1-CB 3.33Å; N25-R27 PolarHBondContact OD1-N 3.34Å; R27-S29 PolarHBondContact O-N 2.86Å
28	Y	91.6	Very high	94	Very high	164 Å²	164	65.2 Å²	65.2	64%	0.643	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-1.2	-177.8	-46.3	-62.7	0	0	0	115.9	P26 H45	P26-Y28 PolarHBondContact O-N 2.65Å; Y28-H45 PolarHBondContact O-CD2 3.07Å; Y28-H45 PolarHBondContact O-NE2 3.45Å
29	S	93.8	Very high	93.8	Very high	28 Å²	28	70 Å²	70	20%	0.196	34%	0.341	C	S	.	.			trans	-66.5	135.4	173.5	-77.1	0	0	0	0	110.9	N25 P26 R27 A44 H45	N25-S29 WeakPolarHBondContact O-CB 3.4Å; N25-S29 PolarHBondContact O-OG 3.34Å; P26-S29 PolarHBondContact O-N 3.45Å; R27-S29 PolarHBondContact O-N 2.86Å; S29-A44 WeakPolarHBondContact CA-O 3.48Å; S29-A44 VanDerWaalsContact CB-O 3.28Å; S29-A44 WeakPolarHBondContact CB-O 3.27Å; S29-A44 PolarHBondContact OG-N 2.91Å; S29-A44 PolarHBondContact OG-O 3.34Å; S29-H45 PolarHBondContact N-NE2 3.07Å; S29-H45 PolarHBondContact OG-CE1 2.84Å
30	D	91.6	Very high	93.8	Very high	92 Å²	92	72.3 Å²	72.3	49%	0.492	35%	0.35	S	S	.	.			trans	-118	6.4	-178.4	62	-8.9	0	0	0	111.9	A44 H45 R46	D30-A44 PolarHBondContact N-O 3.41Å; D30-H45 VanDerWaalsContact OD1-CA 3.24Å; D30-H45 WeakPolarHBondContact OD1-CA 3.33Å; D30-R46 WeakPolarHBondContact O-CD 3.45Å; D30-R46 VanDerWaalsContact OD1-CG 3.31Å; D30-R46 WeakPolarHBondContact OD1-CG 3.48Å; D30-R46 PolarHBondContact OD1-N 3.19Å
31	V	91.6	Very high	93.7	Very high	17 Å²	17	74.2 Å²	74.2	10%	0.103	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	143.2	169.5	60.5	0	0	0	0	111.2	F33 A44 R46 L60 V72	V31-F33 HydrophobicContact CB-CE2 4.45Å; V31-F33 HydrophobicContact CG1-CD2 4.5Å; V31-F33 HydrophobicContact CG1-CE2 3.74Å; V31-F33 HydrophobicContact CG1-CZ 4.37Å; V31-F33 HydrophobicContact CG2-CD2 4.28Å; V31-F33 HydrophobicContact CG2-CE2 3.83Å; V31-F33 HydrophobicContact CG2-CZ 4.03Å; V31-A44 HydrophobicContact CG1-CB 4Å; V31-A44 VanDerWaalsContact CG1-O 3.26Å; V31-A44 WeakPolarHBondContact CG1-O 3.45Å; V31-A44 PolarHBondContact N-O 3Å; V31-A44 PolarHBondContact O-N 3.26Å; V31-R46 HydrophobicContact CB-CG 3.72Å; V31-R46 HydrophobicContact CG1-CG 3.74Å; V31-L60 HydrophobicContact CG2-CD2 4.03Å; V31-V72 HydrophobicContact CG2-CG2 4.31Å
32	C	93.4	Very high	93.7	Very high	33 Å²	33	70.7 Å²	70.7	22%	0.223	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.6	170.3	-178.2	0	0	0	0	109.4	F43 V72	C32-F43 HydrophobicContact CB-CD1 4.33Å; C32-F43 HydrophobicContact CB-CE1 4.33Å; C32-V72 PolarHBondContact O-N 3.04Å
33	F	94.8	Very high	93.7	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	143.8	173.7	-64.8	-91.1	0	0	0	110	V31 V35 E41 V42 A44 L49 F56 L59 L60 V72 L74 F82	V31-F33 HydrophobicContact CB-CE2 4.45Å; V31-F33 HydrophobicContact CG1-CD2 4.5Å; V31-F33 HydrophobicContact CG1-CE2 3.74Å; V31-F33 HydrophobicContact CG1-CZ 4.37Å; V31-F33 HydrophobicContact CG2-CD2 4.28Å; V31-F33 HydrophobicContact CG2-CE2 3.83Å; V31-F33 HydrophobicContact CG2-CZ 4.03Å; F33-V35 HydrophobicContact CB-CG2 3.68Å; F33-E41 CarbonylContact O-C 3.55Å; F33-E41 WeakPolarHBondContact O-CA 3.45Å; F33-V42 HydrophobicContact CB-CB 4.43Å; F33-V42 PolarHBondContact N-O 3.06Å; F33-V42 PolarHBondContact O-N 2.98Å; F33-A44 HydrophobicContact CD2-CB 4.39Å; F33-A44 HydrophobicContact CE2-CB 4.02Å; F33-L49 HydrophobicContact CE2-CD1 3.72Å; F33-L49 HydrophobicContact CZ-CD1 3.8Å; F33-F56 HydrophobicContact CE1-CD1 4.39Å; F33-F56 HydrophobicContact CE1-CE1 4.09Å; F33-F56 HydrophobicContact CZ-CD1 4.17Å; F33-F56 HydrophobicContact CZ-CE1 4.11Å; F33-L59 HydrophobicContact CE1-CD2 4.28Å; F33-L60 HydrophobicContact CZ-CD2 4.28Å; F33-V72 CarbonylContact C-O 3.56Å; F33-V72 VanDerWaalsContact CA-O 3.25Å; F33-V72 WeakPolarHBondContact CA-O 3.33Å; F33-V72 HydrophobicContact CD1-CB 3.59Å; F33-V72 HydrophobicContact CD1-CG1 3.64Å; F33-V72 HydrophobicContact CE1-CB 3.77Å; F33-V72 HydrophobicContact CE1-CG1 3.6Å; F33-V72 HydrophobicContact CE1-CG2 4.38Å; F33-V72 HydrophobicContact CG-CB 4.46Å; F33-L74 HydrophobicContact CD1-CD1 3.61Å; F33-L74 HydrophobicContact CD1-CG 4.04Å; F33-L74 HydrophobicContact CE1-CD1 4.1Å; F33-L74 HydrophobicContact CG-CD1 4.36Å; F33-F82 HydrophobicContact CB-CE1 4.08Å; F33-F82 HydrophobicContact CB-CZ 4.28Å; F33-F82 HydrophobicContact CD1-CZ 4.03Å; F33-F82 HydrophobicContact CD2-CE1 4.03Å; F33-F82 AromaticContact CD2-CZ 3.84Å; F33-F82 HydrophobicContact CD2-CZ 3.84Å; F33-F82 HydrophobicContact CE1-CZ 4.31Å; F33-F82 HydrophobicContact CE2-CZ 4.14Å; F33-F82 HydrophobicContact CG-CE1 4.01Å; F33-F82 AromaticContact CG-CZ 3.78Å; F33-F82 HydrophobicContact CG-CZ 3.78Å; F33-F82 HydrophobicContact CZ-CZ 4.36Å
34	V	95.4	Very high	93.7	Very high	9 Å²	9	69.8 Å²	69.8	6%	0.055	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	108.3	168.7	172.5	0	0	0	0	107.2	R39 Q40 P71 V72 V73 L74	V34-R39 HydrophobicContact CG1-CB 3.6Å; V34-R39 HydrophobicContact CG1-CG 4.12Å; V34-Q40 WeakPolarHBondContact CA-O 3.32Å; V34-P71 HydrophobicContact CG2-CB 3.63Å; V34-P71 HydrophobicContact CG2-CG 4.14Å; V34-V72 PolarHBondContact N-O 3.07Å; V34-V73 HydrophobicContact CB-CG2 4.32Å; V34-V73 CarbonylContact O-C 3.59Å; V34-V73 WeakPolarHBondContact O-CA 3.23Å; V34-L74 PolarHBondContact O-N 3.14Å
35	V	95.3	Very high	93.6	Very high	0 Å²	0	68 Å²	68	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.9	-163.4	-173.7	0	0	0	0	111.8	F33 R39 Q40 V42 L74 V77 F82	F33-V35 HydrophobicContact CB-CG2 3.68Å; V35-R39 WeakPolarHBondContact O-CA 3.49Å; V35-R39 PolarHBondContact O-N 3Å; V35-Q40 PolarHBondContact N-O 3.2Å; V35-Q40 PolarHBondContact O-N 3.08Å; V35-V42 HydrophobicContact CB-CG2 4.18Å; V35-V42 HydrophobicContact CG2-CB 4.08Å; V35-V42 HydrophobicContact CG2-CG2 3.75Å; V35-L74 WeakPolarHBondContact CA-O 3.28Å; V35-V77 HydrophobicContact CG1-CG1 3.7Å; V35-V77 WeakPolarHBondContact CG1-O 3.5Å; V35-F82 HydrophobicContact CG1-CB 3.82Å; V35-F82 HydrophobicContact CG1-CD1 4.25Å; V35-F82 HydrophobicContact CG1-CG 4.12Å; V35-F82 HydrophobicContact CG2-CD1 3.64Å; V35-F82 HydrophobicContact CG2-CE1 3.87Å; V35-F82 HydrophobicContact CG2-CG 4.21Å
36	G	91.2	Very high	93.6	Very high	8 Å²	8	68.8 Å²	68.8	8%	0.082	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	179.9	174.8	0	0	0	0	0	114	E38 R39 L74 V77	G36-E38 PolarHBondContact O-N 3.17Å; G36-R39 PolarHBondContact O-N 3.36Å; G36-L74 PolarHBondContact N-O 3.35Å; G36-V77 VanDerWaalsContact CA-O 3.25Å; G36-V77 WeakPolarHBondContact CA-O 3.32Å; G36-V77 PolarHBondContact N-O 2.87Å
37	Q	89	Confident	93.6	Very high	188 Å²	188	68.9 Å²	68.9	88%	0.879	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.3	177	-62.6	-176.1	5.3	0	0	112	R39	Q37-R39 PolarHBondContact O-N 3.47Å
38	E	89.5	Confident	93.7	Very high	168 Å²	168	63.3 Å²	63.3	79%	0.785	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-7.1	176.7	-60.4	-175.1	177	0	0	113.2	G36 Q40	G36-E38 PolarHBondContact O-N 3.17Å; E38-Q40 VanDerWaalsContact C-N 3.27Å; E38-Q40 PolarHBondContact O-N 3.24Å
39	R	92.1	Very high	93.9	Very high	158 Å²	158	55.5 Å²	55.5	60%	0.596	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	42	179.2	-59.5	-178.2	62.2	87.7	4.1	112.7	V34 V35 G36 Q37	V34-R39 HydrophobicContact CG1-CB 3.6Å; V34-R39 HydrophobicContact CG1-CG 4.12Å; V35-R39 WeakPolarHBondContact O-CA 3.49Å; V35-R39 PolarHBondContact O-N 3Å; G36-R39 PolarHBondContact O-N 3.36Å; Q37-R39 PolarHBondContact O-N 3.47Å
40	Q	95	Very high	94	Very high	82 Å²	82	55.4 Å²	55.4	38%	0.383	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.1	-178.9	-171.7	172.8	1.5	0	0	110.8	V34 V35 E38 T79	V34-Q40 WeakPolarHBondContact CA-O 3.32Å; V35-Q40 PolarHBondContact N-O 3.2Å; V35-Q40 PolarHBondContact O-N 3.08Å; E38-Q40 VanDerWaalsContact C-N 3.27Å; E38-Q40 PolarHBondContact O-N 3.24Å; Q40-T79 HydrophobicContact CB-CG2 4.25Å; Q40-T79 HydrophobicContact CG-CG2 4.23Å; Q40-T79 PolarHBondContact OE1-OG1 3.43Å
41	E	95.4	Very high	94.1	Very high	118 Å²	118	55.7 Å²	55.7	55%	0.551	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.3	174.4	-66.5	-172.4	156.1	0	0	110.9	F33 F43	F33-E41 CarbonylContact O-C 3.55Å; F33-E41 WeakPolarHBondContact O-CA 3.45Å; E41-F43 HydrophobicContact CB-CE2 4.48Å
42	V	96.6	Very high	94.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	120.6	177	-177	0	0	0	0	109.9	N24 F33 V35 T79 F82 L83 L86	N24-V42 HydrophobicContact CB-CG1 4.4Å; N24-V42 WeakPolarHBondContact OD1-CA 3.42Å; F33-V42 HydrophobicContact CB-CB 4.43Å; F33-V42 PolarHBondContact N-O 3.06Å; F33-V42 PolarHBondContact O-N 2.98Å; V35-V42 HydrophobicContact CB-CG2 4.18Å; V35-V42 HydrophobicContact CG2-CB 4.08Å; V35-V42 HydrophobicContact CG2-CG2 3.75Å; V42-T79 HydrophobicContact CG2-CG2 3.83Å; V42-F82 HydrophobicContact CB-CD1 4.21Å; V42-F82 HydrophobicContact CB-CE1 4.06Å; V42-F82 HydrophobicContact CG1-CD1 3.91Å; V42-F82 HydrophobicContact CG1-CE1 3.76Å; V42-F82 HydrophobicContact CG2-CD1 4.29Å; V42-L83 HydrophobicContact CG1-CD2 3.85Å; V42-L86 HydrophobicContact CG1-CD1 3.43Å; V42-L86 VanDerWaalsContact CG1-CD1 3.43Å
43	F	96.1	Very high	94.5	Very high	56 Å²	56	58.8 Å²	58.8	25%	0.246	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139	-177.3	-61.8	-85.8	0	0	0	111.7	N24 P26 C32 E41	N24-F43 VanDerWaalsContact CA-O 3.31Å; N24-F43 WeakPolarHBondContact CA-O 3.28Å; N24-F43 PolarHBondContact N-O 3.1Å; N24-F43 PolarHBondContact OD1-N 3.37Å; P26-F43 HydrophobicContact CB-CD1 4.22Å; P26-F43 HydrophobicContact CB-CD2 4.29Å; P26-F43 HydrophobicContact CB-CE1 4.35Å; P26-F43 HydrophobicContact CB-CE2 4.42Å; P26-F43 HydrophobicContact CB-CG 4.19Å; P26-F43 HydrophobicContact CB-CZ 4.45Å; P26-F43 HydrophobicContact CG-CD2 3.74Å; P26-F43 HydrophobicContact CG-CE2 3.86Å; P26-F43 HydrophobicContact CG-CG 4.11Å; P26-F43 HydrophobicContact CG-CZ 4.32Å; C32-F43 HydrophobicContact CB-CD1 4.33Å; C32-F43 HydrophobicContact CB-CE1 4.33Å; E41-F43 HydrophobicContact CB-CE2 4.48Å
44	A	96.4	Very high	94.6	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	177.6	176.7	0	0	0	0	0	113	S29 D30 V31 F33 L49 L86 Y90	S29-A44 WeakPolarHBondContact CA-O 3.48Å; S29-A44 VanDerWaalsContact CB-O 3.28Å; S29-A44 WeakPolarHBondContact CB-O 3.27Å; S29-A44 PolarHBondContact OG-N 2.91Å; S29-A44 PolarHBondContact OG-O 3.34Å; D30-A44 PolarHBondContact N-O 3.41Å; V31-A44 HydrophobicContact CG1-CB 4Å; V31-A44 VanDerWaalsContact CG1-O 3.26Å; V31-A44 WeakPolarHBondContact CG1-O 3.45Å; V31-A44 PolarHBondContact N-O 3Å; V31-A44 PolarHBondContact O-N 3.26Å; F33-A44 HydrophobicContact CD2-CB 4.39Å; F33-A44 HydrophobicContact CE2-CB 4.02Å; A44-L49 HydrophobicContact CB-CD1 3.88Å; A44-L49 HydrophobicContact CB-CG 4.48Å; A44-L86 HydrophobicContact CB-CD2 4.24Å; A44-Y90 WeakPolarHBondContact CA-OH 3.41Å
45	H	95	Very high	94.6	Very high	15 Å²	15	66.3 Å²	66.3	7%	0.069	32%	0.324	C	S	.	.			trans	-114.5	116.2	-177.5	-55.4	78.6	0	0	0	110.1	Y28 S29 D30 C47 L48 L49 Y90	Y28-H45 PolarHBondContact O-CD2 3.07Å; Y28-H45 PolarHBondContact O-NE2 3.45Å; S29-H45 PolarHBondContact N-NE2 3.07Å; S29-H45 PolarHBondContact OG-CE1 2.84Å; D30-H45 VanDerWaalsContact OD1-CA 3.24Å; D30-H45 WeakPolarHBondContact OD1-CA 3.33Å; H45-C47 VanDerWaalsContact C-N 3.28Å; H45-C47 PolarHBondContact O-N 3.13Å; H45-L48 HydrophobicContact CB-CB 4.34Å; H45-L48 HydrophobicContact CB-CD1 4.06Å; H45-L48 HydrophobicContact CB-CG 4.22Å; H45-L48 PolarHBondContact O-N 3.11Å; H45-L49 PolarHBondContact O-N 3.28Å; H45-Y90 PolarHBondContact N-OH 3.42Å; H45-Y90 AromaticContact ND1-CE1 3.65Å; H45-Y90 AromaticContact ND1-CZ 3.67Å; H45-Y90 PolarHBondContact ND1-OH 3.24Å
46	R	94	Very high	94.5	Very high	67 Å²	67	66.3 Å²	66.3	25%	0.253	32%	0.324	S	S	.	.	H	α-helix	trans	-55.9	-42.6	-174.8	-66.5	164.6	60.8	79	-3.8	111.8	D30 V31 L48 L49 A50 L60	D30-R46 WeakPolarHBondContact O-CD 3.45Å; D30-R46 VanDerWaalsContact OD1-CG 3.31Å; D30-R46 WeakPolarHBondContact OD1-CG 3.48Å; D30-R46 PolarHBondContact OD1-N 3.19Å; V31-R46 HydrophobicContact CB-CG 3.72Å; V31-R46 HydrophobicContact CG1-CG 3.74Å; R46-L48 PolarHBondContact O-N 3.16Å; R46-L49 PolarHBondContact O-N 3.12Å; R46-A50 WeakPolarHBondContact O-CB 3.48Å; R46-A50 PolarHBondContact O-N 2.99Å; R46-L60 HydrophobicContact CB-CD1 4.26Å; R46-L60 HydrophobicContact CG-CD1 4.19Å; R46-L60 PolarHBondContact NH1-O 3.21Å; R46-L60 PolarHBondContact NH2-O 2.71Å
47	C	93.9	Very high	94.7	Very high	86 Å²	86	70.8 Å²	70.8	58%	0.581	34%	0.343	S	S	*	.	H	α-helix	trans	-62.3	-41.3	-178.8	62.1	0	0	0	0	112.9	H45 C51	H45-C47 VanDerWaalsContact C-N 3.28Å; H45-C47 PolarHBondContact O-N 3.13Å; C47-C51 WeakPolarHBondContact O-CB 3.38Å; C47-C51 PolarHBondContact O-N 3.5Å; C47-C51 VanDerWaalsContact O-N 3.13Å; C47-C51 PolarHBondContact O-SG 3.26Å
48	L	95.6	Very high	94.8	Very high	40 Å²	40	70.7 Å²	70.7	21%	0.209	33%	0.334	C	S	.	.	H	α-helix	trans	-69.2	-42.2	179.2	-69.1	178.2	0	0	0	111.5	H45 R46 C51 R52 Y90	H45-L48 HydrophobicContact CB-CB 4.34Å; H45-L48 HydrophobicContact CB-CD1 4.06Å; H45-L48 HydrophobicContact CB-CG 4.22Å; H45-L48 PolarHBondContact O-N 3.11Å; R46-L48 PolarHBondContact O-N 3.16Å; L48-C51 PolarHBondContact O-SG 3.04Å; L48-C51 VanDerWaalsContact O-SG 3.35Å; L48-R52 WeakPolarHBondContact O-CB 3.04Å; L48-R52 VanDerWaalsContact O-CG 3.23Å; L48-R52 WeakPolarHBondContact O-CG 3.47Å; L48-R52 PolarHBondContact O-N 2.97Å; L48-Y90 HydrophobicContact CB-CE2 4.38Å; L48-Y90 HydrophobicContact CD1-CD1 3.61Å; L48-Y90 HydrophobicContact CD1-CE1 3.33Å; L48-Y90 HydrophobicContact CD1-CE2 4.34Å; L48-Y90 HydrophobicContact CD1-CG 4.23Å
49	L	96.4	Very high	94.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.8	-47.8	178.3	-58.4	-175	0	0	0	111.5	F33 A44 H45 R46 C51 R52 C53 F56 L60 L86 L89 Y90	F33-L49 HydrophobicContact CE2-CD1 3.72Å; F33-L49 HydrophobicContact CZ-CD1 3.8Å; A44-L49 HydrophobicContact CB-CD1 3.88Å; A44-L49 HydrophobicContact CB-CG 4.48Å; H45-L49 PolarHBondContact O-N 3.28Å; R46-L49 PolarHBondContact O-N 3.12Å; L49-C51 VanDerWaalsContact C-N 3.34Å; L49-C51 PolarHBondContact O-N 2.86Å; L49-R52 PolarHBondContact O-N 3.2Å; L49-C53 WeakPolarHBondContact O-CB 3.47Å; L49-C53 PolarHBondContact O-N 3.16Å; L49-F56 HydrophobicContact CB-CB 3.68Å; L49-F56 HydrophobicContact CB-CD2 4.22Å; L49-F56 HydrophobicContact CB-CG 3.94Å; L49-F56 HydrophobicContact CD1-CD1 4.23Å; L49-F56 HydrophobicContact CD1-CG 4.3Å; L49-L60 HydrophobicContact CB-CD1 4.12Å; L49-L60 HydrophobicContact CD1-CD1 4.15Å; L49-L86 HydrophobicContact CD1-CD2 4.21Å; L49-L86 HydrophobicContact CD2-CD2 3.47Å; L49-L86 VanDerWaalsContact CD2-CD2 3.47Å; L49-L86 HydrophobicContact CG-CD2 4.46Å; L49-L89 HydrophobicContact CD2-CB 4.32Å; L49-L89 HydrophobicContact CD2-CD1 3.54Å; L49-Y90 HydrophobicContact CD2-CE2 4Å
50	A	94.8	Very high	94.7	Very high	26 Å²	26	58.4 Å²	58.4	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-33	-176.3	0	0	0	0	0	113.1	R46 Q57	R46-A50 WeakPolarHBondContact O-CB 3.48Å; R46-A50 PolarHBondContact O-N 2.99Å; A50-Q57 HydrophobicContact CB-CB 4.22Å; A50-Q57 HydrophobicContact CB-CG 4.29Å; A50-Q57 WeakPolarHBondContact O-CB 3.49Å
51	C	95.4	Very high	93.8	Very high	98 Å²	98	57.4 Å²	57.4	66%	0.662	30%	0.298	S	S	*	.	H	α-helix	trans	-79.7	-19.3	178.5	73.6	0	0	0	0	113.6	C47 L48 L49	C47-C51 WeakPolarHBondContact O-CB 3.38Å; C47-C51 PolarHBondContact O-N 3.5Å; C47-C51 VanDerWaalsContact O-N 3.13Å; C47-C51 PolarHBondContact O-SG 3.26Å; L48-C51 PolarHBondContact O-SG 3.04Å; L48-C51 VanDerWaalsContact O-SG 3.35Å; L49-C51 VanDerWaalsContact C-N 3.34Å; L49-C51 PolarHBondContact O-N 2.86Å
52	R	96.4	Very high	92.6	Very high	110 Å²	110	56.9 Å²	56.9	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-105.6	-15.2	-176	-64	-76.6	-72.7	151.9	6.2	113.6	L48 L49 L89 N92	L48-R52 WeakPolarHBondContact O-CB 3.04Å; L48-R52 VanDerWaalsContact O-CG 3.23Å; L48-R52 WeakPolarHBondContact O-CG 3.47Å; L48-R52 PolarHBondContact O-N 2.97Å; L49-R52 PolarHBondContact O-N 3.2Å; R52-L89 HydrophobicContact CB-CD2 3.7Å; R52-L89 PolarHBondContact NE-O 3.18Å; R52-N92 PolarHBondContact NH2-OD1 2.86Å
53	C	97.2	Very high	90.9	Very high	5 Å²	5	65.2 Å²	65.2	3%	0.034	34%	0.342	C	S	.	.			trans	-148.8	117.6	-173.2	179.8	0	0	0	0	112.1	L49 F55 F56 Q57 L89 Y111 L113	L49-C53 WeakPolarHBondContact O-CB 3.47Å; L49-C53 PolarHBondContact O-N 3.16Å; C53-F55 PolarHBondContact O-N 2.75Å; C53-F56 HydrophobicContact CB-CB 4.35Å; C53-F56 HydrophobicContact CB-CD2 3.69Å; C53-F56 PolarHBondContact O-N 2.95Å; C53-F56 VanDerWaalsContact O-N 3.17Å; C53-F56 WeakPolarHBondContact SG-CD2 3.49Å; C53-Q57 PolarHBondContact O-N 2.9Å; C53-L89 HydrophobicContact CB-CD1 4.47Å; C53-L89 HydrophobicContact CB-CD2 3.89Å; C53-Y111 PolarHBondContact SG-O 3.32Å; C53-Y111 VanDerWaalsContact SG-O 3.35Å; C53-L113 HydrophobicContact CB-CD2 3.99Å
54	N	95.8	Very high	89.1	Confident	117 Å²	117	66.4 Å²	66.4	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-63.2	-28	179.4	-68.5	-21.9	0	0	0	113.3	R58	N54-R58 WeakPolarHBondContact O-CG 3.38Å; N54-R58 PolarHBondContact O-N 3.38Å; N54-R58 VanDerWaalsContact O-N 3.15Å; N54-R58 PolarHBondContact O-NE 3.19Å
55	F	94.8	Very high	87.3	Confident	50 Å²	50	69 Å²	69	22%	0.219	38%	0.381	C	S	.	.	H	α-helix	trans	-62.4	-53.5	172.4	169.7	-95.3	0	0	0	110.4	C53 Q57 R58 L59 Y111	C53-F55 PolarHBondContact O-N 2.75Å; F55-Q57 VanDerWaalsContact C-N 3.34Å; F55-Q57 PolarHBondContact O-N 3.13Å; F55-R58 PolarHBondContact O-N 3.07Å; F55-L59 HydrophobicContact CE1-CD2 3.72Å; F55-L59 HydrophobicContact CZ-CD2 3.96Å; F55-L59 WeakPolarHBondContact O-CB 3.25Å; F55-L59 PolarHBondContact O-N 3.04Å; F55-Y111 WeakPolarHBondContact CB-O 3.29Å; F55-Y111 AromaticContact CD1-CD1 3.49Å; F55-Y111 HydrophobicContact CD1-CD1 3.49Å; F55-Y111 VanDerWaalsContact CD1-CD1 3.49Å; F55-Y111 HydrophobicContact CD1-CE1 4.11Å; F55-Y111 AromaticContact CD1-CG 3.99Å; F55-Y111 HydrophobicContact CD1-CG 3.99Å; F55-Y111 HydrophobicContact CD2-CD1 4.24Å; F55-Y111 AromaticContact CE1-CD1 3.46Å; F55-Y111 HydrophobicContact CE1-CD1 3.46Å; F55-Y111 VanDerWaalsContact CE1-CD1 3.46Å; F55-Y111 AromaticContact CE1-CE1 3.58Å; F55-Y111 HydrophobicContact CE1-CE1 3.58Å; F55-Y111 HydrophobicContact CE1-CG 4.29Å; F55-Y111 HydrophobicContact CE2-CD1 4.22Å; F55-Y111 HydrophobicContact CE2-CE1 4.5Å; F55-Y111 AromaticContact CG-CD1 3.91Å; F55-Y111 HydrophobicContact CG-CD1 3.91Å; F55-Y111 HydrophobicContact CG-CG 4.44Å; F55-Y111 AromaticContact CZ-CD1 3.84Å; F55-Y111 HydrophobicContact CZ-CD1 3.84Å; F55-Y111 AromaticContact CZ-CE1 3.81Å; F55-Y111 HydrophobicContact CZ-CE1 3.81Å
56	F	94.5	Very high	85	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-67.5	-33.2	178.1	-68.6	-63.6	0	0	0	112.8	F33 L49 C53 R58 L59 L60 F82 V85 L89 Y111	F33-F56 HydrophobicContact CE1-CD1 4.39Å; F33-F56 HydrophobicContact CE1-CE1 4.09Å; F33-F56 HydrophobicContact CZ-CD1 4.17Å; F33-F56 HydrophobicContact CZ-CE1 4.11Å; L49-F56 HydrophobicContact CB-CB 3.68Å; L49-F56 HydrophobicContact CB-CD2 4.22Å; L49-F56 HydrophobicContact CB-CG 3.94Å; L49-F56 HydrophobicContact CD1-CD1 4.23Å; L49-F56 HydrophobicContact CD1-CG 4.3Å; C53-F56 HydrophobicContact CB-CB 4.35Å; C53-F56 HydrophobicContact CB-CD2 3.69Å; C53-F56 PolarHBondContact O-N 2.95Å; C53-F56 VanDerWaalsContact O-N 3.17Å; C53-F56 WeakPolarHBondContact SG-CD2 3.49Å; F56-R58 VanDerWaalsContact C-N 3.29Å; F56-R58 PolarHBondContact O-N 3.07Å; F56-L59 HydrophobicContact CD1-CD2 4.03Å; F56-L59 HydrophobicContact CE1-CD2 4.26Å; F56-L59 PolarHBondContact O-N 2.87Å; F56-L60 HydrophobicContact CB-CD1 4.16Å; F56-L60 WeakPolarHBondContact O-CB 3.38Å; F56-L60 VanDerWaalsContact O-CG 3.23Å; F56-L60 WeakPolarHBondContact O-CG 3.48Å; F56-L60 PolarHBondContact O-N 3.27Å; F56-F82 HydrophobicContact CE1-CE2 4.09Å; F56-F82 HydrophobicContact CE1-CZ 4.48Å; F56-F82 AromaticContact CZ-CE2 3.74Å; F56-F82 HydrophobicContact CZ-CE2 3.74Å; F56-F82 HydrophobicContact CZ-CZ 4.42Å; F56-V85 HydrophobicContact CE2-CG1 4.44Å; F56-L89 HydrophobicContact CD2-CD1 3.87Å; F56-L89 HydrophobicContact CE2-CD1 3.76Å; F56-Y111 HydrophobicContact CE2-CD2 4.19Å; F56-Y111 HydrophobicContact CE2-CG 4.41Å; F56-Y111 HydrophobicContact CZ-CD2 4.09Å; F56-Y111 HydrophobicContact CZ-CE2 4.11Å; F56-Y111 HydrophobicContact CZ-CG 4.4Å
57	Q	94.1	Very high	83.2	Confident	102 Å²	102	75.2 Å²	75.2	48%	0.477	44%	0.443	S	S	.	.	H	α-helix	trans	-56.7	-44.7	172.8	-167.2	-171.4	21.9	0	0	111.6	A50 C53 F55 G61	A50-Q57 HydrophobicContact CB-CB 4.22Å; A50-Q57 HydrophobicContact CB-CG 4.29Å; A50-Q57 WeakPolarHBondContact O-CB 3.49Å; C53-Q57 PolarHBondContact O-N 2.9Å; F55-Q57 VanDerWaalsContact C-N 3.34Å; F55-Q57 PolarHBondContact O-N 3.13Å; Q57-G61 VanDerWaalsContact O-CA 3.27Å; Q57-G61 WeakPolarHBondContact O-CA 3.45Å; Q57-G61 PolarHBondContact O-N 2.97Å
58	R	92.1	Very high	81.2	Confident	186 Å²	186	77.7 Å²	77.7	70%	0.702	46%	0.455	S	S	*	.	H	α-helix	trans	-72.7	-45	177.7	-71.1	-177.3	-67.8	165	-0.5	112.1	N54 F55 F56 L60 G61	N54-R58 WeakPolarHBondContact O-CG 3.38Å; N54-R58 PolarHBondContact O-N 3.38Å; N54-R58 VanDerWaalsContact O-N 3.15Å; N54-R58 PolarHBondContact O-NE 3.19Å; F55-R58 PolarHBondContact O-N 3.07Å; F56-R58 VanDerWaalsContact C-N 3.29Å; F56-R58 PolarHBondContact O-N 3.07Å; R58-L60 VanDerWaalsContact C-N 3.27Å; R58-L60 PolarHBondContact O-N 3.43Å; R58-G61 PolarHBondContact O-N 2.83Å
59	L	90.3	Very high	79.4	Confident	63 Å²	63	80.4 Å²	80.4	33%	0.33	48%	0.475	S	S	.	.	H	α-helix	trans	-61.2	-37.7	-179.4	-177.3	62.6	0	0	0	112.2	F33 F55 F56 V72	F33-L59 HydrophobicContact CE1-CD2 4.28Å; F55-L59 HydrophobicContact CE1-CD2 3.72Å; F55-L59 HydrophobicContact CZ-CD2 3.96Å; F55-L59 WeakPolarHBondContact O-CB 3.25Å; F55-L59 PolarHBondContact O-N 3.04Å; F56-L59 HydrophobicContact CD1-CD2 4.03Å; F56-L59 HydrophobicContact CE1-CD2 4.26Å; F56-L59 PolarHBondContact O-N 2.87Å; L59-V72 HydrophobicContact CD1-CG1 4.24Å; L59-V72 HydrophobicContact CD2-CG1 3.78Å; L59-V72 HydrophobicContact CG-CG1 4.16Å
60	L	88.6	Confident	77.7	Confident	5 Å²	5	85.3 Å²	85.3	3%	0.026	51%	0.509	C	S	.	.	H	α-helix	trans	-98.2	-18.3	-176.1	-56.9	173.2	0	0	0	112.3	V31 F33 R46 L49 F56 R58 T62 V72	V31-L60 HydrophobicContact CG2-CD2 4.03Å; F33-L60 HydrophobicContact CZ-CD2 4.28Å; R46-L60 HydrophobicContact CB-CD1 4.26Å; R46-L60 HydrophobicContact CG-CD1 4.19Å; R46-L60 PolarHBondContact NH1-O 3.21Å; R46-L60 PolarHBondContact NH2-O 2.71Å; L49-L60 HydrophobicContact CB-CD1 4.12Å; L49-L60 HydrophobicContact CD1-CD1 4.15Å; F56-L60 HydrophobicContact CB-CD1 4.16Å; F56-L60 WeakPolarHBondContact O-CB 3.38Å; F56-L60 VanDerWaalsContact O-CG 3.23Å; F56-L60 WeakPolarHBondContact O-CG 3.48Å; F56-L60 PolarHBondContact O-N 3.27Å; R58-L60 VanDerWaalsContact C-N 3.27Å; R58-L60 PolarHBondContact O-N 3.43Å; L60-T62 PolarHBondContact O-N 2.83Å; L60-V72 HydrophobicContact CD2-CG2 4.38Å
61	G	77.2	Confident	76.7	Confident	62 Å²	62	86.9 Å²	86.9	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-66.5	-18.3	-175.2	0	0	0	0	0	115.4	Q57 R58 E63	Q57-G61 VanDerWaalsContact O-CA 3.27Å; Q57-G61 WeakPolarHBondContact O-CA 3.45Å; Q57-G61 PolarHBondContact O-N 2.97Å; R58-G61 PolarHBondContact O-N 2.83Å; G61-E63 PolarHBondContact O-N 2.95Å
62	T	69.8	Low	76.2	Confident	107 Å²	107	83.7 Å²	83.7	66%	0.656	50%	0.495	S	S	*	.	S	Bend	trans	-77.4	119.5	169.5	31.6	0	0	0	0	110.4	L60	L60-T62 PolarHBondContact O-N 2.83Å
63	E	60.8	Low	75.9	Confident	175 Å²	175	82 Å²	82	82%	0.818	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-57	126.4	170.4	-69.6	-110	131.7	0	0	109	G61 G65	G61-E63 PolarHBondContact O-N 2.95Å; E63-G65 PolarHBondContact O-N 2.96Å
64	P	59.3	Low	75.7	Confident	81 Å²	81	82.6 Å²	82.6	53%	0.526	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-60.2	125.1	169.1	24.3	-29.3	0	0	0	107.7
65	G	57.6	Low	75.4	Confident	53 Å²	53	80.6 Å²	80.6	55%	0.546	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-56.8	167.7	175.3	0	0	0	0	0	111.9	E63 G67	E63-G65 PolarHBondContact O-N 2.96Å; G65-G67 PolarHBondContact O-N 3.24Å
66	P	46.1	Very low	75.1	Confident	153 Å²	153	83.4 Å²	83.4	99%	0.994	52%	0.516	S	S	*	.	S	Bend	trans	-59.7	102.8	-177.3	24.1	-32.4	0	0	0	110.7
67	G	56.7	Low	75.1	Confident	61 Å²	61	83.6 Å²	83.6	63%	0.629	52%	0.517	S	S	*	.	S	Bend	trans	172.2	171.6	-173.8	0	0	0	0	0	111.6	G65	G65-G67 PolarHBondContact O-N 3.24Å
68	V	51.5	Low	75.2	Confident	137 Å²	137	81.7 Å²	81.7	83%	0.83	51%	0.514	S	S	*	.	S	Bend	trans	-57.6	128.5	172.5	178.9	0	0	0	0	108.1	S70	V68-S70 PolarHBondContact O-N 3.49Å
69	P	57.5	Low	75.4	Confident	98 Å²	98	73.6 Å²	73.6	64%	0.636	49%	0.485	S	S	*	.			trans	-58.2	109.7	175.6	21.9	-30.7	0	0	0	108.5
70	S	61.9	Low	75.6	Confident	102 Å²	102	74.8 Å²	74.8	71%	0.713	49%	0.489	S	S	*	.			trans	-63.4	132.5	175.9	-178.5	0	0	0	0	108.1	V68 V72	V68-S70 PolarHBondContact O-N 3.49Å; S70-V72 PolarHBondContact O-N 3.18Å
71	P	72.5	Confident	76.1	Confident	59 Å²	59	74.6 Å²	74.6	38%	0.383	49%	0.488	S	S	.	.			trans	-58.9	141	174.8	23.9	-32.2	0	0	0	109.9	V34 V73	V34-P71 HydrophobicContact CG2-CB 3.63Å; V34-P71 HydrophobicContact CG2-CG 4.14Å; P71-V73 PolarHBondContact O-N 2.86Å
72	V	85.4	Confident	77.1	Confident	32 Å²	32	71.7 Å²	71.7	19%	0.194	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	111	175.6	-179.3	0	0	0	0	107.7	V31 C32 F33 V34 L59 L60 S70 L74	V31-V72 HydrophobicContact CG2-CG2 4.31Å; C32-V72 PolarHBondContact O-N 3.04Å; F33-V72 CarbonylContact C-O 3.56Å; F33-V72 VanDerWaalsContact CA-O 3.25Å; F33-V72 WeakPolarHBondContact CA-O 3.33Å; F33-V72 HydrophobicContact CD1-CB 3.59Å; F33-V72 HydrophobicContact CD1-CG1 3.64Å; F33-V72 HydrophobicContact CE1-CB 3.77Å; F33-V72 HydrophobicContact CE1-CG1 3.6Å; F33-V72 HydrophobicContact CE1-CG2 4.38Å; F33-V72 HydrophobicContact CG-CB 4.46Å; V34-V72 PolarHBondContact N-O 3.07Å; L59-V72 HydrophobicContact CD1-CG1 4.24Å; L59-V72 HydrophobicContact CD2-CG1 3.78Å; L59-V72 HydrophobicContact CG-CG1 4.16Å; L60-V72 HydrophobicContact CD2-CG2 4.38Å; S70-V72 PolarHBondContact O-N 3.18Å; V72-L74 HydrophobicContact CG1-CD2 4.47Å
73	V	90.6	Very high	78.4	Confident	73 Å²	73	68.9 Å²	68.9	44%	0.442	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.2	-175.8	-175	0	0	0	0	110.1	V34 P71	V34-V73 HydrophobicContact CB-CG2 4.32Å; V34-V73 CarbonylContact O-C 3.59Å; V34-V73 WeakPolarHBondContact O-CA 3.23Å; P71-V73 PolarHBondContact O-N 2.86Å
74	L	92.6	Very high	80.2	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.094	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	81.4	174.8	-59.6	178	0	0	0	108.7	F33 V34 V35 G36 V72 V77 F82	F33-L74 HydrophobicContact CD1-CD1 3.61Å; F33-L74 HydrophobicContact CD1-CG 4.04Å; F33-L74 HydrophobicContact CE1-CD1 4.1Å; F33-L74 HydrophobicContact CG-CD1 4.36Å; V34-L74 PolarHBondContact O-N 3.14Å; V35-L74 WeakPolarHBondContact CA-O 3.28Å; G36-L74 PolarHBondContact N-O 3.35Å; V72-L74 HydrophobicContact CG1-CD2 4.47Å; L74-V77 HydrophobicContact CB-CG1 3.82Å; L74-V77 HydrophobicContact CD1-CG1 4.46Å; L74-F82 HydrophobicContact CD1-CD2 3.82Å; L74-F82 HydrophobicContact CD1-CE1 4.48Å; L74-F82 HydrophobicContact CD1-CE2 3.28Å; L74-F82 HydrophobicContact CD1-CZ 3.67Å
75	S	89.3	Confident	82	Confident	75 Å²	75	57.3 Å²	57.3	52%	0.524	38%	0.379	S	S	.	.			trans	-77.6	-21.4	-171.7	51.1	0	0	0	0	114.8
76	T	89.6	Confident	83.9	Confident	109 Å²	109	54.8 Å²	54.8	67%	0.669	35%	0.353	S	S	*	.	S	Bend	trans	-88.2	-30.7	-173.7	54.2	0	0	0	0	113.2
77	V	94.8	Very high	86.4	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.03	32%	0.316	C	S	.	.	S	Bend	trans	-86.2	130.1	-178	70.3	0	0	0	0	110.4	V35 G36 L74 A81 F82 A107 Y111	V35-V77 HydrophobicContact CG1-CG1 3.7Å; V35-V77 WeakPolarHBondContact CG1-O 3.5Å; G36-V77 VanDerWaalsContact CA-O 3.25Å; G36-V77 WeakPolarHBondContact CA-O 3.32Å; G36-V77 PolarHBondContact N-O 2.87Å; L74-V77 HydrophobicContact CB-CG1 3.82Å; L74-V77 HydrophobicContact CD1-CG1 4.46Å; V77-A81 HydrophobicContact CG2-CB 4.12Å; V77-F82 HydrophobicContact CG1-CB 4.05Å; V77-F82 HydrophobicContact CG1-CD2 4.21Å; V77-F82 HydrophobicContact CG1-CG 4.39Å; V77-F82 HydrophobicContact CG2-CB 4.16Å; V77-A107 HydrophobicContact CG2-CB 3.92Å; V77-Y111 WeakPolarHBondContact CG1-OH 3.45Å
78	P	95.4	Very high	88.4	Confident	62 Å²	62	47 Å²	47	40%	0.403	29%	0.287	S	S	.	.			trans	-64.7	146.8	170.9	-25.4	37.9	0	0	0	111.6	E80 A81 F82 E103	P78-E80 VanDerWaalsContact C-N 3.32Å; P78-E80 PolarHBondContact O-N 3.19Å; P78-A81 HydrophobicContact CB-CB 4.49Å; P78-A81 PolarHBondContact O-N 2.86Å; P78-A81 VanDerWaalsContact O-N 3.16Å; P78-F82 PolarHBondContact O-N 3.03Å; P78-E103 HydrophobicContact CG-CB 4.31Å; P78-E103 HydrophobicContact CG-CG 3.96Å
79	T	95.9	Very high	90.6	Very high	15 Å²	15	40.7 Å²	40.7	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-40.1	-176.2	-49.4	0	0	0	0	112.9	Q40 V42 A81 F82 L83	Q40-T79 HydrophobicContact CB-CG2 4.25Å; Q40-T79 HydrophobicContact CG-CG2 4.23Å; Q40-T79 PolarHBondContact OE1-OG1 3.43Å; V42-T79 HydrophobicContact CG2-CG2 3.83Å; T79-A81 VanDerWaalsContact C-N 3.34Å; T79-A81 PolarHBondContact O-N 3.14Å; T79-F82 PolarHBondContact O-N 3.45Å; T79-L83 HydrophobicContact CG2-CD1 4.02Å; T79-L83 HydrophobicContact CG2-CG 4.2Å; T79-L83 WeakPolarHBondContact O-CB 3.33Å; T79-L83 VanDerWaalsContact O-CG 3.3Å; T79-L83 WeakPolarHBondContact O-CG 3.44Å; T79-L83 PolarHBondContact O-N 2.81Å
80	E	95.7	Very high	92.5	Very high	89 Å²	89	36.4 Å²	36.4	42%	0.416	22%	0.22	S	C	.	.	H	α-helix	trans	-58.8	-45.6	177	-173.8	-179.7	164.8	0	0	111.5	P78 F82 L83 A84 H99 S100	P78-E80 VanDerWaalsContact C-N 3.32Å; P78-E80 PolarHBondContact O-N 3.19Å; E80-F82 PolarHBondContact O-N 3.2Å; E80-L83 PolarHBondContact O-N 3.19Å; E80-A84 WeakPolarHBondContact O-CB 3.15Å; E80-A84 PolarHBondContact O-N 3.46Å; E80-H99 IonicContact OE1-CD2 2.75Å; E80-H99 IonicContact OE1-CE1 3.06Å; E80-H99 IonicContact OE1-NE2 3.53Å; E80-H99 PolarHBondContact OE1-NE2 3.39Å; E80-H99 IonicContact OE2-CD2 3.91Å; E80-H99 IonicContact OE2-NE2 2.61Å; E80-H99 PolarHBondContact OE2-NE2 2.85Å; E80-S100 VanDerWaalsContact OE1-CB 3.31Å; E80-S100 WeakPolarHBondContact OE1-CB 3.42Å; E80-S100 PolarHBondContact OE1-OG 3.35Å
81	A	97.4	Very high	94.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-40.4	179	0	0	0	0	0	112	V77 P78 T79 A84 V85 E103 V104	V77-A81 HydrophobicContact CG2-CB 4.12Å; P78-A81 HydrophobicContact CB-CB 4.49Å; P78-A81 PolarHBondContact O-N 2.86Å; P78-A81 VanDerWaalsContact O-N 3.16Å; T79-A81 VanDerWaalsContact C-N 3.34Å; T79-A81 PolarHBondContact O-N 3.14Å; A81-A84 WeakPolarHBondContact O-CB 3.35Å; A81-A84 PolarHBondContact O-N 3.25Å; A81-V85 WeakPolarHBondContact O-CG2 3.35Å; A81-V85 PolarHBondContact O-N 3.25Å; A81-E103 HydrophobicContact CB-CB 3.66Å; A81-V104 HydrophobicContact CB-CG2 4.04Å
82	F	97.8	Very high	95.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-40.5	175.8	-173.6	-110	0	0	0	112.4	F33 V35 V42 F56 L74 V77 P78 T79 E80 A84 V85 L86 Y111	F33-F82 HydrophobicContact CB-CE1 4.08Å; F33-F82 HydrophobicContact CB-CZ 4.28Å; F33-F82 HydrophobicContact CD1-CZ 4.03Å; F33-F82 HydrophobicContact CD2-CE1 4.03Å; F33-F82 AromaticContact CD2-CZ 3.84Å; F33-F82 HydrophobicContact CD2-CZ 3.84Å; F33-F82 HydrophobicContact CE1-CZ 4.31Å; F33-F82 HydrophobicContact CE2-CZ 4.14Å; F33-F82 HydrophobicContact CG-CE1 4.01Å; F33-F82 AromaticContact CG-CZ 3.78Å; F33-F82 HydrophobicContact CG-CZ 3.78Å; F33-F82 HydrophobicContact CZ-CZ 4.36Å; V35-F82 HydrophobicContact CG1-CB 3.82Å; V35-F82 HydrophobicContact CG1-CD1 4.25Å; V35-F82 HydrophobicContact CG1-CG 4.12Å; V35-F82 HydrophobicContact CG2-CD1 3.64Å; V35-F82 HydrophobicContact CG2-CE1 3.87Å; V35-F82 HydrophobicContact CG2-CG 4.21Å; V42-F82 HydrophobicContact CB-CD1 4.21Å; V42-F82 HydrophobicContact CB-CE1 4.06Å; V42-F82 HydrophobicContact CG1-CD1 3.91Å; V42-F82 HydrophobicContact CG1-CE1 3.76Å; V42-F82 HydrophobicContact CG2-CD1 4.29Å; F56-F82 HydrophobicContact CE1-CE2 4.09Å; F56-F82 HydrophobicContact CE1-CZ 4.48Å; F56-F82 AromaticContact CZ-CE2 3.74Å; F56-F82 HydrophobicContact CZ-CE2 3.74Å; F56-F82 HydrophobicContact CZ-CZ 4.42Å; L74-F82 HydrophobicContact CD1-CD2 3.82Å; L74-F82 HydrophobicContact CD1-CE1 4.48Å; L74-F82 HydrophobicContact CD1-CE2 3.28Å; L74-F82 HydrophobicContact CD1-CZ 3.67Å; V77-F82 HydrophobicContact CG1-CB 4.05Å; V77-F82 HydrophobicContact CG1-CD2 4.21Å; V77-F82 HydrophobicContact CG1-CG 4.39Å; V77-F82 HydrophobicContact CG2-CB 4.16Å; P78-F82 PolarHBondContact O-N 3.03Å; T79-F82 PolarHBondContact O-N 3.45Å; E80-F82 PolarHBondContact O-N 3.2Å; F82-A84 VanDerWaalsContact C-N 3.32Å; F82-A84 PolarHBondContact O-N 2.89Å; F82-V85 WeakPolarHBondContact O-CB 3.4Å; F82-V85 PolarHBondContact O-N 3.46Å; F82-L86 HydrophobicContact CD1-CD1 3.97Å; F82-L86 HydrophobicContact CD1-CG 4.22Å; F82-L86 HydrophobicContact CE1-CD1 3.63Å; F82-L86 HydrophobicContact CE1-CD2 4.26Å; F82-L86 HydrophobicContact CE1-CG 3.95Å; F82-L86 HydrophobicContact CZ-CD1 4.3Å; F82-L86 HydrophobicContact CZ-CD2 4.11Å; F82-L86 HydrophobicContact CZ-CG 4.21Å; F82-L86 WeakPolarHBondContact O-CG 3Å; F82-L86 PolarHBondContact O-N 2.82Å; F82-Y111 HydrophobicContact CD2-CE2 4.17Å; F82-Y111 HydrophobicContact CE2-CE2 4.46Å
83	L	97.6	Very high	95.8	Very high	49 Å²	49	34 Å²	34	26%	0.257	20%	0.2	S	C	.	.	H	α-helix	trans	-62.8	-39.3	174.6	-72.4	172.4	0	0	0	111.8	N24 V42 T79 E80 L86 E87	N24-L83 HydrophobicContact CB-CD2 3.73Å; V42-L83 HydrophobicContact CG1-CD2 3.85Å; T79-L83 HydrophobicContact CG2-CD1 4.02Å; T79-L83 HydrophobicContact CG2-CG 4.2Å; T79-L83 WeakPolarHBondContact O-CB 3.33Å; T79-L83 VanDerWaalsContact O-CG 3.3Å; T79-L83 WeakPolarHBondContact O-CG 3.44Å; T79-L83 PolarHBondContact O-N 2.81Å; E80-L83 PolarHBondContact O-N 3.19Å; L83-L86 HydrophobicContact CD2-CD1 4.46Å; L83-L86 PolarHBondContact O-N 3.28Å; L83-E87 PolarHBondContact O-N 2.87Å
84	A	98.1	Very high	96	Very high	12 Å²	12	31.8 Å²	31.8	10%	0.099	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-42.8	174.6	0	0	0	0	0	111.6	E80 A81 F82 E87 F88 V94 V104	E80-A84 WeakPolarHBondContact O-CB 3.15Å; E80-A84 PolarHBondContact O-N 3.46Å; A81-A84 WeakPolarHBondContact O-CB 3.35Å; A81-A84 PolarHBondContact O-N 3.25Å; F82-A84 VanDerWaalsContact C-N 3.32Å; F82-A84 PolarHBondContact O-N 2.89Å; A84-E87 PolarHBondContact O-N 3.46Å; A84-F88 PolarHBondContact O-N 2.93Å; A84-V94 HydrophobicContact CB-CG2 3.68Å; A84-V94 WeakPolarHBondContact O-CG2 3.31Å; A84-V104 HydrophobicContact CB-CG1 4.3Å; A84-V104 HydrophobicContact CB-CG2 3.68Å
85	V	98.3	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-46.4	172.2	166	0	0	0	0	111.1	F56 A81 F82 F88 L89 A107 Y111 L113 L116	F56-V85 HydrophobicContact CE2-CG1 4.44Å; A81-V85 WeakPolarHBondContact O-CG2 3.35Å; A81-V85 PolarHBondContact O-N 3.25Å; F82-V85 WeakPolarHBondContact O-CB 3.4Å; F82-V85 PolarHBondContact O-N 3.46Å; V85-F88 PolarHBondContact O-N 3.25Å; V85-L89 HydrophobicContact CG1-CD1 3.96Å; V85-L89 HydrophobicContact CG1-CG 4.39Å; V85-L89 WeakPolarHBondContact O-CG 3.44Å; V85-L89 PolarHBondContact O-N 3.19Å; V85-A107 HydrophobicContact CG2-CB 3.87Å; V85-Y111 HydrophobicContact CG1-CD2 3.96Å; V85-Y111 HydrophobicContact CG1-CE2 4.31Å; V85-Y111 HydrophobicContact CG2-CD2 4.37Å; V85-Y111 HydrophobicContact CG2-CE2 4.5Å; V85-L113 HydrophobicContact CG1-CD1 3.69Å; V85-L116 HydrophobicContact CG2-CD2 4.01Å
86	L	97.9	Very high	96.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-46.2	177.5	-72	-177.5	0	0	0	111.5	V23 V42 A44 L49 F82 L83 F88 L89 Y90	V23-L86 HydrophobicContact CG1-CB 4.2Å; V42-L86 HydrophobicContact CG1-CD1 3.43Å; V42-L86 VanDerWaalsContact CG1-CD1 3.43Å; A44-L86 HydrophobicContact CB-CD2 4.24Å; L49-L86 HydrophobicContact CD1-CD2 4.21Å; L49-L86 HydrophobicContact CD2-CD2 3.47Å; L49-L86 VanDerWaalsContact CD2-CD2 3.47Å; L49-L86 HydrophobicContact CG-CD2 4.46Å; F82-L86 HydrophobicContact CD1-CD1 3.97Å; F82-L86 HydrophobicContact CD1-CG 4.22Å; F82-L86 HydrophobicContact CE1-CD1 3.63Å; F82-L86 HydrophobicContact CE1-CD2 4.26Å; F82-L86 HydrophobicContact CE1-CG 3.95Å; F82-L86 HydrophobicContact CZ-CD1 4.3Å; F82-L86 HydrophobicContact CZ-CD2 4.11Å; F82-L86 HydrophobicContact CZ-CG 4.21Å; F82-L86 WeakPolarHBondContact O-CG 3Å; F82-L86 PolarHBondContact O-N 2.82Å; L83-L86 HydrophobicContact CD2-CD1 4.46Å; L83-L86 PolarHBondContact O-N 3.28Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3Å; L86-L89 PolarHBondContact O-N 3.03Å; L86-L89 VanDerWaalsContact O-N 3.17Å; L86-Y90 HydrophobicContact CD2-CE2 4.44Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å; L86-Y90 PolarHBondContact O-N 3.27Å
87	E	97.9	Very high	96.8	Very high	44 Å²	44	33.7 Å²	33.7	21%	0.206	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-44.6	176.9	-167.1	-174.4	164.6	0	0	111.1	R20 L83 A84 L89 Y90 T91 S93	R20-E87 IonicContact CZ-OE1 3.06Å; R20-E87 IonicContact NE-OE1 3.08Å; R20-E87 PolarHBondContact NE-OE1 3.39Å; R20-E87 IonicContact NH2-OE1 3.87Å; R20-E87 PolarHBondContact NH2-OE1 2.95Å; L83-E87 PolarHBondContact O-N 2.87Å; A84-E87 PolarHBondContact O-N 3.46Å; E87-L89 PolarHBondContact O-N 3.46Å; E87-Y90 PolarHBondContact O-N 3.48Å; E87-T91 HydrophobicContact CG-CG2 4.44Å; E87-T91 WeakPolarHBondContact O-CB 3.36Å; E87-T91 WeakPolarHBondContact O-CG2 3.47Å; E87-T91 PolarHBondContact O-N 2.96Å; E87-T91 PolarHBondContact O-OG1 3.48Å; E87-S93 CarbonylContact C-O 3.46Å
88	F	98.4	Very high	96.9	Very high	7 Å²	7	38.2 Å²	38.2	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-43.1	177.1	-173.9	-97.2	0	0	0	112.5	A84 V85 L86 Y90 T91 N92 S93 V94 E115 L116 L119	A84-F88 PolarHBondContact O-N 2.93Å; V85-F88 PolarHBondContact O-N 3.25Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3Å; F88-Y90 VanDerWaalsContact C-N 3.3Å; F88-Y90 PolarHBondContact O-N 2.92Å; F88-T91 PolarHBondContact O-N 3.19Å; F88-N92 VanDerWaalsContact O-CA 3.24Å; F88-N92 WeakPolarHBondContact O-CA 3.33Å; F88-N92 PolarHBondContact O-N 3.15Å; F88-S93 WeakPolarHBondContact CA-O 3.32Å; F88-S93 PolarHBondContact N-O 3.12Å; F88-V94 HydrophobicContact CB-CB 4.26Å; F88-V94 HydrophobicContact CB-CG1 4.43Å; F88-V94 HydrophobicContact CD2-CG1 4.14Å; F88-E115 HydrophobicContact CZ-CB 4.07Å; F88-E115 HydrophobicContact CZ-CG 4.04Å; F88-L116 HydrophobicContact CB-CD1 4.36Å; F88-L116 HydrophobicContact CB-CD2 4.13Å; F88-L116 HydrophobicContact CD1-CB 3.86Å; F88-L116 HydrophobicContact CD1-CD2 4.15Å; F88-L116 HydrophobicContact CD1-CG 4.41Å; F88-L116 HydrophobicContact CD2-CB 4.45Å; F88-L116 HydrophobicContact CD2-CD1 3.95Å; F88-L116 HydrophobicContact CE1-CB 3.82Å; F88-L116 HydrophobicContact CE2-CB 4.41Å; F88-L116 HydrophobicContact CE2-CD1 4.43Å; F88-L116 HydrophobicContact CG-CB 4.18Å; F88-L116 HydrophobicContact CG-CD1 4.02Å; F88-L116 HydrophobicContact CG-CD2 4.12Å; F88-L116 HydrophobicContact CG-CG 4.33Å; F88-L116 HydrophobicContact CZ-CB 4.1Å; F88-L119 HydrophobicContact CE2-CD1 3.92Å
89	L	98.1	Very high	96.8	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-37.9	178.5	-70.6	173.5	0	0	0	112.2	L49 R52 C53 F56 V85 L86 E87 L113	L49-L89 HydrophobicContact CD2-CB 4.32Å; L49-L89 HydrophobicContact CD2-CD1 3.54Å; R52-L89 HydrophobicContact CB-CD2 3.7Å; R52-L89 PolarHBondContact NE-O 3.18Å; C53-L89 HydrophobicContact CB-CD1 4.47Å; C53-L89 HydrophobicContact CB-CD2 3.89Å; F56-L89 HydrophobicContact CD2-CD1 3.87Å; F56-L89 HydrophobicContact CE2-CD1 3.76Å; V85-L89 HydrophobicContact CG1-CD1 3.96Å; V85-L89 HydrophobicContact CG1-CG 4.39Å; V85-L89 WeakPolarHBondContact O-CG 3.44Å; V85-L89 PolarHBondContact O-N 3.19Å; L86-L89 PolarHBondContact O-N 3.03Å; L86-L89 VanDerWaalsContact O-N 3.17Å; E87-L89 PolarHBondContact O-N 3.46Å; L89-L113 HydrophobicContact CD2-CD1 4.24Å; L89-L113 HydrophobicContact CD2-CD2 3.72Å; L89-L113 HydrophobicContact CG-CD1 4.5Å
90	Y	97.6	Very high	96.8	Very high	8 Å²	8	40.5 Å²	40.5	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-79	-34.9	-178.4	-80.3	-124	0	0	0	112.5	L19 L22 V23 A44 H45 L48 L49 L86 E87 F88	L19-Y90 WeakPolarHBondContact CD1-O 3.31Å; L19-Y90 WeakPolarHBondContact O-CD1 3.45Å; L22-Y90 HydrophobicContact CB-CD1 4.08Å; L22-Y90 HydrophobicContact CB-CE1 3.78Å; V23-Y90 HydrophobicContact CG2-CD1 3.95Å; V23-Y90 HydrophobicContact CG2-CD2 4.38Å; V23-Y90 HydrophobicContact CG2-CG 3.84Å; A44-Y90 WeakPolarHBondContact CA-OH 3.41Å; H45-Y90 PolarHBondContact N-OH 3.42Å; H45-Y90 AromaticContact ND1-CE1 3.65Å; H45-Y90 AromaticContact ND1-CZ 3.67Å; H45-Y90 PolarHBondContact ND1-OH 3.24Å; L48-Y90 HydrophobicContact CB-CE2 4.38Å; L48-Y90 HydrophobicContact CD1-CD1 3.61Å; L48-Y90 HydrophobicContact CD1-CE1 3.33Å; L48-Y90 HydrophobicContact CD1-CE2 4.34Å; L48-Y90 HydrophobicContact CD1-CG 4.23Å; L49-Y90 HydrophobicContact CD2-CE2 4Å; L86-Y90 HydrophobicContact CD2-CE2 4.44Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å; L86-Y90 PolarHBondContact O-N 3.27Å; E87-Y90 PolarHBondContact O-N 3.48Å; F88-Y90 VanDerWaalsContact C-N 3.3Å; F88-Y90 PolarHBondContact O-N 2.92Å
91	T	96.9	Very high	96.9	Very high	17 Å²	17	36.2 Å²	36.2	10%	0.104	18%	0.179	C	C	.	.	H	α-helix	trans	-124.4	-7.4	-163.2	73	0	0	0	0	114.6	S16 L19 R20 E87 F88 S93	S16-T91 WeakPolarHBondContact OG-CB 3.07Å; L19-T91 HydrophobicContact CB-CG2 4.48Å; R20-T91 HydrophobicContact CB-CG2 3.74Å; R20-T91 HydrophobicContact CG-CG2 4.34Å; R20-T91 PolarHBondContact NH2-OG1 3.1Å; E87-T91 HydrophobicContact CG-CG2 4.44Å; E87-T91 WeakPolarHBondContact O-CB 3.36Å; E87-T91 WeakPolarHBondContact O-CG2 3.47Å; E87-T91 PolarHBondContact O-N 2.96Å; E87-T91 PolarHBondContact O-OG1 3.48Å; F88-T91 PolarHBondContact O-N 3.19Å; T91-S93 PolarHBondContact O-N 3.05Å; T91-S93 PolarHBondContact OG1-N 3.16Å; T91-S93 PolarHBondContact OG1-O 2.96Å
92	N	96	Very high	96.9	Very high	67 Å²	67	36.5 Å²	36.5	36%	0.358	18%	0.18	S	C	.	.	S	Bend	trans	55	26.3	-168.5	-149.4	78.5	0	0	0	113.2	R52 F88 E115	R52-N92 PolarHBondContact NH2-OD1 2.86Å; F88-N92 VanDerWaalsContact O-CA 3.24Å; F88-N92 WeakPolarHBondContact O-CA 3.33Å; F88-N92 PolarHBondContact O-N 3.15Å; N92-E115 PolarHBondContact ND2-OE1 3.39Å
93	S	95.4	Very high	96.9	Very high	57 Å²	57	39.7 Å²	39.7	40%	0.399	20%	0.195	S	C	.	.			trans	-149	145.9	-176	-175.3	0	0	0	0	109.2	E87 F88 T91	E87-S93 CarbonylContact C-O 3.46Å; F88-S93 WeakPolarHBondContact CA-O 3.32Å; F88-S93 PolarHBondContact N-O 3.12Å; T91-S93 PolarHBondContact O-N 3.05Å; T91-S93 PolarHBondContact OG1-N 3.16Å; T91-S93 PolarHBondContact OG1-O 2.96Å
94	V	96.3	Very high	97	Very high	27 Å²	27	37.4 Å²	37.4	16%	0.164	18%	0.183	C	C	.	.			trans	-154.5	145	177.2	63	0	0	0	0	109.4	A84 F88 L96 L116	A84-V94 HydrophobicContact CB-CG2 3.68Å; A84-V94 WeakPolarHBondContact O-CG2 3.31Å; F88-V94 HydrophobicContact CB-CB 4.26Å; F88-V94 HydrophobicContact CB-CG1 4.43Å; F88-V94 HydrophobicContact CD2-CG1 4.14Å; V94-L96 HydrophobicContact CG1-CD2 3.98Å; V94-L96 HydrophobicContact CG1-CG 4.25Å; V94-L116 HydrophobicContact CG1-CD1 3.66Å
95	K	95.1	Very high	97	Very high	149 Å²	149	36.8 Å²	36.8	65%	0.648	18%	0.178	S	C	*	.			trans	-89.5	109.6	172.1	-171.1	178.8	-178.5	-177.1	0	109.5
96	L	96.5	Very high	97	Very high	28 Å²	28	38.4 Å²	38.4	15%	0.147	19%	0.188	C	C	.	.			trans	-84.8	140.1	175.7	-61.2	177.8	0	0	0	111	V94 V101 V104 F123	V94-L96 HydrophobicContact CG1-CD2 3.98Å; V94-L96 HydrophobicContact CG1-CG 4.25Å; L96-V101 HydrophobicContact CD1-CG2 4.42Å; L96-V104 HydrophobicContact CD2-CB 4.34Å; L96-V104 HydrophobicContact CD2-CG1 3.92Å; L96-F123 HydrophobicContact CB-CD1 3.82Å; L96-F123 HydrophobicContact CB-CE1 3.99Å; L96-F123 HydrophobicContact CB-CG 4.11Å; L96-F123 HydrophobicContact CB-CZ 4.44Å; L96-F123 HydrophobicContact CD1-CB 3.82Å; L96-F123 HydrophobicContact CD1-CD1 4.35Å; L96-F123 HydrophobicContact CD1-CG 4.14Å
97	H	96.2	Very high	97	Very high	66 Å²	66	38.5 Å²	38.5	31%	0.306	19%	0.188	S	C	.	.			trans	-120.6	147.4	176.4	-65.7	-83.4	0	0	0	110.3	H99 S100 V101	H97-H99 VanDerWaalsContact C-N 3.26Å; H97-H99 WeakPolarHBondContact CB-CE1 3.37Å; H97-H99 AromaticContact CG-CE1 3.75Å; H97-H99 PolarHBondContact O-N 2.96Å; H97-S100 PolarHBondContact O-N 3.39Å; H97-V101 WeakPolarHBondContact O-CB 3.24Å; H97-V101 PolarHBondContact O-N 3.37Å
98	R	95.6	Very high	97	Very high	99 Å²	99	36.4 Å²	36.4	37%	0.374	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-41.7	-178.8	175.3	-175.6	167.9	-103.8	2.9	111.8	S100 V127 D129 E131	R98-S100 VanDerWaalsContact C-N 3.29Å; R98-S100 PolarHBondContact O-N 2.73Å; R98-V127 HydrophobicContact CB-CG2 4.43Å; R98-V127 HydrophobicContact CG-CB 4.44Å; R98-V127 HydrophobicContact CG-CG2 4.28Å; R98-D129 IonicContact CZ-OD1 2.67Å; R98-D129 IonicContact CZ-OD2 2.81Å; R98-D129 IonicContact NE-OD2 3.66Å; R98-D129 PolarHBondContact NE-OD2 3.46Å; R98-D129 IonicContact NH2-OD1 3.58Å; R98-D129 PolarHBondContact NH2-OD1 2.93Å; R98-D129 IonicContact NH2-OD2 3.97Å; R98-D129 PolarHBondContact NH2-OD2 3.36Å; R98-E131 IonicContact CZ-OE2 3.3Å; R98-E131 IonicContact NH1-OE2 2.82Å; R98-E131 IonicContact NH2-OE2 2.87Å; R98-E131 PolarHBondContact NH2-OE2 3.41Å
99	H	94.8	Very high	97	Very high	117 Å²	117	38 Å²	38	54%	0.542	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-9.2	-174.3	67.1	-87.4	0	0	0	114.5	E80 H97	E80-H99 IonicContact OE1-CD2 2.75Å; E80-H99 IonicContact OE1-CE1 3.06Å; E80-H99 IonicContact OE1-NE2 3.53Å; E80-H99 PolarHBondContact OE1-NE2 3.39Å; E80-H99 IonicContact OE2-CD2 3.91Å; E80-H99 IonicContact OE2-NE2 2.61Å; E80-H99 PolarHBondContact OE2-NE2 2.85Å; H97-H99 VanDerWaalsContact C-N 3.26Å; H97-H99 WeakPolarHBondContact CB-CE1 3.37Å; H97-H99 AromaticContact CG-CE1 3.75Å; H97-H99 PolarHBondContact O-N 2.96Å
100	S	95.8	Very high	96.9	Very high	8 Å²	8	42.1 Å²	42.1	6%	0.056	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-1.3	-177.4	57.3	0	0	0	0	114.3	E80 H97 R98 L102 E103 V104	E80-S100 VanDerWaalsContact OE1-CB 3.31Å; E80-S100 WeakPolarHBondContact OE1-CB 3.42Å; E80-S100 PolarHBondContact OE1-OG 3.35Å; H97-S100 PolarHBondContact O-N 3.39Å; R98-S100 VanDerWaalsContact C-N 3.29Å; R98-S100 PolarHBondContact O-N 2.73Å; S100-L102 VanDerWaalsContact C-N 3.32Å; S100-L102 PolarHBondContact O-N 3.04Å; S100-E103 WeakPolarHBondContact CA-OE2 3.49Å; S100-E103 PolarHBondContact O-N 3.45Å; S100-E103 VanDerWaalsContact O-OE2 3.13Å; S100-V104 VanDerWaalsContact O-CG2 3.3Å; S100-V104 WeakPolarHBondContact O-CG2 3.23Å; S100-V104 PolarHBondContact O-N 3.07Å; S100-V104 VanDerWaalsContact O-N 3.07Å
101	V	97.8	Very high	96.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-33.3	-174.9	62.2	0	0	0	0	112.7	L96 H97 E103 V104 L105 C120 F123 V124	L96-V101 HydrophobicContact CD1-CG2 4.42Å; H97-V101 WeakPolarHBondContact O-CB 3.24Å; H97-V101 PolarHBondContact O-N 3.37Å; V101-E103 VanDerWaalsContact C-N 3.35Å; V101-V104 PolarHBondContact O-N 3.07Å; V101-L105 VanDerWaalsContact O-CB 3.27Å; V101-L105 WeakPolarHBondContact O-CB 3.44Å; V101-L105 PolarHBondContact O-N 2.67Å; V101-C120 HydrophobicContact CG2-CB 4.11Å; V101-F123 HydrophobicContact CB-CD1 3.96Å; V101-F123 HydrophobicContact CB-CE1 4.33Å; V101-F123 HydrophobicContact CG1-CD1 4.27Å; V101-F123 HydrophobicContact CG2-CD1 3.77Å; V101-V124 HydrophobicContact CB-CG2 4.36Å; V101-V124 HydrophobicContact CG1-CG2 3.79Å; V101-V124 HydrophobicContact CG2-CG2 3.62Å
102	L	98	Very high	96.9	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-71.3	-34.6	-178.1	-68.4	-175.6	0	0	0	111.6	S100 L105 T106 V124 L132 E135 A136 V139	S100-L102 VanDerWaalsContact C-N 3.32Å; S100-L102 PolarHBondContact O-N 3.04Å; L102-L105 HydrophobicContact CD2-CD2 4.49Å; L102-L105 PolarHBondContact O-N 3.4Å; L102-T106 WeakPolarHBondContact O-CB 3.25Å; L102-T106 PolarHBondContact O-N 3Å; L102-T106 PolarHBondContact O-OG1 3.15Å; L102-V124 HydrophobicContact CD2-CG1 4.29Å; L102-V124 HydrophobicContact CD2-CG2 3.87Å; L102-L132 HydrophobicContact CD1-CD1 3.47Å; L102-L132 VanDerWaalsContact CD1-CD1 3.47Å; L102-L132 HydrophobicContact CD1-CG 4.3Å; L102-L132 HydrophobicContact CG-CD1 3.89Å; L102-E135 HydrophobicContact CD1-CB 3.45Å; L102-E135 VanDerWaalsContact CD1-CB 3.45Å; L102-A136 HydrophobicContact CD1-CB 4.34Å; L102-A136 HydrophobicContact CD2-CB 4.02Å; L102-V139 HydrophobicContact CB-CG2 4.36Å; L102-V139 HydrophobicContact CD2-CG2 4.49Å
103	E	97.7	Very high	96.9	Very high	66 Å²	66	41.7 Å²	41.7	31%	0.308	22%	0.219	S	C	.	.	H	α-helix	trans	-68.5	-42.7	173.7	-62.9	76.5	-178.4	0	0	110.5	P78 A81 S100 V101 T106 A107	P78-E103 HydrophobicContact CG-CB 4.31Å; P78-E103 HydrophobicContact CG-CG 3.96Å; A81-E103 HydrophobicContact CB-CB 3.66Å; S100-E103 WeakPolarHBondContact CA-OE2 3.49Å; S100-E103 PolarHBondContact O-N 3.45Å; S100-E103 VanDerWaalsContact O-OE2 3.13Å; V101-E103 VanDerWaalsContact C-N 3.35Å; E103-T106 PolarHBondContact O-N 3.22Å; E103-A107 WeakPolarHBondContact O-CB 3.29Å; E103-A107 PolarHBondContact O-N 3.24Å
104	V	98.4	Very high	97	Very high	1 Å²	1	44 Å²	44	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-41.9	174.5	-178.9	0	0	0	0	110.9	A81 A84 L96 S100 V101 T106 A107 A108 L116	A81-V104 HydrophobicContact CB-CG2 4.04Å; A84-V104 HydrophobicContact CB-CG1 4.3Å; A84-V104 HydrophobicContact CB-CG2 3.68Å; L96-V104 HydrophobicContact CD2-CB 4.34Å; L96-V104 HydrophobicContact CD2-CG1 3.92Å; S100-V104 VanDerWaalsContact O-CG2 3.3Å; S100-V104 WeakPolarHBondContact O-CG2 3.23Å; S100-V104 PolarHBondContact O-N 3.07Å; S100-V104 VanDerWaalsContact O-N 3.07Å; V101-V104 PolarHBondContact O-N 3.07Å; V104-T106 VanDerWaalsContact C-N 3.34Å; V104-T106 PolarHBondContact O-N 2.8Å; V104-A107 PolarHBondContact O-N 3.06Å; V104-A108 VanDerWaalsContact O-CB 3.31Å; V104-A108 WeakPolarHBondContact O-CB 3.36Å; V104-A108 PolarHBondContact O-N 3.48Å; V104-L116 HydrophobicContact CG1-CD1 4.27Å; V104-L116 HydrophobicContact CG1-CD2 4.2Å; V104-L116 HydrophobicContact CG1-CG 4.39Å
105	L	98.6	Very high	97.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-46.1	175	175.1	58.6	0	0	0	110.8	V101 L102 A108 V109 R117 C120 L121 V124 V139 L145 L148	V101-L105 VanDerWaalsContact O-CB 3.27Å; V101-L105 WeakPolarHBondContact O-CB 3.44Å; V101-L105 PolarHBondContact O-N 2.67Å; L102-L105 HydrophobicContact CD2-CD2 4.49Å; L102-L105 PolarHBondContact O-N 3.4Å; L105-A108 PolarHBondContact O-N 2.69Å; L105-V109 HydrophobicContact CD1-CG2 4.43Å; L105-V109 WeakPolarHBondContact O-CG2 3.41Å; L105-V109 PolarHBondContact O-N 2.68Å; L105-R117 HydrophobicContact CD1-CB 4.45Å; L105-R117 HydrophobicContact CD1-CG 3.64Å; L105-C120 HydrophobicContact CB-CB 3.87Å; L105-C120 HydrophobicContact CD1-CB 3.91Å; L105-C120 HydrophobicContact CG-CB 4.41Å; L105-L121 HydrophobicContact CD1-CD2 4.13Å; L105-L121 HydrophobicContact CD1-CG 4.03Å; L105-L121 HydrophobicContact CD2-CD2 3.92Å; L105-V124 HydrophobicContact CD2-CG2 4.45Å; L105-V139 HydrophobicContact CD2-CG1 3.91Å; L105-V139 HydrophobicContact CG-CG1 4.29Å; L105-L145 HydrophobicContact CD2-CD1 4.24Å; L105-L148 HydrophobicContact CD2-CD2 4.2Å
106	T	97.9	Very high	97.3	Very high	34 Å²	34	40.6 Å²	40.6	21%	0.209	21%	0.208	C	C	.	.	H	α-helix	trans	-59.1	-50.8	177.3	-64.6	0	0	0	0	110.8	L102 E103 V104 A108 V109 E110 F143	L102-T106 WeakPolarHBondContact O-CB 3.25Å; L102-T106 PolarHBondContact O-N 3Å; L102-T106 PolarHBondContact O-OG1 3.15Å; E103-T106 PolarHBondContact O-N 3.22Å; V104-T106 VanDerWaalsContact C-N 3.34Å; V104-T106 PolarHBondContact O-N 2.8Å; T106-A108 VanDerWaalsContact C-N 3.31Å; T106-A108 PolarHBondContact O-N 2.67Å; T106-V109 PolarHBondContact O-N 3.21Å; T106-V109 VanDerWaalsContact O-N 3.17Å; T106-E110 WeakPolarHBondContact O-CG 3.39Å; T106-E110 PolarHBondContact O-N 2.99Å; T106-F143 HydrophobicContact CG2-CE2 3.83Å; T106-F143 HydrophobicContact CG2-CZ 3.67Å
107	A	97.9	Very high	97.3	Very high	1 Å²	1	42 Å²	42	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-38.4	177.5	0	0	0	0	0	112.4	V77 V85 E103 V104 V109 E110 Y111	V77-A107 HydrophobicContact CG2-CB 3.92Å; V85-A107 HydrophobicContact CG2-CB 3.87Å; E103-A107 WeakPolarHBondContact O-CB 3.29Å; E103-A107 PolarHBondContact O-N 3.24Å; V104-A107 PolarHBondContact O-N 3.06Å; A107-V109 VanDerWaalsContact C-N 3.34Å; A107-V109 PolarHBondContact O-N 3.12Å; A107-E110 PolarHBondContact O-N 3.32Å; A107-Y111 HydrophobicContact CB-CD2 4.29Å; A107-Y111 HydrophobicContact CB-CE2 3.99Å; A107-Y111 WeakPolarHBondContact O-CB 3.41Å; A107-Y111 VanDerWaalsContact O-CD2 3.24Å; A107-Y111 WeakPolarHBondContact O-CD2 3.31Å; A107-Y111 VanDerWaalsContact O-CG 3.24Å; A107-Y111 PolarHBondContact O-N 2.61Å
108	A	98.3	Very high	97.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-40.1	176.4	0	0	0	0	0	111.9	V104 L105 T106 G112 L113 L116 R117	V104-A108 VanDerWaalsContact O-CB 3.31Å; V104-A108 WeakPolarHBondContact O-CB 3.36Å; V104-A108 PolarHBondContact O-N 3.48Å; L105-A108 PolarHBondContact O-N 2.69Å; T106-A108 VanDerWaalsContact C-N 3.31Å; T106-A108 PolarHBondContact O-N 2.67Å; A108-G112 PolarHBondContact O-N 3.13Å; A108-G112 VanDerWaalsContact O-N 3.11Å; A108-L113 HydrophobicContact CB-CB 4.31Å; A108-L113 PolarHBondContact O-N 3.26Å; A108-L116 HydrophobicContact CB-CB 4.14Å; A108-L116 HydrophobicContact CB-CD2 3.99Å; A108-L116 HydrophobicContact CB-CG 3.87Å; A108-R117 HydrophobicContact CB-CB 4.24Å
109	V	97.5	Very high	97.6	Very high	41 Å²	41	40.8 Å²	40.8	25%	0.248	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-49.6	174.5	176	0	0	0	0	110.9	L105 T106 A107 Y111 G112 R117 F143	L105-V109 HydrophobicContact CD1-CG2 4.43Å; L105-V109 WeakPolarHBondContact O-CG2 3.41Å; L105-V109 PolarHBondContact O-N 2.68Å; T106-V109 PolarHBondContact O-N 3.21Å; T106-V109 VanDerWaalsContact O-N 3.17Å; A107-V109 VanDerWaalsContact C-N 3.34Å; A107-V109 PolarHBondContact O-N 3.12Å; V109-Y111 VanDerWaalsContact C-N 3.32Å; V109-Y111 PolarHBondContact O-N 3.06Å; V109-G112 PolarHBondContact O-N 3.42Å; V109-G112 VanDerWaalsContact O-N 3.15Å; V109-R117 HydrophobicContact CG2-CG 3.85Å; V109-F143 HydrophobicContact CB-CD1 4.24Å; V109-F143 HydrophobicContact CB-CG 4.43Å; V109-F143 HydrophobicContact CG1-CB 4.21Å; V109-F143 HydrophobicContact CG1-CD1 3.48Å; V109-F143 VanDerWaalsContact CG1-CD1 3.48Å; V109-F143 HydrophobicContact CG1-CE1 4.04Å; V109-F143 HydrophobicContact CG1-CG 3.92Å
110	E	96.1	Very high	97.7	Very high	91 Å²	91	35.2 Å²	35.2	43%	0.425	19%	0.186	S	C	.	.	H	α-helix	trans	-61.6	-38.6	-177.8	-71.1	-173.9	152.9	0	0	112.9	T106 A107 F143	T106-E110 WeakPolarHBondContact O-CG 3.39Å; T106-E110 PolarHBondContact O-N 2.99Å; A107-E110 PolarHBondContact O-N 3.32Å; E110-F143 HydrophobicContact CG-CE1 4.39Å
111	Y	96.9	Very high	97.8	Very high	12 Å²	12	36.2 Å²	36.2	5%	0.047	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.1	179.6	-55.1	-26.4	0	0	0	113.6	C53 F55 F56 V77 F82 V85 A107 V109	C53-Y111 PolarHBondContact SG-O 3.32Å; C53-Y111 VanDerWaalsContact SG-O 3.35Å; F55-Y111 WeakPolarHBondContact CB-O 3.29Å; F55-Y111 AromaticContact CD1-CD1 3.49Å; F55-Y111 HydrophobicContact CD1-CD1 3.49Å; F55-Y111 VanDerWaalsContact CD1-CD1 3.49Å; F55-Y111 HydrophobicContact CD1-CE1 4.11Å; F55-Y111 AromaticContact CD1-CG 3.99Å; F55-Y111 HydrophobicContact CD1-CG 3.99Å; F55-Y111 HydrophobicContact CD2-CD1 4.24Å; F55-Y111 AromaticContact CE1-CD1 3.46Å; F55-Y111 HydrophobicContact CE1-CD1 3.46Å; F55-Y111 VanDerWaalsContact CE1-CD1 3.46Å; F55-Y111 AromaticContact CE1-CE1 3.58Å; F55-Y111 HydrophobicContact CE1-CE1 3.58Å; F55-Y111 HydrophobicContact CE1-CG 4.29Å; F55-Y111 HydrophobicContact CE2-CD1 4.22Å; F55-Y111 HydrophobicContact CE2-CE1 4.5Å; F55-Y111 AromaticContact CG-CD1 3.91Å; F55-Y111 HydrophobicContact CG-CD1 3.91Å; F55-Y111 HydrophobicContact CG-CG 4.44Å; F55-Y111 AromaticContact CZ-CD1 3.84Å; F55-Y111 HydrophobicContact CZ-CD1 3.84Å; F55-Y111 AromaticContact CZ-CE1 3.81Å; F55-Y111 HydrophobicContact CZ-CE1 3.81Å; F56-Y111 HydrophobicContact CE2-CD2 4.19Å; F56-Y111 HydrophobicContact CE2-CG 4.41Å; F56-Y111 HydrophobicContact CZ-CD2 4.09Å; F56-Y111 HydrophobicContact CZ-CE2 4.11Å; F56-Y111 HydrophobicContact CZ-CG 4.4Å; V77-Y111 WeakPolarHBondContact CG1-OH 3.45Å; F82-Y111 HydrophobicContact CD2-CE2 4.17Å; F82-Y111 HydrophobicContact CE2-CE2 4.46Å; V85-Y111 HydrophobicContact CG1-CD2 3.96Å; V85-Y111 HydrophobicContact CG1-CE2 4.31Å; V85-Y111 HydrophobicContact CG2-CD2 4.37Å; V85-Y111 HydrophobicContact CG2-CE2 4.5Å; A107-Y111 HydrophobicContact CB-CD2 4.29Å; A107-Y111 HydrophobicContact CB-CE2 3.99Å; A107-Y111 WeakPolarHBondContact O-CB 3.41Å; A107-Y111 VanDerWaalsContact O-CD2 3.24Å; A107-Y111 WeakPolarHBondContact O-CD2 3.31Å; A107-Y111 VanDerWaalsContact O-CG 3.24Å; A107-Y111 PolarHBondContact O-N 2.61Å; V109-Y111 VanDerWaalsContact C-N 3.32Å; V109-Y111 PolarHBondContact O-N 3.06Å
112	G	97.2	Very high	97.8	Very high	59 Å²	59	41.3 Å²	41.3	61%	0.608	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	36.6	178.3	0	0	0	0	0	114	A108 V109 E114	A108-G112 PolarHBondContact O-N 3.13Å; A108-G112 VanDerWaalsContact O-N 3.11Å; V109-G112 PolarHBondContact O-N 3.42Å; V109-G112 VanDerWaalsContact O-N 3.15Å; G112-E114 PolarHBondContact O-N 3.42Å
113	L	98	Very high	97.8	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	22%	0.224	C	C	.	.			trans	-94.1	82	178.5	-60.9	175.3	0	0	0	110.8	C53 V85 L89 A108 E115 L116 R117	C53-L113 HydrophobicContact CB-CD2 3.99Å; V85-L113 HydrophobicContact CG1-CD1 3.69Å; L89-L113 HydrophobicContact CD2-CD1 4.24Å; L89-L113 HydrophobicContact CD2-CD2 3.72Å; L89-L113 HydrophobicContact CG-CD1 4.5Å; A108-L113 HydrophobicContact CB-CB 4.31Å; A108-L113 PolarHBondContact O-N 3.26Å; L113-E115 PolarHBondContact O-N 2.8Å; L113-L116 HydrophobicContact CB-CB 4.04Å; L113-L116 HydrophobicContact CD1-CD2 4.12Å; L113-L116 PolarHBondContact O-N 2.93Å; L113-R117 WeakPolarHBondContact O-CB 3.37Å; L113-R117 PolarHBondContact O-N 2.92Å
114	E	97.3	Very high	97.9	Very high	106 Å²	106	40.3 Å²	40.3	50%	0.495	21%	0.209	S	C	.	.	H	α-helix	trans	-58.1	-47.5	-172.6	-165.6	72.1	174.4	0	0	113.7	G112 L116 R117 E118	G112-E114 PolarHBondContact O-N 3.42Å; E114-L116 PolarHBondContact O-N 3.12Å; E114-R117 VanDerWaalsContact CD-NH2 3.25Å; E114-R117 WeakPolarHBondContact O-CB 3.49Å; E114-R117 PolarHBondContact O-N 3Å; E114-R117 IonicContact OE1-CZ 3.1Å; E114-R117 IonicContact OE1-NH1 3.35Å; E114-R117 PolarHBondContact OE1-NH1 3.47Å; E114-R117 IonicContact OE1-NH2 3.38Å; E114-R117 PolarHBondContact OE1-NH2 3.42Å; E114-R117 IonicContact OE2-CZ 2.69Å; E114-R117 IonicContact OE2-NE 2.85Å; E114-R117 IonicContact OE2-NH1 3.99Å; E114-R117 PolarHBondContact OE2-NH1 2.78Å; E114-R117 IonicContact OE2-NH2 2.59Å; E114-E118 PolarHBondContact O-N 2.87Å
115	E	97.6	Very high	97.7	Very high	105 Å²	105	43 Å²	43	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-64.4	-41.8	-178.7	-172.3	-179.6	176.6	0	0	111.5	F88 N92 L113 E118 L119	F88-E115 HydrophobicContact CZ-CB 4.07Å; F88-E115 HydrophobicContact CZ-CG 4.04Å; N92-E115 PolarHBondContact ND2-OE1 3.39Å; L113-E115 PolarHBondContact O-N 2.8Å; E115-E118 PolarHBondContact O-N 2.9Å; E115-L119 HydrophobicContact CG-CD1 4.44Å; E115-L119 VanDerWaalsContact O-CG 3.31Å; E115-L119 WeakPolarHBondContact O-CG 3.23Å; E115-L119 PolarHBondContact O-N 2.96Å
116	L	98.4	Very high	97.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-40	175.8	-179.6	57.9	0	0	0	111.4	V85 F88 V94 V104 A108 L113 E114 E118 L119 C120	V85-L116 HydrophobicContact CG2-CD2 4.01Å; F88-L116 HydrophobicContact CB-CD1 4.36Å; F88-L116 HydrophobicContact CB-CD2 4.13Å; F88-L116 HydrophobicContact CD1-CB 3.86Å; F88-L116 HydrophobicContact CD1-CD2 4.15Å; F88-L116 HydrophobicContact CD1-CG 4.41Å; F88-L116 HydrophobicContact CD2-CB 4.45Å; F88-L116 HydrophobicContact CD2-CD1 3.95Å; F88-L116 HydrophobicContact CE1-CB 3.82Å; F88-L116 HydrophobicContact CE2-CB 4.41Å; F88-L116 HydrophobicContact CE2-CD1 4.43Å; F88-L116 HydrophobicContact CG-CB 4.18Å; F88-L116 HydrophobicContact CG-CD1 4.02Å; F88-L116 HydrophobicContact CG-CD2 4.12Å; F88-L116 HydrophobicContact CG-CG 4.33Å; F88-L116 HydrophobicContact CZ-CB 4.1Å; V94-L116 HydrophobicContact CG1-CD1 3.66Å; V104-L116 HydrophobicContact CG1-CD1 4.27Å; V104-L116 HydrophobicContact CG1-CD2 4.2Å; V104-L116 HydrophobicContact CG1-CG 4.39Å; A108-L116 HydrophobicContact CB-CB 4.14Å; A108-L116 HydrophobicContact CB-CD2 3.99Å; A108-L116 HydrophobicContact CB-CG 3.87Å; L113-L116 HydrophobicContact CB-CB 4.04Å; L113-L116 HydrophobicContact CD1-CD2 4.12Å; L113-L116 PolarHBondContact O-N 2.93Å; E114-L116 PolarHBondContact O-N 3.12Å; L116-E118 PolarHBondContact O-N 2.87Å; L116-L119 PolarHBondContact O-N 3.34Å; L116-C120 WeakPolarHBondContact O-CB 3.42Å; L116-C120 PolarHBondContact O-N 3.23Å; L116-C120 PolarHBondContact O-SG 3.18Å
117	R	98.3	Very high	97.6	Very high	56 Å²	56	50.9 Å²	50.9	21%	0.211	26%	0.259	C	S	.	.	H	α-helix	trans	-56.6	-50.5	175	-173.8	-166.5	78.6	-161.9	3.9	110.8	L105 A108 V109 L113 E114 L119 C120 L121	L105-R117 HydrophobicContact CD1-CB 4.45Å; L105-R117 HydrophobicContact CD1-CG 3.64Å; A108-R117 HydrophobicContact CB-CB 4.24Å; V109-R117 HydrophobicContact CG2-CG 3.85Å; L113-R117 WeakPolarHBondContact O-CB 3.37Å; L113-R117 PolarHBondContact O-N 2.92Å; E114-R117 VanDerWaalsContact CD-NH2 3.25Å; E114-R117 WeakPolarHBondContact O-CB 3.49Å; E114-R117 PolarHBondContact O-N 3Å; E114-R117 IonicContact OE1-CZ 3.1Å; E114-R117 IonicContact OE1-NH1 3.35Å; E114-R117 PolarHBondContact OE1-NH1 3.47Å; E114-R117 IonicContact OE1-NH2 3.38Å; E114-R117 PolarHBondContact OE1-NH2 3.42Å; E114-R117 IonicContact OE2-CZ 2.69Å; E114-R117 IonicContact OE2-NE 2.85Å; E114-R117 IonicContact OE2-NH1 3.99Å; E114-R117 PolarHBondContact OE2-NH1 2.78Å; E114-R117 IonicContact OE2-NH2 2.59Å; R117-L119 PolarHBondContact O-N 3.39Å; R117-C120 PolarHBondContact O-N 3.49Å; R117-L121 HydrophobicContact CG-CD1 4.3Å; R117-L121 WeakPolarHBondContact O-CG 3.49Å; R117-L121 PolarHBondContact O-N 3.08Å
118	E	98.1	Very high	97.5	Very high	73 Å²	73	51.9 Å²	51.9	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-40.8	179.9	-67.7	-50.3	123	0	0	112.6	E114 E115 L116 C120 L121 Q122	E114-E118 PolarHBondContact O-N 2.87Å; E115-E118 PolarHBondContact O-N 2.9Å; L116-E118 PolarHBondContact O-N 2.87Å; E118-C120 VanDerWaalsContact C-N 3.34Å; E118-C120 PolarHBondContact O-N 3.42Å; E118-L121 PolarHBondContact O-N 3.44Å; E118-Q122 VanDerWaalsContact O-CG 3.3Å; E118-Q122 WeakPolarHBondContact O-CG 3.45Å; E118-Q122 PolarHBondContact O-N 3.31Å
119	L	98.2	Very high	97.5	Very high	68 Å²	68	54 Å²	54	36%	0.356	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-41	175	-69.4	171.1	0	0	0	111.9	F88 E115 L116 R117 Q122 F123	F88-L119 HydrophobicContact CE2-CD1 3.92Å; E115-L119 HydrophobicContact CG-CD1 4.44Å; E115-L119 VanDerWaalsContact O-CG 3.31Å; E115-L119 WeakPolarHBondContact O-CG 3.23Å; E115-L119 PolarHBondContact O-N 2.96Å; L116-L119 PolarHBondContact O-N 3.34Å; R117-L119 PolarHBondContact O-N 3.39Å; L119-Q122 PolarHBondContact O-N 2.94Å; L119-F123 PolarHBondContact O-N 2.94Å
120	C	98.5	Very high	97.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-46.1	175.2	-66.9	0	0	0	0	111.3	V101 L105 L116 R117 E118 Q122 F123 V124	V101-C120 HydrophobicContact CG2-CB 4.11Å; L105-C120 HydrophobicContact CB-CB 3.87Å; L105-C120 HydrophobicContact CD1-CB 3.91Å; L105-C120 HydrophobicContact CG-CB 4.41Å; L116-C120 WeakPolarHBondContact O-CB 3.42Å; L116-C120 PolarHBondContact O-N 3.23Å; L116-C120 PolarHBondContact O-SG 3.18Å; R117-C120 PolarHBondContact O-N 3.49Å; E118-C120 VanDerWaalsContact C-N 3.34Å; E118-C120 PolarHBondContact O-N 3.42Å; C120-Q122 VanDerWaalsContact C-N 3.34Å; C120-Q122 PolarHBondContact O-N 3.38Å; C120-F123 PolarHBondContact O-N 3.24Å; C120-F123 VanDerWaalsContact O-N 3.08Å; C120-V124 VanDerWaalsContact O-CG2 3.32Å; C120-V124 WeakPolarHBondContact O-CG2 3.38Å; C120-V124 PolarHBondContact O-N 2.68Å
121	L	98.1	Very high	97.3	Very high	28 Å²	28	55.2 Å²	55.2	15%	0.147	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-46.1	176.5	-73.8	175.1	0	0	0	112	L105 R117 E118 F123 V124 V125 L145 L148	L105-L121 HydrophobicContact CD1-CD2 4.13Å; L105-L121 HydrophobicContact CD1-CG 4.03Å; L105-L121 HydrophobicContact CD2-CD2 3.92Å; R117-L121 HydrophobicContact CG-CD1 4.3Å; R117-L121 WeakPolarHBondContact O-CG 3.49Å; R117-L121 PolarHBondContact O-N 3.08Å; E118-L121 PolarHBondContact O-N 3.44Å; L121-F123 VanDerWaalsContact C-N 3.29Å; L121-F123 PolarHBondContact O-N 3.09Å; L121-V124 PolarHBondContact O-N 2.98Å; L121-V125 WeakPolarHBondContact O-CG2 3.24Å; L121-V125 PolarHBondContact O-N 3Å; L121-V125 VanDerWaalsContact O-N 3.13Å; L121-L145 HydrophobicContact CD2-CD1 4.16Å; L121-L148 HydrophobicContact CD2-CB 4.03Å; L121-L148 HydrophobicContact CD2-CD2 3.71Å; L121-L148 HydrophobicContact CD2-CG 4.32Å
122	Q	97.4	Very high	97.3	Very high	107 Å²	107	55.2 Å²	55.2	50%	0.5	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-37.4	176.3	-71.1	175.3	18	0	0	112.5	E118 L119 C120 K126	E118-Q122 VanDerWaalsContact O-CG 3.3Å; E118-Q122 WeakPolarHBondContact O-CG 3.45Å; E118-Q122 PolarHBondContact O-N 3.31Å; L119-Q122 PolarHBondContact O-N 2.94Å; C120-Q122 VanDerWaalsContact C-N 3.34Å; C120-Q122 PolarHBondContact O-N 3.38Å; Q122-K126 WeakPolarHBondContact O-CG 3.45Å
123	F	98.1	Very high	97.3	Very high	53 Å²	53	52.4 Å²	52.4	23%	0.232	25%	0.252	C	S	.	.	H	α-helix	trans	-72.1	-46.8	177.7	-172.6	-106.7	0	0	0	111.7	L96 V101 L119 C120 L121 V125 K126 V127	L96-F123 HydrophobicContact CB-CD1 3.82Å; L96-F123 HydrophobicContact CB-CE1 3.99Å; L96-F123 HydrophobicContact CB-CG 4.11Å; L96-F123 HydrophobicContact CB-CZ 4.44Å; L96-F123 HydrophobicContact CD1-CB 3.82Å; L96-F123 HydrophobicContact CD1-CD1 4.35Å; L96-F123 HydrophobicContact CD1-CG 4.14Å; V101-F123 HydrophobicContact CB-CD1 3.96Å; V101-F123 HydrophobicContact CB-CE1 4.33Å; V101-F123 HydrophobicContact CG1-CD1 4.27Å; V101-F123 HydrophobicContact CG2-CD1 3.77Å; L119-F123 PolarHBondContact O-N 2.94Å; C120-F123 PolarHBondContact O-N 3.24Å; C120-F123 VanDerWaalsContact O-N 3.08Å; L121-F123 VanDerWaalsContact C-N 3.29Å; L121-F123 PolarHBondContact O-N 3.09Å; F123-V125 VanDerWaalsContact C-N 3.27Å; F123-V125 PolarHBondContact O-N 2.75Å; F123-K126 WeakPolarHBondContact O-CA 3.48Å; F123-K126 WeakPolarHBondContact O-CB 3.33Å; F123-K126 PolarHBondContact O-N 2.96Å; F123-V127 HydrophobicContact CD1-CG1 4.38Å; F123-V127 HydrophobicContact CD1-CG2 4.08Å; F123-V127 HydrophobicContact CD2-CG1 4.3Å; F123-V127 HydrophobicContact CE1-CG1 3.91Å; F123-V127 HydrophobicContact CE1-CG2 3.95Å; F123-V127 HydrophobicContact CE2-CG1 3.8Å; F123-V127 HydrophobicContact CZ-CG1 3.6Å; F123-V127 HydrophobicContact CZ-CG2 4.5Å; F123-V127 WeakPolarHBondContact O-CG2 3.35Å; F123-V127 PolarHBondContact O-N 3.33Å
124	V	98.2	Very high	97.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-52.1	-47.2	177	170.9	0	0	0	0	110.6	V101 L102 L105 C120 L121 K126 V127 L128 A136 L148	V101-V124 HydrophobicContact CB-CG2 4.36Å; V101-V124 HydrophobicContact CG1-CG2 3.79Å; V101-V124 HydrophobicContact CG2-CG2 3.62Å; L102-V124 HydrophobicContact CD2-CG1 4.29Å; L102-V124 HydrophobicContact CD2-CG2 3.87Å; L105-V124 HydrophobicContact CD2-CG2 4.45Å; C120-V124 VanDerWaalsContact O-CG2 3.32Å; C120-V124 WeakPolarHBondContact O-CG2 3.38Å; C120-V124 PolarHBondContact O-N 2.68Å; L121-V124 PolarHBondContact O-N 2.98Å; V124-K126 PolarHBondContact O-N 3.32Å; V124-V127 PolarHBondContact O-N 2.9Å; V124-L128 HydrophobicContact CG1-CD1 4.3Å; V124-L128 WeakPolarHBondContact O-CB 3.25Å; V124-L128 PolarHBondContact O-N 3.17Å; V124-A136 HydrophobicContact CG1-CB 4.1Å; V124-L148 HydrophobicContact CG1-CD1 3.87Å
125	V	96	Very high	97.4	Very high	57 Å²	57	50.7 Å²	50.7	35%	0.345	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-30	179.5	173.9	0	0	0	0	112.7	L121 F123 L148 R151	L121-V125 WeakPolarHBondContact O-CG2 3.24Å; L121-V125 PolarHBondContact O-N 3Å; L121-V125 VanDerWaalsContact O-N 3.13Å; F123-V125 VanDerWaalsContact C-N 3.27Å; F123-V125 PolarHBondContact O-N 2.75Å; V125-L148 HydrophobicContact CG2-CD1 4.26Å; V125-R151 HydrophobicContact CG1-CG 4.27Å; V125-R151 HydrophobicContact CG2-CG 4.26Å
126	K	96.7	Very high	97.4	Very high	165 Å²	165	45.7 Å²	45.7	72%	0.717	22%	0.221	S	C	*	.	H	α-helix	trans	-78.7	-31.7	178.6	-70.6	170.8	-175	174.3	0	113.1	Q122 F123 V124	Q122-K126 WeakPolarHBondContact O-CG 3.45Å; F123-K126 WeakPolarHBondContact O-CA 3.48Å; F123-K126 WeakPolarHBondContact O-CB 3.33Å; F123-K126 PolarHBondContact O-N 2.96Å; V124-K126 PolarHBondContact O-N 3.32Å
127	V	97.1	Very high	97.4	Very high	35 Å²	35	45.7 Å²	45.7	21%	0.212	22%	0.221	C	C	.	.	H	α-helix	trans	-104.9	9.7	-176.7	-55	0	0	0	0	113.2	R98 F123 V124 D129 L132	R98-V127 HydrophobicContact CB-CG2 4.43Å; R98-V127 HydrophobicContact CG-CB 4.44Å; R98-V127 HydrophobicContact CG-CG2 4.28Å; F123-V127 HydrophobicContact CD1-CG1 4.38Å; F123-V127 HydrophobicContact CD1-CG2 4.08Å; F123-V127 HydrophobicContact CD2-CG1 4.3Å; F123-V127 HydrophobicContact CE1-CG1 3.91Å; F123-V127 HydrophobicContact CE1-CG2 3.95Å; F123-V127 HydrophobicContact CE2-CG1 3.8Å; F123-V127 HydrophobicContact CZ-CG1 3.6Å; F123-V127 HydrophobicContact CZ-CG2 4.5Å; F123-V127 WeakPolarHBondContact O-CG2 3.35Å; F123-V127 PolarHBondContact O-N 3.33Å; V124-V127 PolarHBondContact O-N 2.9Å; V127-D129 PolarHBondContact O-N 3.27Å; V127-L132 HydrophobicContact CG2-CD2 3.96Å
128	L	96.6	Very high	97.4	Very high	22 Å²	22	45 Å²	45	12%	0.115	22%	0.22	C	C	.	.			trans	-62.8	128.7	-178.5	-161.2	69.8	0	0	0	111.1	V124 V133 A136 F155	V124-L128 HydrophobicContact CG1-CD1 4.3Å; V124-L128 WeakPolarHBondContact O-CB 3.25Å; V124-L128 PolarHBondContact O-N 3.17Å; L128-V133 HydrophobicContact CD1-CB 4.04Å; L128-V133 HydrophobicContact CD1-CG2 4.13Å; L128-V133 HydrophobicContact CD2-CG2 4.11Å; L128-V133 HydrophobicContact CG-CB 4.21Å; L128-V133 HydrophobicContact CG-CG2 4.22Å; L128-A136 HydrophobicContact CD1-CB 4.01Å; L128-F155 HydrophobicContact CD2-CB 3.84Å; L128-F155 HydrophobicContact CD2-CD2 3.86Å; L128-F155 HydrophobicContact CD2-CG 3.86Å; L128-F155 HydrophobicContact CG-CD2 4.25Å; L128-F155 HydrophobicContact CG-CG 4.38Å
129	D	96.7	Very high	97.4	Very high	44 Å²	44	42.4 Å²	42.4	24%	0.235	21%	0.209	C	C	.	.			trans	-145	-178.2	174.6	59.6	51.1	0	0	0	111	R98 V127 E131 L132 V133	R98-D129 IonicContact CZ-OD1 2.67Å; R98-D129 IonicContact CZ-OD2 2.81Å; R98-D129 IonicContact NE-OD2 3.66Å; R98-D129 PolarHBondContact NE-OD2 3.46Å; R98-D129 IonicContact NH2-OD1 3.58Å; R98-D129 PolarHBondContact NH2-OD1 2.93Å; R98-D129 IonicContact NH2-OD2 3.97Å; R98-D129 PolarHBondContact NH2-OD2 3.36Å; V127-D129 PolarHBondContact O-N 3.27Å; D129-E131 VanDerWaalsContact C-N 3.27Å; D129-E131 PolarHBondContact O-N 3.27Å; D129-E131 PolarHBondContact OD1-N 2.76Å; D129-L132 PolarHBondContact O-N 3.06Å; D129-L132 PolarHBondContact OD1-N 3.25Å; D129-V133 VanDerWaalsContact O-CB 3.23Å; D129-V133 WeakPolarHBondContact O-CB 3.47Å; D129-V133 WeakPolarHBondContact O-CG1 3.09Å; D129-V133 PolarHBondContact O-N 3.11Å
130	V	95.9	Very high	97.4	Very high	28 Å²	28	39.2 Å²	39.2	17%	0.17	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.5	-175.3	176.6	0	0	0	0	113.1	F155 H159 E162	V130-F155 HydrophobicContact CG2-CE1 4.14Å; V130-F155 HydrophobicContact CG2-CZ 4.48Å; V130-H159 HydrophobicContact CG2-CB 4.23Å; V130-E162 HydrophobicContact CG1-CB 3.76Å; V130-E162 HydrophobicContact CG2-CB 4.06Å
131	E	94.4	Very high	97.3	Very high	129 Å²	129	40.8 Å²	40.8	60%	0.603	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-43.2	179.5	-60.6	175.3	165.3	0	0	109.9	R98 D129	R98-E131 IonicContact CZ-OE2 3.3Å; R98-E131 IonicContact NH1-OE2 2.82Å; R98-E131 IonicContact NH2-OE2 2.87Å; R98-E131 PolarHBondContact NH2-OE2 3.41Å; D129-E131 VanDerWaalsContact C-N 3.27Å; D129-E131 PolarHBondContact O-N 3.27Å; D129-E131 PolarHBondContact OD1-N 2.76Å
132	L	96.7	Very high	97.3	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-79.2	-29.6	-175.6	-171.4	65.7	0	0	0	114.1	L102 V127 D129 C134 E135 A136	L102-L132 HydrophobicContact CD1-CD1 3.47Å; L102-L132 VanDerWaalsContact CD1-CD1 3.47Å; L102-L132 HydrophobicContact CD1-CG 4.3Å; L102-L132 HydrophobicContact CG-CD1 3.89Å; V127-L132 HydrophobicContact CG2-CD2 3.96Å; D129-L132 PolarHBondContact O-N 3.06Å; D129-L132 PolarHBondContact OD1-N 3.25Å; L132-C134 VanDerWaalsContact C-N 3.34Å; L132-C134 PolarHBondContact O-N 2.97Å; L132-E135 PolarHBondContact O-N 3.21Å; L132-A136 WeakPolarHBondContact O-CB 3.5Å; L132-A136 PolarHBondContact O-N 3.48Å
133	V	98	Very high	97.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-34.2	-165.3	66.6	0	0	0	0	114.2	L128 D129 L137 C152 F155 I156	L128-V133 HydrophobicContact CD1-CB 4.04Å; L128-V133 HydrophobicContact CD1-CG2 4.13Å; L128-V133 HydrophobicContact CD2-CG2 4.11Å; L128-V133 HydrophobicContact CG-CB 4.21Å; L128-V133 HydrophobicContact CG-CG2 4.22Å; D129-V133 VanDerWaalsContact O-CB 3.23Å; D129-V133 WeakPolarHBondContact O-CB 3.47Å; D129-V133 WeakPolarHBondContact O-CG1 3.09Å; D129-V133 PolarHBondContact O-N 3.11Å; V133-L137 WeakPolarHBondContact O-CB 3.48Å; V133-L137 PolarHBondContact O-N 2.71Å; V133-C152 HydrophobicContact CG2-CB 3.86Å; V133-F155 HydrophobicContact CB-CD1 3.91Å; V133-F155 HydrophobicContact CB-CE1 4.3Å; V133-F155 HydrophobicContact CG1-CD1 3.95Å; V133-F155 HydrophobicContact CG1-CE1 4.16Å; V133-F155 HydrophobicContact CG2-CB 4.08Å; V133-F155 HydrophobicContact CG2-CD1 3.77Å; V133-F155 HydrophobicContact CG2-CG 4.16Å; V133-I156 HydrophobicContact CB-CG1 4.47Å; V133-I156 HydrophobicContact CG1-CD1 4.32Å; V133-I156 HydrophobicContact CG1-CG1 3.84Å; V133-I156 HydrophobicContact CG2-CD1 3.97Å; V133-I156 HydrophobicContact CG2-CG1 3.74Å
134	C	98	Very high	97.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.9	-42.8	178.7	-69.9	0	0	0	0	111.2	L132 L137 Q138 G168 L172	L132-C134 VanDerWaalsContact C-N 3.34Å; L132-C134 PolarHBondContact O-N 2.97Å; C134-L137 WeakPolarHBondContact O-CB 3.28Å; C134-L137 PolarHBondContact O-N 2.72Å; C134-Q138 PolarHBondContact O-N 2.92Å; C134-G168 WeakPolarHBondContact CB-O 3.47Å; C134-L172 HydrophobicContact CB-CD2 4.12Å; C134-L172 HydrophobicContact CB-CG 4.4Å; C134-L172 WeakPolarHBondContact O-CD2 3.45Å
135	E	97.4	Very high	97.1	Very high	82 Å²	82	42.6 Å²	42.6	38%	0.383	23%	0.232	S	C	.	.	H	α-helix	trans	-63.8	-42.7	174.4	-64.4	175.1	-133	0	0	111.1	L102 L132 L137 Q138 V139	L102-E135 HydrophobicContact CD1-CB 3.45Å; L102-E135 VanDerWaalsContact CD1-CB 3.45Å; L132-E135 PolarHBondContact O-N 3.21Å; E135-L137 VanDerWaalsContact C-N 3.32Å; E135-L137 PolarHBondContact O-N 2.71Å; E135-Q138 WeakPolarHBondContact O-CB 3.43Å; E135-Q138 PolarHBondContact O-N 3.25Å; E135-Q138 VanDerWaalsContact O-N 3.13Å; E135-V139 WeakPolarHBondContact O-CG2 3.3Å; E135-V139 PolarHBondContact O-N 3.15Å
136	A	98.3	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-39.6	175.2	0	0	0	0	0	112.1	L102 V124 L128 L132 V139 A140	L102-A136 HydrophobicContact CD1-CB 4.34Å; L102-A136 HydrophobicContact CD2-CB 4.02Å; V124-A136 HydrophobicContact CG1-CB 4.1Å; L128-A136 HydrophobicContact CD1-CB 4.01Å; L132-A136 WeakPolarHBondContact O-CB 3.5Å; L132-A136 PolarHBondContact O-N 3.48Å; A136-V139 PolarHBondContact O-N 3.46Å; A136-A140 WeakPolarHBondContact O-CB 3.3Å; A136-A140 PolarHBondContact O-N 2.95Å
137	L	98.4	Very high	97.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-42.2	173.3	178.6	63.4	0	0	0	111.3	V133 C134 E135 A140 V141 Q149 C152 V153 I156 L172 A176 L180	V133-L137 WeakPolarHBondContact O-CB 3.48Å; V133-L137 PolarHBondContact O-N 2.71Å; C134-L137 WeakPolarHBondContact O-CB 3.28Å; C134-L137 PolarHBondContact O-N 2.72Å; E135-L137 VanDerWaalsContact C-N 3.32Å; E135-L137 PolarHBondContact O-N 2.71Å; L137-A140 PolarHBondContact O-N 2.56Å; L137-V141 HydrophobicContact CD1-CG2 4.15Å; L137-V141 WeakPolarHBondContact O-CG2 3.24Å; L137-V141 PolarHBondContact O-N 3.38Å; L137-Q149 HydrophobicContact CD1-CG 3.83Å; L137-C152 HydrophobicContact CB-CB 3.88Å; L137-C152 HydrophobicContact CD1-CB 4.07Å; L137-V153 HydrophobicContact CD1-CG2 4.11Å; L137-I156 HydrophobicContact CD2-CD1 3.89Å; L137-L172 HydrophobicContact CD2-CD1 4.49Å; L137-A176 HydrophobicContact CG-CB 4.43Å; L137-L180 HydrophobicContact CD2-CD1 3.65Å; L137-L180 HydrophobicContact CD2-CD2 3.99Å; L137-L180 HydrophobicContact CD2-CG 3.82Å
138	Q	98	Very high	97.1	Very high	43 Å²	43	37 Å²	37	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-49.2	176.8	-177.9	55.1	59.4	0	0	111	C134 E135 A140 V141 T142 L172 S173	C134-Q138 PolarHBondContact O-N 2.92Å; E135-Q138 WeakPolarHBondContact O-CB 3.43Å; E135-Q138 PolarHBondContact O-N 3.25Å; E135-Q138 VanDerWaalsContact O-N 3.13Å; Q138-A140 VanDerWaalsContact C-N 3.34Å; Q138-A140 PolarHBondContact O-N 3.45Å; Q138-V141 PolarHBondContact O-N 2.99Å; Q138-T142 PolarHBondContact NE2-OG1 3.21Å; Q138-T142 WeakPolarHBondContact O-CB 3.11Å; Q138-T142 PolarHBondContact O-N 3.35Å; Q138-T142 PolarHBondContact O-OG1 3.29Å; Q138-L172 HydrophobicContact CB-CD2 4.09Å; Q138-S173 PolarHBondContact NE2-OG 2.69Å; Q138-S173 VanDerWaalsContact NE2-OG 3.12Å; Q138-S173 VanDerWaalsContact OE1-CB 3.22Å; Q138-S173 PolarHBondContact OE1-OG 3.34Å
139	V	98	Very high	97.2	Very high	18 Å²	18	38.6 Å²	38.6	11%	0.109	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-46	175.4	173	0	0	0	0	110.7	L102 L105 E135 A136 V141 T142 F143 L145	L102-V139 HydrophobicContact CB-CG2 4.36Å; L102-V139 HydrophobicContact CD2-CG2 4.49Å; L105-V139 HydrophobicContact CD2-CG1 3.91Å; L105-V139 HydrophobicContact CG-CG1 4.29Å; E135-V139 WeakPolarHBondContact O-CG2 3.3Å; E135-V139 PolarHBondContact O-N 3.15Å; A136-V139 PolarHBondContact O-N 3.46Å; V139-V141 VanDerWaalsContact C-N 3.32Å; V139-V141 PolarHBondContact O-N 2.99Å; V139-T142 PolarHBondContact O-N 3.45Å; V139-F143 HydrophobicContact CG1-CD2 3.83Å; V139-F143 HydrophobicContact CG1-CE2 4.21Å; V139-F143 WeakPolarHBondContact O-CD2 3.11Å; V139-F143 PolarHBondContact O-N 3.34Å; V139-L145 HydrophobicContact CG1-CD1 4.4Å
140	A	98.1	Very high	97.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-41.7	-179.6	0	0	0	0	0	112.5	A136 L137 Q138 G144 L145 L148 Q149	A136-A140 WeakPolarHBondContact O-CB 3.3Å; A136-A140 PolarHBondContact O-N 2.95Å; L137-A140 PolarHBondContact O-N 2.56Å; Q138-A140 VanDerWaalsContact C-N 3.34Å; Q138-A140 PolarHBondContact O-N 3.45Å; A140-G144 CarbonylContact O-C 3.48Å; A140-G144 WeakPolarHBondContact O-CA 3.39Å; A140-G144 PolarHBondContact O-N 3.4Å; A140-L145 HydrophobicContact CB-CB 4.26Å; A140-L145 PolarHBondContact O-N 3.42Å; A140-L148 HydrophobicContact CB-CB 4.01Å; A140-L148 HydrophobicContact CB-CD2 3.93Å; A140-L148 HydrophobicContact CB-CG 3.88Å; A140-Q149 HydrophobicContact CB-CB 3.94Å
141	V	97.6	Very high	97.3	Very high	34 Å²	34	48.7 Å²	48.7	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-74	-41.5	179.1	171.6	0	0	0	0	111.5	L137 Q138 V139 F143 G144 Q149 A175 A176	L137-V141 HydrophobicContact CD1-CG2 4.15Å; L137-V141 WeakPolarHBondContact O-CG2 3.24Å; L137-V141 PolarHBondContact O-N 3.38Å; Q138-V141 PolarHBondContact O-N 2.99Å; V139-V141 VanDerWaalsContact C-N 3.32Å; V139-V141 PolarHBondContact O-N 2.99Å; V141-F143 VanDerWaalsContact C-N 3.3Å; V141-F143 PolarHBondContact O-N 3.38Å; V141-G144 PolarHBondContact O-N 2.59Å; V141-Q149 HydrophobicContact CG2-CG 4.1Å; V141-A175 HydrophobicContact CG1-CB 3.96Å; V141-A176 HydrophobicContact CB-CB 4.24Å; V141-A176 HydrophobicContact CG1-CB 4.43Å; V141-A176 HydrophobicContact CG2-CB 4.26Å
142	T	96.9	Very high	97.5	Very high	84 Å²	84	42.5 Å²	42.5	52%	0.515	24%	0.235	S	C	.	.	H	α-helix	trans	-57.9	-42.1	177.7	-63.4	0	0	0	0	112	Q138 V139	Q138-T142 PolarHBondContact NE2-OG1 3.21Å; Q138-T142 WeakPolarHBondContact O-CB 3.11Å; Q138-T142 PolarHBondContact O-N 3.35Å; Q138-T142 PolarHBondContact O-OG1 3.29Å; V139-T142 PolarHBondContact O-N 3.45Å
143	F	96.6	Very high	97.5	Very high	61 Å²	61	42.9 Å²	42.9	27%	0.268	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	4.3	-175.9	-63.4	-67.7	0	0	0	114.3	T106 V109 E110 V139 V141 L145	T106-F143 HydrophobicContact CG2-CE2 3.83Å; T106-F143 HydrophobicContact CG2-CZ 3.67Å; V109-F143 HydrophobicContact CB-CD1 4.24Å; V109-F143 HydrophobicContact CB-CG 4.43Å; V109-F143 HydrophobicContact CG1-CB 4.21Å; V109-F143 HydrophobicContact CG1-CD1 3.48Å; V109-F143 VanDerWaalsContact CG1-CD1 3.48Å; V109-F143 HydrophobicContact CG1-CE1 4.04Å; V109-F143 HydrophobicContact CG1-CG 3.92Å; E110-F143 HydrophobicContact CG-CE1 4.39Å; V139-F143 HydrophobicContact CG1-CD2 3.83Å; V139-F143 HydrophobicContact CG1-CE2 4.21Å; V139-F143 WeakPolarHBondContact O-CD2 3.11Å; V139-F143 PolarHBondContact O-N 3.34Å; V141-F143 VanDerWaalsContact C-N 3.3Å; V141-F143 PolarHBondContact O-N 3.38Å; F143-L145 HydrophobicContact CB-CD1 4.19Å; F143-L145 HydrophobicContact CB-CD2 4.27Å; F143-L145 HydrophobicContact CB-CG 3.92Å; F143-L145 PolarHBondContact O-N 3Å
144	G	96.6	Very high	97.5	Very high	61 Å²	61	45 Å²	45	63%	0.629	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	31.8	179.4	0	0	0	0	0	114.5	A140 V141 G146	A140-G144 CarbonylContact O-C 3.48Å; A140-G144 WeakPolarHBondContact O-CA 3.39Å; A140-G144 PolarHBondContact O-N 3.4Å; V141-G144 PolarHBondContact O-N 2.59Å; G144-G146 VanDerWaalsContact C-N 3.31Å; G144-G146 PolarHBondContact O-N 3.19Å
145	L	96.8	Very high	97.5	Very high	19 Å²	19	47.1 Å²	47.1	10%	0.099	26%	0.264	C	S	.	.			trans	-81.8	73	-179.7	-48.4	174.3	0	0	0	110.5	L105 L121 V139 A140 F143 L148 Q149	L105-L145 HydrophobicContact CD2-CD1 4.24Å; L121-L145 HydrophobicContact CD2-CD1 4.16Å; V139-L145 HydrophobicContact CG1-CD1 4.4Å; A140-L145 HydrophobicContact CB-CB 4.26Å; A140-L145 PolarHBondContact O-N 3.42Å; F143-L145 HydrophobicContact CB-CD1 4.19Å; F143-L145 HydrophobicContact CB-CD2 4.27Å; F143-L145 HydrophobicContact CB-CG 3.92Å; F143-L145 PolarHBondContact O-N 3Å; L145-L148 HydrophobicContact CB-CB 4.19Å; L145-L148 HydrophobicContact CD1-CD2 4.43Å; L145-L148 PolarHBondContact O-N 3.38Å; L145-Q149 PolarHBondContact O-N 2.93Å
146	G	96.5	Very high	97.5	Very high	26 Å²	26	43.2 Å²	43.2	27%	0.268	25%	0.246	S	C	.	.	H	α-helix	trans	-47.8	-51	-174.1	0	0	0	0	0	115.4	G144 L148 Q149 E150	G144-G146 VanDerWaalsContact C-N 3.31Å; G144-G146 PolarHBondContact O-N 3.19Å; G146-L148 VanDerWaalsContact C-N 3.3Å; G146-L148 PolarHBondContact O-N 2.85Å; G146-Q149 WeakPolarHBondContact O-CB 3.46Å; G146-Q149 PolarHBondContact O-N 3.35Å; G146-Q149 VanDerWaalsContact O-N 3.14Å; G146-E150 WeakPolarHBondContact O-CG 3.35Å; G146-E150 PolarHBondContact O-N 3.19Å
147	P	96.6	Very high	97.5	Very high	108 Å²	108	44.4 Å²	44.4	70%	0.701	25%	0.252	S	S	*	.	H	α-helix	trans	-60.5	-36.5	179.1	-26.1	35.5	0	0	0	113.8	R151	P147-R151 WeakPolarHBondContact O-CB 3.34Å; P147-R151 PolarHBondContact O-N 3.24Å; P147-R151 VanDerWaalsContact O-N 3.17Å
148	L	97.6	Very high	97.4	Very high	6 Å²	6	47.8 Å²	47.8	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-71.1	-41.5	175.7	179.9	62.1	0	0	0	110.7	L105 L121 V124 V125 A140 L145 G146 E150 R151 C152	L105-L148 HydrophobicContact CD2-CD2 4.2Å; L121-L148 HydrophobicContact CD2-CB 4.03Å; L121-L148 HydrophobicContact CD2-CD2 3.71Å; L121-L148 HydrophobicContact CD2-CG 4.32Å; V124-L148 HydrophobicContact CG1-CD1 3.87Å; V125-L148 HydrophobicContact CG2-CD1 4.26Å; A140-L148 HydrophobicContact CB-CB 4.01Å; A140-L148 HydrophobicContact CB-CD2 3.93Å; A140-L148 HydrophobicContact CB-CG 3.88Å; L145-L148 HydrophobicContact CB-CB 4.19Å; L145-L148 HydrophobicContact CD1-CD2 4.43Å; L145-L148 PolarHBondContact O-N 3.38Å; G146-L148 VanDerWaalsContact C-N 3.3Å; G146-L148 PolarHBondContact O-N 2.85Å; L148-E150 PolarHBondContact O-N 2.89Å; L148-R151 PolarHBondContact O-N 2.89Å; L148-C152 PolarHBondContact O-N 2.93Å; L148-C152 PolarHBondContact O-SG 3.41Å
149	Q	98	Very high	97.4	Very high	55 Å²	55	49 Å²	49	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-50	176	-179.4	-173.5	-14.6	0	0	110.8	L137 A140 V141 L145 G146 R151 C152 V153 P179	L137-Q149 HydrophobicContact CD1-CG 3.83Å; A140-Q149 HydrophobicContact CB-CB 3.94Å; V141-Q149 HydrophobicContact CG2-CG 4.1Å; L145-Q149 PolarHBondContact O-N 2.93Å; G146-Q149 WeakPolarHBondContact O-CB 3.46Å; G146-Q149 PolarHBondContact O-N 3.35Å; G146-Q149 VanDerWaalsContact O-N 3.14Å; Q149-R151 VanDerWaalsContact C-N 3.28Å; Q149-R151 PolarHBondContact O-N 3.32Å; Q149-C152 PolarHBondContact O-N 3.36Å; Q149-V153 HydrophobicContact CG-CG2 4.47Å; Q149-V153 VanDerWaalsContact O-CG2 3.3Å; Q149-V153 WeakPolarHBondContact O-CG2 3.44Å; Q149-V153 PolarHBondContact O-N 3.26Å; Q149-P179 VanDerWaalsContact NE2-CG 3.34Å
150	E	97.1	Very high	97.3	Very high	145 Å²	145	48.2 Å²	48.2	68%	0.678	28%	0.281	S	S	*	.	H	α-helix	trans	-57.8	-41.9	177.2	-71.9	176.9	-173.9	0	0	111.8	G146 L148 A154	G146-E150 WeakPolarHBondContact O-CG 3.35Å; G146-E150 PolarHBondContact O-N 3.19Å; L148-E150 PolarHBondContact O-N 2.89Å; E150-A154 WeakPolarHBondContact O-CB 3.27Å; E150-A154 PolarHBondContact O-N 3.38Å
151	R	97.8	Very high	97.1	Very high	139 Å²	139	52.4 Å²	52.4	53%	0.525	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-42.3	178.2	-170.4	62.3	173.6	-178.9	1.4	112.4	V125 P147 L148 Q149 A154 F155	V125-R151 HydrophobicContact CG1-CG 4.27Å; V125-R151 HydrophobicContact CG2-CG 4.26Å; P147-R151 WeakPolarHBondContact O-CB 3.34Å; P147-R151 PolarHBondContact O-N 3.24Å; P147-R151 VanDerWaalsContact O-N 3.17Å; L148-R151 PolarHBondContact O-N 2.89Å; Q149-R151 VanDerWaalsContact C-N 3.28Å; Q149-R151 PolarHBondContact O-N 3.32Å; R151-A154 PolarHBondContact O-N 3.38Å; R151-F155 WeakPolarHBondContact O-CB 3.5Å; R151-F155 PolarHBondContact O-N 2.96Å
152	C	98.3	Very high	97	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-44	177.7	-64.6	0	0	0	0	111.1	V133 L137 L148 Q149 A154 F155 I156	V133-C152 HydrophobicContact CG2-CB 3.86Å; L137-C152 HydrophobicContact CB-CB 3.88Å; L137-C152 HydrophobicContact CD1-CB 4.07Å; L148-C152 PolarHBondContact O-N 2.93Å; L148-C152 PolarHBondContact O-SG 3.41Å; Q149-C152 PolarHBondContact O-N 3.36Å; C152-A154 PolarHBondContact O-N 3.35Å; C152-F155 PolarHBondContact O-N 2.85Å; C152-I156 WeakPolarHBondContact O-CG1 3.48Å; C152-I156 PolarHBondContact O-N 3.43Å
153	V	97.8	Very high	97	Very high	19 Å²	19	52.2 Å²	52.2	12%	0.115	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-47.9	175.2	172.3	0	0	0	0	110.4	L137 Q149 F155 I156 E157 P179 L180	L137-V153 HydrophobicContact CD1-CG2 4.11Å; Q149-V153 HydrophobicContact CG-CG2 4.47Å; Q149-V153 VanDerWaalsContact O-CG2 3.3Å; Q149-V153 WeakPolarHBondContact O-CG2 3.44Å; Q149-V153 PolarHBondContact O-N 3.26Å; V153-F155 VanDerWaalsContact C-N 3.29Å; V153-F155 PolarHBondContact O-N 2.71Å; V153-I156 PolarHBondContact O-N 2.91Å; V153-E157 HydrophobicContact CG1-CG 4.33Å; V153-E157 WeakPolarHBondContact CG1-OE1 3.38Å; V153-E157 VanDerWaalsContact O-CG 3.25Å; V153-E157 WeakPolarHBondContact O-CG 3.24Å; V153-E157 PolarHBondContact O-N 2.89Å; V153-P179 HydrophobicContact CG2-CB 4.21Å; V153-L180 HydrophobicContact CB-CD2 4.4Å; V153-L180 HydrophobicContact CG1-CD2 4.36Å; V153-L180 HydrophobicContact CG2-CD2 3.97Å
154	A	97.6	Very high	96.9	Very high	46 Å²	46	50.2 Å²	50.2	38%	0.38	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-36.7	178.2	0	0	0	0	0	113	E150 R151 C152 A158	E150-A154 WeakPolarHBondContact O-CB 3.27Å; E150-A154 PolarHBondContact O-N 3.38Å; R151-A154 PolarHBondContact O-N 3.38Å; C152-A154 PolarHBondContact O-N 3.35Å; A154-A158 PolarHBondContact O-N 3.27Å
155	F	98.2	Very high	96.8	Very high	43 Å²	43	55.1 Å²	55.1	19%	0.189	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-46.5	174.6	-174.1	-79.2	0	0	0	111.4	L128 V130 V133 R151 C152 V153 E157 A158 H159	L128-F155 HydrophobicContact CD2-CB 3.84Å; L128-F155 HydrophobicContact CD2-CD2 3.86Å; L128-F155 HydrophobicContact CD2-CG 3.86Å; L128-F155 HydrophobicContact CG-CD2 4.25Å; L128-F155 HydrophobicContact CG-CG 4.38Å; V130-F155 HydrophobicContact CG2-CE1 4.14Å; V130-F155 HydrophobicContact CG2-CZ 4.48Å; V133-F155 HydrophobicContact CB-CD1 3.91Å; V133-F155 HydrophobicContact CB-CE1 4.3Å; V133-F155 HydrophobicContact CG1-CD1 3.95Å; V133-F155 HydrophobicContact CG1-CE1 4.16Å; V133-F155 HydrophobicContact CG2-CB 4.08Å; V133-F155 HydrophobicContact CG2-CD1 3.77Å; V133-F155 HydrophobicContact CG2-CG 4.16Å; R151-F155 WeakPolarHBondContact O-CB 3.5Å; R151-F155 PolarHBondContact O-N 2.96Å; C152-F155 PolarHBondContact O-N 2.85Å; V153-F155 VanDerWaalsContact C-N 3.29Å; V153-F155 PolarHBondContact O-N 2.71Å; F155-E157 VanDerWaalsContact C-N 3.29Å; F155-E157 PolarHBondContact O-N 3.41Å; F155-A158 WeakPolarHBondContact O-CB 3.44Å; F155-A158 PolarHBondContact O-N 3Å; F155-H159 AromaticContact CD1-CD2 3.94Å; F155-H159 HydrophobicContact CE1-CB 4.15Å; F155-H159 AromaticContact CE1-CD2 3.6Å; F155-H159 AromaticContact CE2-CD2 3.88Å; F155-H159 AromaticContact CZ-CD2 3.55Å; F155-H159 AromaticContact CZ-NE2 3.97Å; F155-H159 PolarHBondContact O-CD2 2.9Å; F155-H159 PolarHBondContact O-N 2.9Å
156	I	98	Very high	96.7	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-35.4	177.1	-67.4	164.5	0	0	0	111	V133 L137 C152 V153 A158 H159 S160 A163 L180 L186	V133-I156 HydrophobicContact CB-CG1 4.47Å; V133-I156 HydrophobicContact CG1-CD1 4.32Å; V133-I156 HydrophobicContact CG1-CG1 3.84Å; V133-I156 HydrophobicContact CG2-CD1 3.97Å; V133-I156 HydrophobicContact CG2-CG1 3.74Å; L137-I156 HydrophobicContact CD2-CD1 3.89Å; C152-I156 WeakPolarHBondContact O-CG1 3.48Å; C152-I156 PolarHBondContact O-N 3.43Å; V153-I156 PolarHBondContact O-N 2.91Å; I156-A158 VanDerWaalsContact C-N 3.27Å; I156-A158 PolarHBondContact O-N 3.3Å; I156-H159 CarbonylContact O-C 3.43Å; I156-H159 PolarHBondContact O-N 3.24Å; I156-S160 WeakPolarHBondContact O-CA 3.33Å; I156-S160 WeakPolarHBondContact O-CB 3.19Å; I156-S160 PolarHBondContact O-N 3.11Å; I156-S160 PolarHBondContact O-OG 2.99Å; I156-A163 HydrophobicContact CB-CB 4.4Å; I156-A163 HydrophobicContact CG1-CB 4.11Å; I156-A163 HydrophobicContact CG2-CB 3.92Å; I156-L180 HydrophobicContact CB-CD2 4.06Å; I156-L180 HydrophobicContact CD1-CD1 3.94Å; I156-L180 HydrophobicContact CD1-CD2 3.76Å; I156-L180 HydrophobicContact CD1-CG 4.49Å; I156-L180 HydrophobicContact CG2-CD1 4.39Å; I156-L180 HydrophobicContact CG2-CD2 3.86Å; I156-L186 HydrophobicContact CG2-CD2 4.1Å
157	E	97	Very high	96.6	Very high	24 Å²	24	60.5 Å²	60.5	11%	0.112	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-34	172.5	-72.1	170.6	172.5	0	0	112.7	V153 F155 S160 S183 K185 L186	V153-E157 HydrophobicContact CG1-CG 4.33Å; V153-E157 WeakPolarHBondContact CG1-OE1 3.38Å; V153-E157 VanDerWaalsContact O-CG 3.25Å; V153-E157 WeakPolarHBondContact O-CG 3.24Å; V153-E157 PolarHBondContact O-N 2.89Å; F155-E157 VanDerWaalsContact C-N 3.29Å; F155-E157 PolarHBondContact O-N 3.41Å; E157-S160 PolarHBondContact O-OG 2.99Å; E157-S160 VanDerWaalsContact O-OG 3.07Å; E157-S183 WeakPolarHBondContact OE1-CB 3.27Å; E157-S183 PolarHBondContact OE1-OG 3.37Å; E157-K185 HydrophobicContact CB-CB 4.22Å; E157-K185 VanDerWaalsContact CD-CB 3.41Å; E157-K185 HydrophobicContact CG-CB 3.78Å; E157-K185 WeakPolarHBondContact OE2-CD 3.44Å; E157-L186 HydrophobicContact CG-CD2 4.23Å
158	A	96.7	Very high	96.6	Very high	71 Å²	71	55.7 Å²	55.7	59%	0.587	27%	0.273	S	S	*	.	H	α-helix	trans	-79.7	-31.8	177.2	0	0	0	0	0	113.1	A154 F155 I156	A154-A158 PolarHBondContact O-N 3.27Å; F155-A158 WeakPolarHBondContact O-CB 3.44Å; F155-A158 PolarHBondContact O-N 3Å; I156-A158 VanDerWaalsContact C-N 3.27Å; I156-A158 PolarHBondContact O-N 3.3Å
159	H	97	Very high	96.6	Very high	68 Å²	68	55.6 Å²	55.6	32%	0.315	27%	0.272	S	S	.	.	S	Bend	trans	-117.1	34.8	-175.6	-63.9	-80.4	0	0	0	112.8	V130 F155 I156 Q161 E162 A163	V130-H159 HydrophobicContact CG2-CB 4.23Å; F155-H159 AromaticContact CD1-CD2 3.94Å; F155-H159 HydrophobicContact CE1-CB 4.15Å; F155-H159 AromaticContact CE1-CD2 3.6Å; F155-H159 AromaticContact CE2-CD2 3.88Å; F155-H159 AromaticContact CZ-CD2 3.55Å; F155-H159 AromaticContact CZ-NE2 3.97Å; F155-H159 PolarHBondContact O-CD2 2.9Å; F155-H159 PolarHBondContact O-N 2.9Å; I156-H159 CarbonylContact O-C 3.43Å; I156-H159 PolarHBondContact O-N 3.24Å; H159-Q161 PolarHBondContact O-N 3.27Å; H159-E162 IonicContact ND1-OE1 3.81Å; H159-E162 PolarHBondContact O-N 3.04Å; H159-E162 VanDerWaalsContact O-N 3.17Å; H159-A163 WeakPolarHBondContact O-CB 3.41Å; H159-A163 PolarHBondContact O-N 3.17Å
160	S	96.1	Very high	96.5	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-44.5	-162.6	-54.5	0	0	0	0	114.4	I156 E157 E162 A163 L164 C187 V188	I156-S160 WeakPolarHBondContact O-CA 3.33Å; I156-S160 WeakPolarHBondContact O-CB 3.19Å; I156-S160 PolarHBondContact O-N 3.11Å; I156-S160 PolarHBondContact O-OG 2.99Å; E157-S160 PolarHBondContact O-OG 2.99Å; E157-S160 VanDerWaalsContact O-OG 3.07Å; S160-E162 PolarHBondContact O-N 3.03Å; S160-A163 PolarHBondContact O-N 2.82Å; S160-L164 WeakPolarHBondContact O-CB 3.18Å; S160-L164 WeakPolarHBondContact O-CD1 3.47Å; S160-L164 PolarHBondContact O-N 3.43Å; S160-C187 PolarHBondContact OG-N 3.46Å; S160-C187 VanDerWaalsContact OG-N 3.07Å; S160-V188 VanDerWaalsContact CB-CG2 3.44Å
161	Q	93.9	Very high	96.4	Very high	88 Å²	88	53.7 Å²	53.7	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-39.6	-178.8	-68.2	-171.5	26.7	0	0	113	H159 R165 V188	H159-Q161 PolarHBondContact O-N 3.27Å; Q161-R165 WeakPolarHBondContact O-CD 3.47Å; Q161-R165 VanDerWaalsContact O-CG 3.28Å; Q161-R165 WeakPolarHBondContact O-CG 3.44Å; Q161-R165 PolarHBondContact O-N 3.28Å; Q161-V188 HydrophobicContact CG-CG2 4.16Å
162	E	95.9	Very high	96.4	Very high	113 Å²	113	47.4 Å²	47.4	53%	0.528	24%	0.241	S	C	.	.	H	α-helix	trans	-71.4	-44	179.9	-62.6	170.4	-121.6	0	0	110.1	V130 H159 S160 L164 R165 S166	V130-E162 HydrophobicContact CG1-CB 3.76Å; V130-E162 HydrophobicContact CG2-CB 4.06Å; H159-E162 IonicContact ND1-OE1 3.81Å; H159-E162 PolarHBondContact O-N 3.04Å; H159-E162 VanDerWaalsContact O-N 3.17Å; S160-E162 PolarHBondContact O-N 3.03Å; E162-L164 PolarHBondContact O-N 2.93Å; E162-R165 PolarHBondContact O-N 3.26Å; E162-S166 PolarHBondContact O-N 2.9Å
163	A	96.4	Very high	96.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-42.7	177.3	0	0	0	0	0	112.6	I156 H159 S160 R165 S166 F169	I156-A163 HydrophobicContact CB-CB 4.4Å; I156-A163 HydrophobicContact CG1-CB 4.11Å; I156-A163 HydrophobicContact CG2-CB 3.92Å; H159-A163 WeakPolarHBondContact O-CB 3.41Å; H159-A163 PolarHBondContact O-N 3.17Å; S160-A163 PolarHBondContact O-N 2.82Å; A163-R165 PolarHBondContact O-N 3.17Å; A163-S166 WeakPolarHBondContact O-CB 3.45Å; A163-S166 PolarHBondContact O-N 3.29Å; A163-S166 PolarHBondContact O-OG 2.92Å; A163-F169 VanDerWaalsContact O-CB 3.31Å; A163-F169 WeakPolarHBondContact O-CB 3.3Å
164	L	94.9	Very high	96.2	Very high	19 Å²	19	49.6 Å²	49.6	10%	0.099	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-20.9	178.3	-94.8	67.1	0	0	0	113.8	S160 E162 F169 V188 L193 A196	S160-L164 WeakPolarHBondContact O-CB 3.18Å; S160-L164 WeakPolarHBondContact O-CD1 3.47Å; S160-L164 PolarHBondContact O-N 3.43Å; E162-L164 PolarHBondContact O-N 2.93Å; L164-F169 HydrophobicContact CD1-CD2 4.48Å; L164-F169 HydrophobicContact CD1-CE2 4.15Å; L164-F169 HydrophobicContact CG-CD2 4.4Å; L164-F169 HydrophobicContact CG-CE2 4.02Å; L164-F169 HydrophobicContact CG-CZ 4.24Å; L164-V188 HydrophobicContact CD2-CB 4.21Å; L164-V188 HydrophobicContact CD2-CG1 3.75Å; L164-V188 HydrophobicContact CD2-CG2 3.91Å; L164-L193 HydrophobicContact CD2-CD2 3.64Å; L164-L193 HydrophobicContact CD2-CG 4.23Å; L164-L193 HydrophobicContact CG-CD2 4.48Å; L164-A196 HydrophobicContact CD2-CB 4.14Å; L164-A196 HydrophobicContact CG-CB 4.37Å
165	R	94.4	Very high	96.2	Very high	165 Å²	165	50.1 Å²	50.1	62%	0.623	26%	0.263	S	S	*	.	H	α-helix	trans	-95.4	-6.9	178.7	-67	173.7	-169.8	143.7	9.7	112.4	Q161 E162 A163 E192	Q161-R165 WeakPolarHBondContact O-CD 3.47Å; Q161-R165 VanDerWaalsContact O-CG 3.28Å; Q161-R165 WeakPolarHBondContact O-CG 3.44Å; Q161-R165 PolarHBondContact O-N 3.28Å; E162-R165 PolarHBondContact O-N 3.26Å; A163-R165 PolarHBondContact O-N 3.17Å; R165-E192 IonicContact NH2-OE2 3.53Å
166	S	95.8	Very high	96.2	Very high	16 Å²	16	48 Å²	48	11%	0.112	25%	0.254	C	S	.	.	S	Bend	trans	-71.5	154.1	-179.4	80.8	0	0	0	0	111.1	E162 A163 G168 F169	E162-S166 PolarHBondContact O-N 2.9Å; A163-S166 WeakPolarHBondContact O-CB 3.45Å; A163-S166 PolarHBondContact O-N 3.29Å; A163-S166 PolarHBondContact O-OG 2.92Å; S166-G168 VanDerWaalsContact C-N 3.3Å; S166-F169 PolarHBondContact O-N 3.2Å; S166-F169 PolarHBondContact OG-N 2.82Å
167	Q	94.8	Very high	96.1	Very high	142 Å²	142	48 Å²	48	66%	0.664	25%	0.253	S	S	*	.	H	α-helix	trans	-62.2	-41.8	172.8	-178.3	177.4	-23.7	0	0	110.9	F169 L170 E171	Q167-F169 PolarHBondContact O-N 2.87Å; Q167-F169 VanDerWaalsContact O-N 3.12Å; Q167-L170 WeakPolarHBondContact O-CB 3.32Å; Q167-L170 PolarHBondContact O-N 3.13Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.39Å; Q167-E171 PolarHBondContact NE2-OE1 3.24Å; Q167-E171 PolarHBondContact O-N 2.87Å
168	G	95.1	Very high	96.1	Very high	7 Å²	7	48.3 Å²	48.3	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-29.4	179.7	0	0	0	0	0	113.5	C134 S166 L170 E171 L172	C134-G168 WeakPolarHBondContact CB-O 3.47Å; S166-G168 VanDerWaalsContact C-N 3.3Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 3.36Å; G168-E171 PolarHBondContact O-N 3.17Å; G168-L172 WeakPolarHBondContact O-CG 3.25Å; G168-L172 PolarHBondContact O-N 3Å
169	F	97.1	Very high	96	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-39.2	173.8	179	-88.9	0	0	0	112.6	A163 L164 S166 Q167 E171 L172 L177 A196 W200	A163-F169 VanDerWaalsContact O-CB 3.31Å; A163-F169 WeakPolarHBondContact O-CB 3.3Å; L164-F169 HydrophobicContact CD1-CD2 4.48Å; L164-F169 HydrophobicContact CD1-CE2 4.15Å; L164-F169 HydrophobicContact CG-CD2 4.4Å; L164-F169 HydrophobicContact CG-CE2 4.02Å; L164-F169 HydrophobicContact CG-CZ 4.24Å; S166-F169 PolarHBondContact O-N 3.2Å; S166-F169 PolarHBondContact OG-N 2.82Å; Q167-F169 PolarHBondContact O-N 2.87Å; Q167-F169 VanDerWaalsContact O-N 3.12Å; F169-E171 PolarHBondContact O-N 2.93Å; F169-L172 HydrophobicContact CD2-CD1 4.14Å; F169-L172 PolarHBondContact O-N 3.48Å; F169-L177 HydrophobicContact CD2-CD1 4.27Å; F169-L177 HydrophobicContact CE1-CD1 4.48Å; F169-L177 HydrophobicContact CE2-CD1 3.4Å; F169-L177 HydrophobicContact CZ-CD1 3.53Å; F169-A196 HydrophobicContact CE1-CB 3.8Å; F169-A196 HydrophobicContact CZ-CB 4.07Å; F169-W200 HydrophobicContact CE1-CB 4.21Å
170	L	96.6	Very high	95.9	Very high	51 Å²	51	43.3 Å²	43.3	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-69.8	-22.7	179.9	-60.2	174.6	0	0	0	112.4	Q167 G168 W200 V203	Q167-L170 WeakPolarHBondContact O-CB 3.32Å; Q167-L170 PolarHBondContact O-N 3.13Å; G168-L170 VanDerWaalsContact C-N 3.34Å; G168-L170 PolarHBondContact O-N 3.36Å; L170-W200 HydrophobicContact CD2-CB 4.31Å; L170-V203 HydrophobicContact CB-CB 4.46Å; L170-V203 HydrophobicContact CB-CG1 4.43Å; L170-V203 HydrophobicContact CB-CG2 4.28Å; L170-V203 HydrophobicContact CD1-CG2 4.28Å
171	E	95.1	Very high	95.8	Very high	109 Å²	109	43.2 Å²	43.2	51%	0.509	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-4.8	-177.8	-64.9	174.6	-178.7	0	0	113.2	Q167 G168 F169	Q167-E171 WeakPolarHBondContact CG-OE1 3.39Å; Q167-E171 PolarHBondContact NE2-OE1 3.24Å; Q167-E171 PolarHBondContact O-N 2.87Å; G168-E171 PolarHBondContact O-N 3.17Å; F169-E171 PolarHBondContact O-N 2.93Å
172	L	97.3	Very high	95.8	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.037	23%	0.228	C	C	.	.			trans	-60.4	144.4	177	-69.6	178.1	0	0	0	111.8	C134 L137 Q138 G168 F169 A176 L177 L180 W200	C134-L172 HydrophobicContact CB-CD2 4.12Å; C134-L172 HydrophobicContact CB-CG 4.4Å; C134-L172 WeakPolarHBondContact O-CD2 3.45Å; L137-L172 HydrophobicContact CD2-CD1 4.49Å; Q138-L172 HydrophobicContact CB-CD2 4.09Å; G168-L172 WeakPolarHBondContact O-CG 3.25Å; G168-L172 PolarHBondContact O-N 3Å; F169-L172 HydrophobicContact CD2-CD1 4.14Å; F169-L172 PolarHBondContact O-N 3.48Å; L172-A176 HydrophobicContact CB-CB 4.41Å; L172-A176 HydrophobicContact CD2-CB 3.98Å; L172-L177 HydrophobicContact CD1-CD1 4.17Å; L172-L180 HydrophobicContact CD1-CD1 4Å; L172-W200 PolarHBondContact O-NE1 2.88Å
173	S	96.8	Very high	95.7	Very high	40 Å²	40	41 Å²	41	28%	0.28	21%	0.208	S	C	.	.			trans	-70.4	156.4	163.5	64.8	0	0	0	0	110.8	Q138 A175 A176 L177	Q138-S173 PolarHBondContact NE2-OG 2.69Å; Q138-S173 VanDerWaalsContact NE2-OG 3.12Å; Q138-S173 VanDerWaalsContact OE1-CB 3.22Å; Q138-S173 PolarHBondContact OE1-OG 3.34Å; S173-A175 PolarHBondContact O-N 3.13Å; S173-A176 PolarHBondContact O-N 3.25Å; S173-A176 WeakPolarHBondContact OG-CB 3.33Å; S173-A176 PolarHBondContact OG-N 3.11Å; S173-L177 PolarHBondContact O-N 3.21Å
174	A	96.5	Very high	95.6	Very high	25 Å²	25	42.8 Å²	42.8	21%	0.207	22%	0.218	C	C	.	.	H	α-helix	trans	-55.1	-38.2	173.2	0	0	0	0	0	111.8	A176 L177 L178 W200 P218 V219	A174-A176 VanDerWaalsContact C-N 3.32Å; A174-A176 PolarHBondContact O-N 2.78Å; A174-L177 PolarHBondContact O-N 3.39Å; A174-L178 VanDerWaalsContact O-CG 3.29Å; A174-L178 WeakPolarHBondContact O-CG 3.49Å; A174-L178 PolarHBondContact O-N 3.12Å; A174-W200 HydrophobicContact CB-CH2 4Å; A174-W200 HydrophobicContact CB-CZ2 4.18Å; A174-P218 HydrophobicContact CB-CB 4.12Å; A174-P218 HydrophobicContact CB-CG 3.56Å; A174-V219 HydrophobicContact CB-CG1 4.06Å
175	A	96.9	Very high	95.6	Very high	56 Å²	56	47.2 Å²	47.2	46%	0.463	24%	0.236	S	C	.	.	H	α-helix	trans	-61.6	-38.9	177.2	0	0	0	0	0	112.5	V141 S173 P179	V141-A175 HydrophobicContact CG1-CB 3.96Å; S173-A175 PolarHBondContact O-N 3.13Å; A175-P179 WeakPolarHBondContact O-CD 3.38Å
176	A	97.3	Very high	95.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-76.6	-29	177.4	0	0	0	0	0	113.1	L137 V141 L172 S173 A174 P179	L137-A176 HydrophobicContact CG-CB 4.43Å; V141-A176 HydrophobicContact CB-CB 4.24Å; V141-A176 HydrophobicContact CG1-CB 4.43Å; V141-A176 HydrophobicContact CG2-CB 4.26Å; L172-A176 HydrophobicContact CB-CB 4.41Å; L172-A176 HydrophobicContact CD2-CB 3.98Å; S173-A176 PolarHBondContact O-N 3.25Å; S173-A176 WeakPolarHBondContact OG-CB 3.33Å; S173-A176 PolarHBondContact OG-N 3.11Å; A174-A176 VanDerWaalsContact C-N 3.32Å; A174-A176 PolarHBondContact O-N 2.78Å; A176-P179 WeakPolarHBondContact O-CD 3.48Å
177	L	97.1	Very high	95.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-75.3	-32.6	177.9	-168.1	60.1	0	0	0	112.8	F169 L172 S173 A174 L180 L181 W200 V219	F169-L177 HydrophobicContact CD2-CD1 4.27Å; F169-L177 HydrophobicContact CE1-CD1 4.48Å; F169-L177 HydrophobicContact CE2-CD1 3.4Å; F169-L177 HydrophobicContact CZ-CD1 3.53Å; L172-L177 HydrophobicContact CD1-CD1 4.17Å; S173-L177 PolarHBondContact O-N 3.21Å; A174-L177 PolarHBondContact O-N 3.39Å; L177-L180 HydrophobicContact CD1-CD1 4.3Å; L177-L180 WeakPolarHBondContact O-CB 3.32Å; L177-L180 PolarHBondContact O-N 2.73Å; L177-L180 VanDerWaalsContact O-N 3.11Å; L177-L181 HydrophobicContact CD1-CG 4.39Å; L177-L181 HydrophobicContact CD2-CD1 4.04Å; L177-L181 HydrophobicContact CG-CD1 3.83Å; L177-L181 HydrophobicContact CG-CG 4Å; L177-L181 PolarHBondContact O-N 2.97Å; L177-W200 HydrophobicContact CD2-CD2 3.72Å; L177-W200 HydrophobicContact CD2-CE3 3.98Å; L177-W200 HydrophobicContact CD2-CG 4.08Å; L177-W200 HydrophobicContact CD2-CZ2 4.38Å; L177-W200 HydrophobicContact CD2-CZ3 4.43Å; L177-V219 HydrophobicContact CB-CG1 4.33Å; L177-V219 HydrophobicContact CD2-CB 4.39Å; L177-V219 HydrophobicContact CD2-CG1 4.09Å; L177-V219 HydrophobicContact CD2-CG2 4.47Å; L177-V219 HydrophobicContact CG-CG1 4.44Å
178	L	95.9	Very high	95.7	Very high	31 Å²	31	34.8 Å²	34.8	16%	0.162	19%	0.189	C	C	.	.	H	α-helix	trans	-55.4	-48.5	-178.1	-81.1	173.5	0	0	0	114.3	A174 L180 L181 R182 V219 E222	A174-L178 VanDerWaalsContact O-CG 3.29Å; A174-L178 WeakPolarHBondContact O-CG 3.49Å; A174-L178 PolarHBondContact O-N 3.12Å; L178-L180 PolarHBondContact O-N 3.22Å; L178-L181 PolarHBondContact O-N 3.21Å; L178-R182 WeakPolarHBondContact O-CB 3.31Å; L178-R182 VanDerWaalsContact O-CG 3.32Å; L178-R182 WeakPolarHBondContact O-CG 3.17Å; L178-R182 PolarHBondContact O-N 2.98Å; L178-V219 HydrophobicContact CD2-CG1 4.37Å; L178-V219 HydrophobicContact CG-CG1 4.44Å; L178-E222 HydrophobicContact CD2-CG 3.59Å
179	P	94.7	Very high	95.7	Very high	30 Å²	30	34.6 Å²	34.6	20%	0.195	19%	0.187	C	C	.	.	H	α-helix	trans	-55.3	-38	174.9	-26.5	32.4	0	0	0	113.6	Q149 V153 A175 A176 S183	Q149-P179 VanDerWaalsContact NE2-CG 3.34Å; V153-P179 HydrophobicContact CG2-CB 4.21Å; A175-P179 WeakPolarHBondContact O-CD 3.38Å; A176-P179 WeakPolarHBondContact O-CD 3.48Å; P179-S183 PolarHBondContact O-N 2.81Å
180	L	95.5	Very high	95.5	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-68.8	-50.8	178	-59.1	178	0	0	0	110.6	L137 V153 I156 L172 L177 L178 R182 S183 L186	L137-L180 HydrophobicContact CD2-CD1 3.65Å; L137-L180 HydrophobicContact CD2-CD2 3.99Å; L137-L180 HydrophobicContact CD2-CG 3.82Å; V153-L180 HydrophobicContact CB-CD2 4.4Å; V153-L180 HydrophobicContact CG1-CD2 4.36Å; V153-L180 HydrophobicContact CG2-CD2 3.97Å; I156-L180 HydrophobicContact CB-CD2 4.06Å; I156-L180 HydrophobicContact CD1-CD1 3.94Å; I156-L180 HydrophobicContact CD1-CD2 3.76Å; I156-L180 HydrophobicContact CD1-CG 4.49Å; I156-L180 HydrophobicContact CG2-CD1 4.39Å; I156-L180 HydrophobicContact CG2-CD2 3.86Å; L172-L180 HydrophobicContact CD1-CD1 4Å; L177-L180 HydrophobicContact CD1-CD1 4.3Å; L177-L180 WeakPolarHBondContact O-CB 3.32Å; L177-L180 PolarHBondContact O-N 2.73Å; L177-L180 VanDerWaalsContact O-N 3.11Å; L178-L180 PolarHBondContact O-N 3.22Å; L180-R182 PolarHBondContact O-N 3.02Å; L180-S183 WeakPolarHBondContact O-CB 3.49Å; L180-S183 PolarHBondContact O-N 3.39Å; L180-L186 VanDerWaalsContact O-CD1 3.24Å; L180-L186 WeakPolarHBondContact O-CD1 3.3Å
181	L	94.5	Very high	95.4	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-17.8	179.9	-63.2	179.1	0	0	0	113.2	L177 L178 L193 V219 E222 L223 R274	L177-L181 HydrophobicContact CD1-CG 4.39Å; L177-L181 HydrophobicContact CD2-CD1 4.04Å; L177-L181 HydrophobicContact CG-CD1 3.83Å; L177-L181 HydrophobicContact CG-CG 4Å; L177-L181 PolarHBondContact O-N 2.97Å; L178-L181 PolarHBondContact O-N 3.21Å; L181-L193 HydrophobicContact CD2-CD2 3.93Å; L181-V219 HydrophobicContact CD1-CB 3.68Å; L181-V219 HydrophobicContact CD1-CG1 4.26Å; L181-E222 HydrophobicContact CB-CB 3.61Å; L181-E222 HydrophobicContact CB-CG 4.33Å; L181-E222 HydrophobicContact CD1-CB 4.36Å; L181-L223 HydrophobicContact CD2-CD2 4.3Å; L181-R274 VanDerWaalsContact C-NH1 3.31Å; L181-R274 PolarHBondContact O-NH1 2.73Å; L181-R274 PolarHBondContact O-NH2 3.2Å
182	R	93.8	Very high	95.4	Very high	137 Å²	137	29.9 Å²	29.9	52%	0.517	17%	0.166	S	C	.	.	H	α-helix	trans	-82.1	-21.9	170.7	-73.9	170.2	-179.1	163.2	5.2	113.4	L178 L180 D184 E222 R224	L178-R182 WeakPolarHBondContact O-CB 3.31Å; L178-R182 VanDerWaalsContact O-CG 3.32Å; L178-R182 WeakPolarHBondContact O-CG 3.17Å; L178-R182 PolarHBondContact O-N 2.98Å; L180-R182 PolarHBondContact O-N 3.02Å; R182-D184 PolarHBondContact O-N 2.79Å; R182-E222 HydrophobicContact CG-CG 4.37Å; R182-E222 VanDerWaalsContact CG-OE2 3.25Å; R182-E222 WeakPolarHBondContact CG-OE2 3.47Å; R182-E222 IonicContact CZ-OE1 3.17Å; R182-E222 VanDerWaalsContact CZ-OE1 3.3Å; R182-E222 IonicContact NE-OE1 3.36Å; R182-E222 PolarHBondContact NE-OE1 3.07Å; R182-E222 IonicContact NE-OE2 3.53Å; R182-E222 IonicContact NH2-OE1 3.05Å; R182-E222 PolarHBondContact NH2-OE1 3.39Å; R182-R224 PolarHBondContact O-NH2 2.95Å
183	S	94.1	Very high	95.3	Very high	16 Å²	16	29.6 Å²	29.6	11%	0.112	16%	0.164	C	C	.	.			trans	-72	126.4	-174.7	179.3	0	0	0	0	113.4	E157 P179 L180 K185 R274	E157-S183 WeakPolarHBondContact OE1-CB 3.27Å; E157-S183 PolarHBondContact OE1-OG 3.37Å; P179-S183 PolarHBondContact O-N 2.81Å; L180-S183 WeakPolarHBondContact O-CB 3.49Å; L180-S183 PolarHBondContact O-N 3.39Å; S183-K185 PolarHBondContact O-N 3.07Å; S183-K185 PolarHBondContact OG-N 2.9Å; S183-R274 PolarHBondContact O-NH1 3.26Å
184	D	93.8	Very high	95.2	Very high	39 Å²	39	28 Å²	28	21%	0.209	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.7	170.9	-59.4	-53.8	0	0	0	113.5	R182 R224 R272 R274 R275	R182-D184 PolarHBondContact O-N 2.79Å; D184-R224 IonicContact OD1-CZ 3.14Å; D184-R224 IonicContact OD1-NH1 2.83Å; D184-R224 PolarHBondContact OD1-NH1 2.84Å; D184-R224 IonicContact OD1-NH2 3.94Å; D184-R224 PolarHBondContact OD1-NH2 3.19Å; D184-R272 WeakPolarHBondContact OD1-CD 3.16Å; D184-R272 IonicContact OD1-NE 2.79Å; D184-R272 WeakPolarHBondContact OD2-CD 3.28Å; D184-R272 IonicContact OD2-CZ 3.87Å; D184-R272 IonicContact OD2-NE 2.63Å; D184-R272 PolarHBondContact OD2-NE 2.88Å; D184-R272 IonicContact OD2-NH1 3.3Å; D184-R272 PolarHBondContact OD2-NH1 3.47Å; D184-R274 CarbonylContact O-C 3.5Å; D184-R274 VanDerWaalsContact O-CA 3.24Å; D184-R274 WeakPolarHBondContact O-CA 3.39Å; D184-R275 PolarHBondContact O-N 3.17Å
185	K	95.5	Very high	95.2	Very high	112 Å²	112	33.3 Å²	33.3	49%	0.487	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-7.8	-172.3	-64	172.4	-178.5	173	0	113.6	E157 S183 C187 R275	E157-K185 HydrophobicContact CB-CB 4.22Å; E157-K185 VanDerWaalsContact CD-CB 3.41Å; E157-K185 HydrophobicContact CG-CB 3.78Å; E157-K185 WeakPolarHBondContact OE2-CD 3.44Å; S183-K185 PolarHBondContact O-N 3.07Å; S183-K185 PolarHBondContact OG-N 2.9Å; K185-C187 PolarHBondContact O-N 2.93Å; K185-R275 WeakPolarHBondContact O-CB 3.24Å
186	L	95.6	Very high	95.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.15	C	C	.	.			trans	-57.1	129.9	176.1	-66.3	-180	0	0	0	110.9	I156 E157 L180 V188 L193 R275 G276	I156-L186 HydrophobicContact CG2-CD2 4.1Å; E157-L186 HydrophobicContact CG-CD2 4.23Å; L180-L186 VanDerWaalsContact O-CD1 3.24Å; L180-L186 WeakPolarHBondContact O-CD1 3.3Å; L186-V188 PolarHBondContact O-N 3.13Å; L186-V188 VanDerWaalsContact O-N 3.16Å; L186-L193 HydrophobicContact CD1-CD1 4.36Å; L186-L193 HydrophobicContact CD1-CD2 4.15Å; L186-R275 PolarHBondContact O-N 3.45Å; L186-G276 PolarHBondContact O-N 3.29Å
187	C	95.3	Very high	95.1	Very high	58 Å²	58	31.4 Å²	31.4	39%	0.392	15%	0.151	S	C	.	.			trans	-90.1	52.2	179.2	-157.7	0	0	0	0	111.2	S160 K185	S160-C187 PolarHBondContact OG-N 3.46Å; S160-C187 VanDerWaalsContact OG-N 3.07Å; K185-C187 PolarHBondContact O-N 2.93Å
188	V	94.8	Very high	95	Very high	2 Å²	2	32 Å²	32	1%	0.012	15%	0.154	C	C	.	.	S	Bend	trans	-139.2	144.9	-178.4	-179.9	0	0	0	0	110.1	S160 Q161 L164 L186 E192 L193 G276	S160-V188 VanDerWaalsContact CB-CG2 3.44Å; Q161-V188 HydrophobicContact CG-CG2 4.16Å; L164-V188 HydrophobicContact CD2-CB 4.21Å; L164-V188 HydrophobicContact CD2-CG1 3.75Å; L164-V188 HydrophobicContact CD2-CG2 3.91Å; L186-V188 PolarHBondContact O-N 3.13Å; L186-V188 VanDerWaalsContact O-N 3.16Å; V188-E192 HydrophobicContact CG1-CB 3.37Å; V188-E192 HydrophobicContact CG1-CG 4.34Å; V188-L193 HydrophobicContact CB-CG 4.43Å; V188-L193 HydrophobicContact CG1-CG 4.07Å; V188-G276 CarbonylContact C-O 3.54Å; V188-G276 CarbonylContact O-C 3.46Å
189	D	95.1	Very high	95	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	16%	0.164	C	C	.	.			trans	-75.2	149.6	174.2	-171.1	72.9	0	0	0	112.3	A191 E192 L193 G276 L278 R280	D189-A191 PolarHBondContact O-N 2.91Å; D189-A191 WeakPolarHBondContact OD2-CB 3.32Å; D189-A191 PolarHBondContact OD2-N 2.95Å; D189-E192 WeakPolarHBondContact O-CB 3.45Å; D189-E192 PolarHBondContact O-N 3.08Å; D189-L193 PolarHBondContact O-N 3.32Å; D189-L193 VanDerWaalsContact O-N 3.08Å; D189-G276 PolarHBondContact N-O 2.95Å; D189-L278 HydrophobicContact CB-CD1 4.21Å; D189-L278 HydrophobicContact CB-CG 4.04Å; D189-L278 WeakPolarHBondContact OD1-CB 3.23Å; D189-L278 PolarHBondContact OD1-N 3.35Å; D189-R280 VanDerWaalsContact CG-NH2 3.33Å; D189-R280 IonicContact OD1-CZ 3.45Å; D189-R280 IonicContact OD1-NH1 2.78Å; D189-R280 PolarHBondContact OD1-NH1 2.96Å; D189-R280 IonicContact OD1-NH2 3.2Å; D189-R280 PolarHBondContact OD1-NH2 3.45Å; D189-R280 IonicContact OD2-CZ 3.73Å; D189-R280 IonicContact OD2-NH1 3.66Å; D189-R280 IonicContact OD2-NH2 2.75Å; D189-R280 PolarHBondContact OD2-NH2 2.88Å
190	E	93.6	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-32.1	-179.7	-70	-64.7	150.5	0	0	112.8	E192 L193 V194 R224 L227 L228 R274	E190-E192 VanDerWaalsContact C-N 3.27Å; E190-E192 PolarHBondContact O-N 3.39Å; E190-L193 PolarHBondContact O-N 2.89Å; E190-V194 WeakPolarHBondContact O-CB 3.39Å; E190-V194 VanDerWaalsContact O-CG2 3.23Å; E190-V194 WeakPolarHBondContact O-CG2 3.42Å; E190-V194 PolarHBondContact O-N 3.35Å; E190-R224 VanDerWaalsContact CD-CB 3.49Å; E190-R224 HydrophobicContact CG-CB 3.97Å; E190-R224 WeakPolarHBondContact OE1-CD 3.37Å; E190-R224 IonicContact OE1-NE 3.21Å; E190-R224 PolarHBondContact OE2-N 3.01Å; E190-L227 HydrophobicContact CG-CB 3.98Å; E190-L227 HydrophobicContact CG-CD1 4.03Å; E190-L228 HydrophobicContact CB-CD2 3.9Å; E190-R274 VanDerWaalsContact OE1-CD 3.31Å; E190-R274 WeakPolarHBondContact OE1-CD 3.26Å; E190-R274 IonicContact OE1-CZ 3.11Å; E190-R274 IonicContact OE1-NE 2.97Å; E190-R274 PolarHBondContact OE1-NE 3.21Å; E190-R274 IonicContact OE1-NH2 3.85Å
191	A	94.5	Very high	95.1	Very high	14 Å²	14	31.9 Å²	31.9	12%	0.116	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-34.4	176.6	0	0	0	0	0	112	D189 R195 L228	D189-A191 PolarHBondContact O-N 2.91Å; D189-A191 WeakPolarHBondContact OD2-CB 3.32Å; D189-A191 PolarHBondContact OD2-N 2.95Å; A191-R195 WeakPolarHBondContact O-CG 3.41Å; A191-R195 PolarHBondContact O-N 3.43Å; A191-R195 PolarHBondContact O-NE 2.98Å; A191-R195 VanDerWaalsContact O-NE 3.14Å; A191-L228 HydrophobicContact CB-CD2 3.82Å
192	E	95.1	Very high	95.2	Very high	51 Å²	51	37.5 Å²	37.5	24%	0.238	18%	0.176	C	C	.	.	H	α-helix	trans	-72.9	-41.6	174.1	-75.6	-175.2	-118.2	0	0	111.6	R165 V188 D189 E190 R195 A196	R165-E192 IonicContact NH2-OE2 3.53Å; V188-E192 HydrophobicContact CG1-CB 3.37Å; V188-E192 HydrophobicContact CG1-CG 4.34Å; D189-E192 WeakPolarHBondContact O-CB 3.45Å; D189-E192 PolarHBondContact O-N 3.08Å; E190-E192 VanDerWaalsContact C-N 3.27Å; E190-E192 PolarHBondContact O-N 3.39Å; E192-R195 PolarHBondContact O-N 3.06Å; E192-A196 WeakPolarHBondContact O-CB 3.08Å; E192-A196 PolarHBondContact O-N 3.31Å
193	L	95.1	Very high	95.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-41.2	176.6	-81.6	167.4	0	0	0	112.9	L164 L181 L186 V188 D189 E190 R195 A196 A197 L223 R274	L164-L193 HydrophobicContact CD2-CD2 3.64Å; L164-L193 HydrophobicContact CD2-CG 4.23Å; L164-L193 HydrophobicContact CG-CD2 4.48Å; L181-L193 HydrophobicContact CD2-CD2 3.93Å; L186-L193 HydrophobicContact CD1-CD1 4.36Å; L186-L193 HydrophobicContact CD1-CD2 4.15Å; V188-L193 HydrophobicContact CB-CG 4.43Å; V188-L193 HydrophobicContact CG1-CG 4.07Å; D189-L193 PolarHBondContact O-N 3.32Å; D189-L193 VanDerWaalsContact O-N 3.08Å; E190-L193 PolarHBondContact O-N 2.89Å; L193-R195 VanDerWaalsContact C-N 3.32Å; L193-R195 PolarHBondContact O-N 3.39Å; L193-A196 PolarHBondContact O-N 3.05Å; L193-A197 WeakPolarHBondContact O-CB 3.33Å; L193-A197 PolarHBondContact O-N 3.14Å; L193-L223 HydrophobicContact CB-CD2 4.44Å; L193-R274 VanDerWaalsContact CD1-CD 3.49Å
194	V	95.4	Very high	95.3	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-41.8	175.3	171.5	0	0	0	0	110.8	E190 R198 L223 L225 L236 I246	E190-V194 WeakPolarHBondContact O-CB 3.39Å; E190-V194 VanDerWaalsContact O-CG2 3.23Å; E190-V194 WeakPolarHBondContact O-CG2 3.42Å; E190-V194 PolarHBondContact O-N 3.35Å; V194-R198 WeakPolarHBondContact O-CB 3.29Å; V194-R198 PolarHBondContact O-N 2.96Å; V194-L223 HydrophobicContact CG2-CB 4.44Å; V194-L223 HydrophobicContact CG2-CD1 4.19Å; V194-L223 HydrophobicContact CG2-CD2 4.4Å; V194-L225 HydrophobicContact CG2-CD2 3.78Å; V194-L236 HydrophobicContact CG1-CD1 3.58Å; V194-L236 HydrophobicContact CG1-CD2 4.26Å; V194-I246 HydrophobicContact CG1-CD1 4.45Å
195	R	95.3	Very high	95.3	Very high	136 Å²	136	32.1 Å²	32.1	51%	0.513	16%	0.163	S	C	.	.	H	α-helix	trans	-65.6	-41.5	175.4	-78.3	-177.5	-86	111.7	-7.3	112.4	A191 E192 L193 R198 S199	A191-R195 WeakPolarHBondContact O-CG 3.41Å; A191-R195 PolarHBondContact O-N 3.43Å; A191-R195 PolarHBondContact O-NE 2.98Å; A191-R195 VanDerWaalsContact O-NE 3.14Å; E192-R195 PolarHBondContact O-N 3.06Å; L193-R195 VanDerWaalsContact C-N 3.32Å; L193-R195 PolarHBondContact O-N 3.39Å; R195-R198 PolarHBondContact O-N 3.47Å; R195-S199 PolarHBondContact O-N 3.34Å; R195-S199 PolarHBondContact O-OG 2.63Å
196	A	95.8	Very high	95.3	Very high	12 Å²	12	30.5 Å²	30.5	10%	0.099	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-46.5	176.3	0	0	0	0	0	111.2	L164 F169 E192 L193 R198 S199 W200	L164-A196 HydrophobicContact CD2-CB 4.14Å; L164-A196 HydrophobicContact CG-CB 4.37Å; F169-A196 HydrophobicContact CE1-CB 3.8Å; F169-A196 HydrophobicContact CZ-CB 4.07Å; E192-A196 WeakPolarHBondContact O-CB 3.08Å; E192-A196 PolarHBondContact O-N 3.31Å; L193-A196 PolarHBondContact O-N 3.05Å; A196-R198 VanDerWaalsContact C-N 3.33Å; A196-R198 PolarHBondContact O-N 3.33Å; A196-S199 PolarHBondContact O-N 3.42Å; A196-S199 VanDerWaalsContact O-N 3.14Å; A196-W200 WeakPolarHBondContact O-CB 3.32Å; A196-W200 PolarHBondContact O-N 3.31Å
197	A	95.9	Very high	95.2	Very high	3 Å²	3	35.8 Å²	35.8	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-38.3	177	0	0	0	0	0	112.5	L193 A201 L223	L193-A197 WeakPolarHBondContact O-CB 3.33Å; L193-A197 PolarHBondContact O-N 3.14Å; A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.4Å; A197-A201 PolarHBondContact O-N 3.28Å; A197-L223 HydrophobicContact CB-CD1 4.15Å; A197-L223 HydrophobicContact CB-CD2 4.19Å
198	R	95.4	Very high	95.1	Very high	13 Å²	13	37.7 Å²	37.7	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-45.9	172.6	-174.1	177	-67.8	-82.4	-0.6	111.7	V194 R195 A196 A201 R202 E243 L245	V194-R198 WeakPolarHBondContact O-CB 3.29Å; V194-R198 PolarHBondContact O-N 2.96Å; R195-R198 PolarHBondContact O-N 3.47Å; A196-R198 VanDerWaalsContact C-N 3.33Å; A196-R198 PolarHBondContact O-N 3.33Å; R198-A201 PolarHBondContact O-N 3.43Å; R198-R202 WeakPolarHBondContact O-CG 3.3Å; R198-R202 PolarHBondContact O-N 3.01Å; R198-E243 IonicContact CZ-OE2 3.68Å; R198-E243 PolarHBondContact NH1-O 3.31Å; R198-E243 IonicContact NH1-OE2 3.8Å; R198-E243 PolarHBondContact NH1-OE2 2.88Å; R198-L245 HydrophobicContact CB-CD2 3.73Å; R198-L245 HydrophobicContact CG-CD2 4.09Å
199	S	95.8	Very high	95	Very high	54 Å²	54	46.3 Å²	46.3	38%	0.378	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-45.2	-179.3	-55.2	0	0	0	0	111.1	R195 A196 R202 V203	R195-S199 PolarHBondContact O-N 3.34Å; R195-S199 PolarHBondContact O-OG 2.63Å; A196-S199 PolarHBondContact O-N 3.42Å; A196-S199 VanDerWaalsContact O-N 3.14Å; S199-R202 PolarHBondContact O-N 3.16Å; S199-V203 WeakPolarHBondContact O-CG2 3.49Å; S199-V203 PolarHBondContact O-N 3.36Å; S199-V203 VanDerWaalsContact O-N 3.12Å
200	W	97.4	Very high	94.9	Very high	8 Å²	8	51.3 Å²	51.3	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-56.4	-50	172.2	169.6	82.4	0	0	0	112	F169 L170 L172 A174 L177 A196 R202 V203 G204 V215 V219	F169-W200 HydrophobicContact CE1-CB 4.21Å; L170-W200 HydrophobicContact CD2-CB 4.31Å; L172-W200 PolarHBondContact O-NE1 2.88Å; A174-W200 HydrophobicContact CB-CH2 4Å; A174-W200 HydrophobicContact CB-CZ2 4.18Å; L177-W200 HydrophobicContact CD2-CD2 3.72Å; L177-W200 HydrophobicContact CD2-CE3 3.98Å; L177-W200 HydrophobicContact CD2-CG 4.08Å; L177-W200 HydrophobicContact CD2-CZ2 4.38Å; L177-W200 HydrophobicContact CD2-CZ3 4.43Å; A196-W200 WeakPolarHBondContact O-CB 3.32Å; A196-W200 PolarHBondContact O-N 3.31Å; W200-R202 VanDerWaalsContact C-N 3.29Å; W200-R202 PolarHBondContact O-N 3.33Å; W200-V203 PolarHBondContact O-N 2.79Å; W200-G204 PolarHBondContact O-N 3.36Å; W200-V215 HydrophobicContact CH2-CG1 3.84Å; W200-V215 WeakPolarHBondContact CH2-O 3.47Å; W200-V215 HydrophobicContact CZ2-CG1 4.41Å; W200-V215 HydrophobicContact CZ3-CG1 3.98Å; W200-V215 WeakPolarHBondContact CZ3-O 3.35Å; W200-V219 HydrophobicContact CE3-CG2 4.03Å; W200-V219 HydrophobicContact CH2-CG1 4.19Å; W200-V219 HydrophobicContact CH2-CG2 4.06Å; W200-V219 HydrophobicContact CZ3-CB 4.5Å; W200-V219 HydrophobicContact CZ3-CG1 4.33Å; W200-V219 HydrophobicContact CZ3-CG2 3.4Å
201	A	96.3	Very high	94.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-32.8	-178.8	0	0	0	0	0	112.7	A197 R198 A205 V212 A216 L245	A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.4Å; A197-A201 PolarHBondContact O-N 3.28Å; R198-A201 PolarHBondContact O-N 3.43Å; A201-A205 WeakPolarHBondContact O-CB 3.44Å; A201-A205 PolarHBondContact O-N 3.39Å; A201-V212 HydrophobicContact CB-CG1 3.84Å; A201-A216 HydrophobicContact CB-CB 3.86Å; A201-L245 HydrophobicContact CB-CD1 3.7Å
202	R	95.4	Very high	94.9	Very high	120 Å²	120	55.9 Å²	55.9	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-66	-45.1	173.7	-75.8	174.5	176.1	174.3	0	112.3	R198 S199 W200 A205 A206 V212 E243	R198-R202 WeakPolarHBondContact O-CG 3.3Å; R198-R202 PolarHBondContact O-N 3.01Å; S199-R202 PolarHBondContact O-N 3.16Å; W200-R202 VanDerWaalsContact C-N 3.29Å; W200-R202 PolarHBondContact O-N 3.33Å; R202-A205 PolarHBondContact O-N 2.99Å; R202-A206 PolarHBondContact O-N 3.47Å; R202-V212 HydrophobicContact CG-CG2 4.33Å; R202-E243 IonicContact CZ-OE1 2.75Å; R202-E243 IonicContact CZ-OE2 2.9Å; R202-E243 VanDerWaalsContact CZ-OE2 3.24Å; R202-E243 VanDerWaalsContact NE-CD 3.31Å; R202-E243 IonicContact NE-OE1 3.43Å; R202-E243 PolarHBondContact NE-OE1 3.49Å; R202-E243 IonicContact NE-OE2 2.71Å; R202-E243 PolarHBondContact NE-OE2 2.99Å; R202-E243 IonicContact NH2-OE1 3.53Å; R202-E243 PolarHBondContact NH2-OE1 3.34Å; R202-E243 IonicContact NH2-OE2 3.24Å; R202-E243 PolarHBondContact NH2-OE2 2.92Å
203	V	95.8	Very high	94.8	Very high	54 Å²	54	55.5 Å²	55.5	33%	0.327	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-48.1	176.5	174.3	0	0	0	0	110	L170 S199 W200 A205 A206 V207	L170-V203 HydrophobicContact CB-CB 4.46Å; L170-V203 HydrophobicContact CB-CG1 4.43Å; L170-V203 HydrophobicContact CB-CG2 4.28Å; L170-V203 HydrophobicContact CD1-CG2 4.28Å; S199-V203 WeakPolarHBondContact O-CG2 3.49Å; S199-V203 PolarHBondContact O-N 3.36Å; S199-V203 VanDerWaalsContact O-N 3.12Å; W200-V203 PolarHBondContact O-N 2.79Å; V203-A205 VanDerWaalsContact C-N 3.32Å; V203-A205 PolarHBondContact O-N 2.85Å; V203-A206 PolarHBondContact O-N 3.4Å; V203-V207 HydrophobicContact CG1-CG2 4.38Å; V203-V207 VanDerWaalsContact O-CG2 3.3Å; V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 3.5Å
204	G	94.1	Very high	94.7	Very high	13 Å²	13	59.8 Å²	59.8	13%	0.134	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-38.3	176.6	0	0	0	0	0	113.2	W200 V207 L208	W200-G204 PolarHBondContact O-N 3.36Å; G204-V207 PolarHBondContact O-N 3.01Å; G204-L208 VanDerWaalsContact O-CB 3.24Å; G204-L208 WeakPolarHBondContact O-CB 3.3Å; G204-L208 VanDerWaalsContact O-CG 3.28Å; G204-L208 WeakPolarHBondContact O-CG 3.47Å; G204-L208 PolarHBondContact O-N 3.02Å
205	A	95	Very high	94.7	Very high	11 Å²	11	59.9 Å²	59.9	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-42.3	174.9	0	0	0	0	0	112.6	A201 R202 V203 E209 R210 V212 V215	A201-A205 WeakPolarHBondContact O-CB 3.44Å; A201-A205 PolarHBondContact O-N 3.39Å; R202-A205 PolarHBondContact O-N 2.99Å; V203-A205 VanDerWaalsContact C-N 3.32Å; V203-A205 PolarHBondContact O-N 2.85Å; A205-E209 WeakPolarHBondContact O-CA 3.45Å; A205-E209 PolarHBondContact O-N 3.28Å; A205-R210 VanDerWaalsContact CA-O 3.3Å; A205-R210 WeakPolarHBondContact CA-O 3.38Å; A205-R210 WeakPolarHBondContact CB-O 3.31Å; A205-R210 PolarHBondContact O-N 3.36Å; A205-R210 VanDerWaalsContact O-N 3.13Å; A205-V212 HydrophobicContact CB-CB 4.36Å; A205-V212 HydrophobicContact CB-CG2 3.6Å; A205-V215 HydrophobicContact CB-CG2 4.35Å
206	A	94.6	Very high	94.7	Very high	78 Å²	78	53.5 Å²	53.5	65%	0.645	30%	0.297	S	S	*	.	H	α-helix	trans	-66.5	-41.5	177.1	0	0	0	0	0	112	R202 V203	R202-A206 PolarHBondContact O-N 3.47Å; V203-A206 PolarHBondContact O-N 3.4Å
207	V	93.3	Very high	94.6	Very high	113 Å²	113	55.2 Å²	55.2	69%	0.685	31%	0.311	S	S	*	.	H	α-helix	trans	-72.5	-40.1	-178.9	173.4	0	0	0	0	112	V203 G204	V203-V207 HydrophobicContact CG1-CG2 4.38Å; V203-V207 VanDerWaalsContact O-CG2 3.3Å; V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 3.5Å; G204-V207 PolarHBondContact O-N 3.01Å
208	L	92.8	Very high	94.5	Very high	98 Å²	98	57.9 Å²	57.9	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-90.9	-3.1	-177	-61.1	174.8	0	0	0	113.4	G204 R210 V215	G204-L208 VanDerWaalsContact O-CB 3.24Å; G204-L208 WeakPolarHBondContact O-CB 3.3Å; G204-L208 VanDerWaalsContact O-CG 3.28Å; G204-L208 WeakPolarHBondContact O-CG 3.47Å; G204-L208 PolarHBondContact O-N 3.02Å; L208-R210 HydrophobicContact CB-CB 4.39Å; L208-R210 HydrophobicContact CB-CG 4.4Å; L208-R210 WeakPolarHBondContact O-CG 3.49Å; L208-R210 PolarHBondContact O-N 3.05Å; L208-V215 HydrophobicContact CD1-CG2 4.34Å
209	E	93.4	Very high	94.4	Very high	182 Å²	182	57.3 Å²	57.3	85%	0.85	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	39.4	-173.2	-59	-176.1	175.3	0	0	112.9	A205	A205-E209 WeakPolarHBondContact O-CA 3.45Å; A205-E209 PolarHBondContact O-N 3.28Å
210	R	93.9	Very high	94.3	Very high	110 Å²	110	54.8 Å²	54.8	42%	0.415	31%	0.309	S	S	.	.			trans	-120.7	154.1	-177.6	-76.4	170.2	76.1	-166.9	9.5	111.7	A205 L208 E214 V215	A205-R210 VanDerWaalsContact CA-O 3.3Å; A205-R210 WeakPolarHBondContact CA-O 3.38Å; A205-R210 WeakPolarHBondContact CB-O 3.31Å; A205-R210 PolarHBondContact O-N 3.36Å; A205-R210 VanDerWaalsContact O-N 3.13Å; L208-R210 HydrophobicContact CB-CB 4.39Å; L208-R210 HydrophobicContact CB-CG 4.4Å; L208-R210 WeakPolarHBondContact O-CG 3.49Å; L208-R210 PolarHBondContact O-N 3.05Å; R210-E214 IonicContact CZ-OE1 2.76Å; R210-E214 VanDerWaalsContact CZ-OE1 3.3Å; R210-E214 IonicContact CZ-OE2 2.59Å; R210-E214 IonicContact NE-OE1 2.96Å; R210-E214 PolarHBondContact NE-OE1 3.33Å; R210-E214 IonicContact NE-OE2 2.68Å; R210-E214 PolarHBondContact NE-OE2 3.37Å; R210-E214 VanDerWaalsContact NE-OE2 3.11Å; R210-E214 IonicContact NH2-OE1 2.7Å; R210-E214 PolarHBondContact NH2-OE1 3.49Å; R210-E214 IonicContact NH2-OE2 3.58Å; R210-V215 HydrophobicContact CB-CG2 4.13Å
211	P	93.1	Very high	94	Very high	85 Å²	85	61.3 Å²	61.3	55%	0.552	34%	0.337	S	S	*	.			trans	-57.6	139.8	174.5	-23.6	33.9	0	0	0	112.6	A213 E214 V215	P211-A213 PolarHBondContact O-N 2.86Å; P211-E214 HydrophobicContact CB-CB 4.46Å; P211-E214 WeakPolarHBondContact CD-OE2 3.47Å; P211-E214 WeakPolarHBondContact O-CB 3.4Å; P211-E214 PolarHBondContact O-N 3.15Å; P211-V215 PolarHBondContact O-N 3.42Å
212	V	94.1	Very high	93.9	Very high	25 Å²	25	63.4 Å²	63.4	15%	0.152	35%	0.347	C	S	.	.	H	α-helix	trans	-51.9	-41.9	178.5	176.2	0	0	0	0	112.1	A201 R202 A205 E214 V215 A216 L245	A201-V212 HydrophobicContact CB-CG1 3.84Å; R202-V212 HydrophobicContact CG-CG2 4.33Å; A205-V212 HydrophobicContact CB-CB 4.36Å; A205-V212 HydrophobicContact CB-CG2 3.6Å; V212-E214 VanDerWaalsContact C-N 3.29Å; V212-E214 PolarHBondContact O-N 2.91Å; V212-V215 PolarHBondContact O-N 3.49Å; V212-A216 VanDerWaalsContact O-CB 3.24Å; V212-A216 WeakPolarHBondContact O-CB 3.31Å; V212-A216 PolarHBondContact O-N 3.22Å; V212-L245 HydrophobicContact CG1-CD1 3.59Å
213	A	93.1	Very high	93.8	Very high	43 Å²	43	57.9 Å²	57.9	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-35.8	177.7	0	0	0	0	0	113.1	P211 A217	P211-A213 PolarHBondContact O-N 2.86Å; A213-A217 WeakPolarHBondContact O-CB 3.33Å; A213-A217 PolarHBondContact O-N 2.92Å
214	E	93.5	Very high	93.7	Very high	90 Å²	90	55.9 Å²	55.9	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-73.5	-40.7	-179.1	-165.5	-176.3	178.4	0	0	111.2	R210 P211 V212 A216	R210-E214 IonicContact CZ-OE1 2.76Å; R210-E214 VanDerWaalsContact CZ-OE1 3.3Å; R210-E214 IonicContact CZ-OE2 2.59Å; R210-E214 IonicContact NE-OE1 2.96Å; R210-E214 PolarHBondContact NE-OE1 3.33Å; R210-E214 IonicContact NE-OE2 2.68Å; R210-E214 PolarHBondContact NE-OE2 3.37Å; R210-E214 VanDerWaalsContact NE-OE2 3.11Å; R210-E214 IonicContact NH2-OE1 2.7Å; R210-E214 PolarHBondContact NH2-OE1 3.49Å; R210-E214 IonicContact NH2-OE2 3.58Å; P211-E214 HydrophobicContact CB-CB 4.46Å; P211-E214 WeakPolarHBondContact CD-OE2 3.47Å; P211-E214 WeakPolarHBondContact O-CB 3.4Å; P211-E214 PolarHBondContact O-N 3.15Å; V212-E214 VanDerWaalsContact C-N 3.29Å; V212-E214 PolarHBondContact O-N 2.91Å; E214-A216 VanDerWaalsContact C-N 3.34Å
215	V	94.4	Very high	93.6	Very high	10 Å²	10	55.6 Å²	55.6	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-38.7	174.6	178.9	0	0	0	0	111.1	W200 A205 L208 R210 P211 V212 P218	W200-V215 HydrophobicContact CH2-CG1 3.84Å; W200-V215 WeakPolarHBondContact CH2-O 3.47Å; W200-V215 HydrophobicContact CZ2-CG1 4.41Å; W200-V215 HydrophobicContact CZ3-CG1 3.98Å; W200-V215 WeakPolarHBondContact CZ3-O 3.35Å; A205-V215 HydrophobicContact CB-CG2 4.35Å; L208-V215 HydrophobicContact CD1-CG2 4.34Å; R210-V215 HydrophobicContact CB-CG2 4.13Å; P211-V215 PolarHBondContact O-N 3.42Å; V212-V215 PolarHBondContact O-N 3.49Å; V215-P218 WeakPolarHBondContact O-CD 3.4Å
216	A	94.8	Very high	93.4	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-77.9	-26.1	-178.6	0	0	0	0	0	114.3	A201 V212 E214 P218 V219 V220 L245	A201-A216 HydrophobicContact CB-CB 3.86Å; V212-A216 VanDerWaalsContact O-CB 3.24Å; V212-A216 WeakPolarHBondContact O-CB 3.31Å; V212-A216 PolarHBondContact O-N 3.22Å; E214-A216 VanDerWaalsContact C-N 3.34Å; A216-P218 VanDerWaalsContact C-CD 3.43Å; A216-P218 VanDerWaalsContact O-N 3.13Å; A216-V219 WeakPolarHBondContact O-CG2 3.46Å; A216-V219 PolarHBondContact O-N 3.24Å; A216-V220 HydrophobicContact CB-CG1 3.73Å; A216-V220 WeakPolarHBondContact O-CG1 3.33Å; A216-V220 WeakPolarHBondContact O-CG2 3.49Å; A216-V220 PolarHBondContact O-N 3.5Å; A216-L245 HydrophobicContact CB-CD1 3.38Å; A216-L245 HydrophobicContact CB-CG 4.09Å
217	A	93.9	Very high	93.3	Very high	48 Å²	48	51.4 Å²	51.4	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-43.2	-45.9	-177	0	0	0	0	0	116.1	A213 V219	A213-A217 WeakPolarHBondContact O-CB 3.33Å; A213-A217 PolarHBondContact O-N 2.92Å; A217-V219 VanDerWaalsContact C-N 3.32Å; A217-V219 PolarHBondContact O-N 3.35Å
218	P	93.4	Very high	93.3	Very high	60 Å²	60	46.2 Å²	46.2	39%	0.39	24%	0.242	S	C	.	.	H	α-helix	trans	-67	-29	179	23.9	-34.7	0	0	0	114	A174 V215 A216	A174-P218 HydrophobicContact CB-CB 4.12Å; A174-P218 HydrophobicContact CB-CG 3.56Å; V215-P218 WeakPolarHBondContact O-CD 3.4Å; A216-P218 VanDerWaalsContact C-CD 3.43Å; A216-P218 VanDerWaalsContact O-N 3.13Å
219	V	94.4	Very high	93.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-103.9	-26.3	-168.3	-62.7	0	0	0	0	113.4	A174 L177 L178 L181 W200 A216 A217 K221 E222	A174-V219 HydrophobicContact CB-CG1 4.06Å; L177-V219 HydrophobicContact CB-CG1 4.33Å; L177-V219 HydrophobicContact CD2-CB 4.39Å; L177-V219 HydrophobicContact CD2-CG1 4.09Å; L177-V219 HydrophobicContact CD2-CG2 4.47Å; L177-V219 HydrophobicContact CG-CG1 4.44Å; L178-V219 HydrophobicContact CD2-CG1 4.37Å; L178-V219 HydrophobicContact CG-CG1 4.44Å; L181-V219 HydrophobicContact CD1-CB 3.68Å; L181-V219 HydrophobicContact CD1-CG1 4.26Å; W200-V219 HydrophobicContact CE3-CG2 4.03Å; W200-V219 HydrophobicContact CH2-CG1 4.19Å; W200-V219 HydrophobicContact CH2-CG2 4.06Å; W200-V219 HydrophobicContact CZ3-CB 4.5Å; W200-V219 HydrophobicContact CZ3-CG1 4.33Å; W200-V219 HydrophobicContact CZ3-CG2 3.4Å; A216-V219 WeakPolarHBondContact O-CG2 3.46Å; A216-V219 PolarHBondContact O-N 3.24Å; A217-V219 VanDerWaalsContact C-N 3.32Å; A217-V219 PolarHBondContact O-N 3.35Å; V219-K221 PolarHBondContact O-N 2.78Å; V219-E222 WeakPolarHBondContact O-CB 3.25Å; V219-E222 PolarHBondContact O-N 3.47Å
220	V	93.4	Very high	93.3	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-28.3	-176.3	-70.7	0	0	0	0	113.6	A216 E222 L223 L245 I246 Q250	A216-V220 HydrophobicContact CB-CG1 3.73Å; A216-V220 WeakPolarHBondContact O-CG1 3.33Å; A216-V220 WeakPolarHBondContact O-CG2 3.49Å; A216-V220 PolarHBondContact O-N 3.5Å; V220-E222 PolarHBondContact O-N 3.46Å; V220-L223 HydrophobicContact CB-CD1 4.46Å; V220-L223 HydrophobicContact CG1-CD1 4.33Å; V220-L223 WeakPolarHBondContact O-CB 3.43Å; V220-L223 PolarHBondContact O-N 3.02Å; V220-L245 HydrophobicContact CG1-CG 4.32Å; V220-I246 HydrophobicContact CB-CG1 4.36Å; V220-I246 HydrophobicContact CG1-CG1 4.02Å; V220-Q250 PolarHBondContact O-OE1 3.42Å
221	K	90.9	Very high	93.4	Very high	145 Å²	145	35.3 Å²	35.3	63%	0.63	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.5	177.2	-66.1	-178.7	180	-179.1	0	113.4	V219	V219-K221 PolarHBondContact O-N 2.78Å
222	E	93.9	Very high	93.5	Very high	45 Å²	45	34.3 Å²	34.3	21%	0.21	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.3	179.9	-52.7	-67	174.2	0	0	112.1	L178 L181 R182 V219 V220 R274	L178-E222 HydrophobicContact CD2-CG 3.59Å; L181-E222 HydrophobicContact CB-CB 3.61Å; L181-E222 HydrophobicContact CB-CG 4.33Å; L181-E222 HydrophobicContact CD1-CB 4.36Å; R182-E222 HydrophobicContact CG-CG 4.37Å; R182-E222 VanDerWaalsContact CG-OE2 3.25Å; R182-E222 WeakPolarHBondContact CG-OE2 3.47Å; R182-E222 IonicContact CZ-OE1 3.17Å; R182-E222 VanDerWaalsContact CZ-OE1 3.3Å; R182-E222 IonicContact NE-OE1 3.36Å; R182-E222 PolarHBondContact NE-OE1 3.07Å; R182-E222 IonicContact NE-OE2 3.53Å; R182-E222 IonicContact NH2-OE1 3.05Å; R182-E222 PolarHBondContact NH2-OE1 3.39Å; V219-E222 WeakPolarHBondContact O-CB 3.25Å; V219-E222 PolarHBondContact O-N 3.47Å; V220-E222 PolarHBondContact O-N 3.46Å; E222-R274 PolarHBondContact O-NH2 2.98Å; E222-R274 VanDerWaalsContact O-NH2 3.11Å
223	L	94.1	Very high	93.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	20%	0.197	C	C	.	.	S	Bend	trans	-78.6	132.5	175.5	-59.9	174.6	0	0	0	110.2	L181 L193 V194 A197 V220 L225 I246	L181-L223 HydrophobicContact CD2-CD2 4.3Å; L193-L223 HydrophobicContact CB-CD2 4.44Å; V194-L223 HydrophobicContact CG2-CB 4.44Å; V194-L223 HydrophobicContact CG2-CD1 4.19Å; V194-L223 HydrophobicContact CG2-CD2 4.4Å; A197-L223 HydrophobicContact CB-CD1 4.15Å; A197-L223 HydrophobicContact CB-CD2 4.19Å; V220-L223 HydrophobicContact CB-CD1 4.46Å; V220-L223 HydrophobicContact CG1-CD1 4.33Å; V220-L223 WeakPolarHBondContact O-CB 3.43Å; V220-L223 PolarHBondContact O-N 3.02Å; L223-L225 HydrophobicContact CB-CD2 3.96Å; L223-L225 HydrophobicContact CB-CG 4.49Å; L223-L225 PolarHBondContact O-N 3.31Å; L223-I246 HydrophobicContact CD1-CD1 4.37Å
224	R	92.7	Very high	93.6	Very high	12 Å²	12	34 Å²	34	5%	0.045	20%	0.2	C	C	.	.			trans	-98.6	66	-169.9	-48.7	-177.3	-172.5	174.5	-2.4	110.5	R182 D184 E190 A226 L227 P270 R272	R182-R224 PolarHBondContact O-NH2 2.95Å; D184-R224 IonicContact OD1-CZ 3.14Å; D184-R224 IonicContact OD1-NH1 2.83Å; D184-R224 PolarHBondContact OD1-NH1 2.84Å; D184-R224 IonicContact OD1-NH2 3.94Å; D184-R224 PolarHBondContact OD1-NH2 3.19Å; E190-R224 VanDerWaalsContact CD-CB 3.49Å; E190-R224 HydrophobicContact CG-CB 3.97Å; E190-R224 WeakPolarHBondContact OE1-CD 3.37Å; E190-R224 IonicContact OE1-NE 3.21Å; E190-R224 PolarHBondContact OE2-N 3.01Å; R224-A226 PolarHBondContact O-N 2.87Å; R224-A226 VanDerWaalsContact O-N 3.12Å; R224-L227 HydrophobicContact CB-CD1 3.76Å; R224-L227 HydrophobicContact CB-CG 4.12Å; R224-L227 WeakPolarHBondContact O-CB 3.39Å; R224-L227 PolarHBondContact O-N 2.84Å; R224-P270 WeakPolarHBondContact CB-O 3.31Å; R224-P270 HydrophobicContact CG-CB 4.1Å; R224-P270 HydrophobicContact CG-CG 4.12Å; R224-R272 WeakPolarHBondContact CD-O 3.41Å; R224-R272 PolarHBondContact NH1-O 3.41Å
225	L	93.5	Very high	93.7	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.037	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-58.7	-29.6	-170.1	-54.6	-176.4	0	0	0	113.6	V194 L223 L227 L228 L233 L236 I246 Q250 I251 A254	V194-L225 HydrophobicContact CG2-CD2 3.78Å; L223-L225 HydrophobicContact CB-CD2 3.96Å; L223-L225 HydrophobicContact CB-CG 4.49Å; L223-L225 PolarHBondContact O-N 3.31Å; L225-L227 PolarHBondContact O-N 3.24Å; L225-L228 HydrophobicContact CD2-CD1 4.16Å; L225-L228 WeakPolarHBondContact O-CB 3.44Å; L225-L228 WeakPolarHBondContact O-CG 3.43Å; L225-L228 PolarHBondContact O-N 3.01Å; L225-L228 VanDerWaalsContact O-N 3.11Å; L225-L233 HydrophobicContact CB-CD1 4.43Å; L225-L236 HydrophobicContact CD1-CD2 4.43Å; L225-L236 HydrophobicContact CD2-CD2 3.76Å; L225-I246 HydrophobicContact CD1-CD1 4.11Å; L225-I246 HydrophobicContact CD1-CG2 3.81Å; L225-I246 HydrophobicContact CD2-CD1 4.06Å; L225-Q250 HydrophobicContact CD1-CB 4.2Å; L225-I251 HydrophobicContact CD1-CG1 4.36Å; L225-A254 HydrophobicContact CB-CB 3.74Å
226	A	90.9	Very high	93.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-61.9	-21.7	175.5	0	0	0	0	0	113.3	R224 L228 C257 H282 L286	R224-A226 PolarHBondContact O-N 2.87Å; R224-A226 VanDerWaalsContact O-N 3.12Å; A226-L228 VanDerWaalsContact C-N 3.34Å; A226-C257 HydrophobicContact CB-CB 3.95Å; A226-H282 PolarHBondContact O-NE2 3.33Å; A226-L286 HydrophobicContact CB-CD1 4.23Å; A226-L286 WeakPolarHBondContact O-CD1 3.39Å
227	L	91.8	Very high	93.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-82.5	-10.5	177.8	-62.6	179.1	0	0	0	113.4	E190 R224 L225 R272 R273 T277 R280 H283 L286	E190-L227 HydrophobicContact CG-CB 3.98Å; E190-L227 HydrophobicContact CG-CD1 4.03Å; R224-L227 HydrophobicContact CB-CD1 3.76Å; R224-L227 HydrophobicContact CB-CG 4.12Å; R224-L227 WeakPolarHBondContact O-CB 3.39Å; R224-L227 PolarHBondContact O-N 2.84Å; L225-L227 PolarHBondContact O-N 3.24Å; L227-R272 WeakPolarHBondContact CD1-O 3.41Å; L227-R273 HydrophobicContact CD1-CB 4.5Å; L227-R273 HydrophobicContact CD1-CG 4.12Å; L227-R273 HydrophobicContact CD2-CG 3.79Å; L227-T277 HydrophobicContact CB-CG2 4.43Å; L227-T277 HydrophobicContact CD1-CG2 4.31Å; L227-R280 VanDerWaalsContact O-CD 3.28Å; L227-R280 WeakPolarHBondContact O-CD 3.37Å; L227-R280 PolarHBondContact O-NE 3.13Å; L227-R280 PolarHBondContact O-NH1 3.27Å; L227-H283 PolarHBondContact O-NE2 2.87Å; L227-L286 HydrophobicContact CD2-CD1 4.41Å
228	L	93.9	Very high	93.8	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	21%	0.21	C	C	.	.	S	Bend	trans	-66.5	154.1	173.7	-61.5	175	0	0	0	110.7	E190 A191 L225 A226 E232 L233 L236 H258 H282	E190-L228 HydrophobicContact CB-CD2 3.9Å; A191-L228 HydrophobicContact CB-CD2 3.82Å; L225-L228 HydrophobicContact CD2-CD1 4.16Å; L225-L228 WeakPolarHBondContact O-CB 3.44Å; L225-L228 WeakPolarHBondContact O-CG 3.43Å; L225-L228 PolarHBondContact O-N 3.01Å; L225-L228 VanDerWaalsContact O-N 3.11Å; A226-L228 VanDerWaalsContact C-N 3.34Å; L228-E232 HydrophobicContact CB-CB 4.12Å; L228-E232 HydrophobicContact CD2-CB 4.48Å; L228-L233 HydrophobicContact CB-CB 4.39Å; L228-L233 HydrophobicContact CD1-CD1 4.23Å; L228-L236 HydrophobicContact CD1-CD2 3.7Å; L228-H258 PolarHBondContact O-CE1 3Å; L228-H258 PolarHBondContact O-NE2 3.36Å; L228-H282 PolarHBondContact O-CE1 3.09Å; L228-H282 PolarHBondContact O-NE2 3.01Å
229	A	93.3	Very high	93.8	Very high	23 Å²	23	37.7 Å²	37.7	19%	0.19	21%	0.211	C	C	.	.			trans	-71.1	154.5	168.7	0	0	0	0	0	109.6	A231 E232 L233	A229-A231 PolarHBondContact O-N 3.26Å; A229-A231 VanDerWaalsContact O-N 3.17Å; A229-E232 HydrophobicContact CB-CB 4.39Å; A229-E232 HydrophobicContact CB-CG 4.05Å; A229-E232 VanDerWaalsContact CB-OE2 3.22Å; A229-E232 WeakPolarHBondContact CB-OE2 3.5Å; A229-E232 PolarHBondContact N-OE2 2.64Å; A229-E232 WeakPolarHBondContact O-CA 3.49Å; A229-E232 WeakPolarHBondContact O-CB 3.41Å; A229-E232 PolarHBondContact O-N 2.87Å; A229-L233 PolarHBondContact O-N 3.25Å
230	P	92.8	Very high	93.8	Very high	62 Å²	62	38.5 Å²	38.5	40%	0.403	22%	0.215	S	C	.	.	H	α-helix	trans	-52.5	-41.1	177.2	-28.5	35.7	0	0	0	113.5	E232 L233 S234 W255	P230-E232 PolarHBondContact O-N 3.25Å; P230-L233 PolarHBondContact O-N 3.16Å; P230-S234 WeakPolarHBondContact O-CB 3.38Å; P230-S234 PolarHBondContact O-N 2.86Å; P230-S234 PolarHBondContact O-OG 3.28Å; P230-S234 VanDerWaalsContact O-OG 3.1Å; P230-W255 HydrophobicContact CB-CH2 4.18Å; P230-W255 HydrophobicContact CB-CZ3 4.16Å; P230-W255 WeakPolarHBondContact O-CH2 3.48Å
231	A	94.6	Very high	93.8	Very high	76 Å²	76	45.6 Å²	45.6	63%	0.628	24%	0.242	S	C	*	.	H	α-helix	trans	-65.2	-38	176.8	0	0	0	0	0	112.8	A229 A235	A229-A231 PolarHBondContact O-N 3.26Å; A229-A231 VanDerWaalsContact O-N 3.17Å; A231-A235 WeakPolarHBondContact O-CB 3.24Å; A231-A235 PolarHBondContact O-N 3.23Å
232	E	95.3	Very high	93.8	Very high	65 Å²	65	45.8 Å²	45.8	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-70.4	-38.9	177.2	-63.9	170.7	138	0	0	111.2	L228 A229 P230 A235 L236 R280	L228-E232 HydrophobicContact CB-CB 4.12Å; L228-E232 HydrophobicContact CD2-CB 4.48Å; A229-E232 HydrophobicContact CB-CB 4.39Å; A229-E232 HydrophobicContact CB-CG 4.05Å; A229-E232 VanDerWaalsContact CB-OE2 3.22Å; A229-E232 WeakPolarHBondContact CB-OE2 3.5Å; A229-E232 PolarHBondContact N-OE2 2.64Å; A229-E232 WeakPolarHBondContact O-CA 3.49Å; A229-E232 WeakPolarHBondContact O-CB 3.41Å; A229-E232 PolarHBondContact O-N 2.87Å; P230-E232 PolarHBondContact O-N 3.25Å; E232-A235 PolarHBondContact O-N 3.4Å; E232-L236 VanDerWaalsContact O-CB 3.32Å; E232-L236 WeakPolarHBondContact O-CB 3.35Å; E232-L236 PolarHBondContact O-N 2.83Å; E232-R280 IonicContact OE1-NH2 3.24Å; E232-R280 PolarHBondContact OE1-NH2 3.17Å; E232-R280 IonicContact OE2-CZ 3.3Å; E232-R280 VanDerWaalsContact OE2-CZ 3.3Å; E232-R280 IonicContact OE2-NE 3.02Å; E232-R280 PolarHBondContact OE2-NE 2.88Å; E232-R280 IonicContact OE2-NH2 2.73Å; E232-R280 PolarHBondContact OE2-NH2 3.23Å
233	L	94.4	Very high	93.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.4	-40.7	176.4	-171.1	61.8	0	0	0	111.6	L225 L228 A229 P230 L236 E237 I251 A254 W255	L225-L233 HydrophobicContact CB-CD1 4.43Å; L228-L233 HydrophobicContact CB-CB 4.39Å; L228-L233 HydrophobicContact CD1-CD1 4.23Å; A229-L233 PolarHBondContact O-N 3.25Å; P230-L233 PolarHBondContact O-N 3.16Å; L233-L236 HydrophobicContact CD1-CD2 4.3Å; L233-L236 WeakPolarHBondContact O-CB 3.4Å; L233-L236 PolarHBondContact O-N 3.34Å; L233-E237 WeakPolarHBondContact O-CB 3.43Å; L233-E237 PolarHBondContact O-N 3.48Å; L233-I251 HydrophobicContact CD1-CG2 4.24Å; L233-A254 HydrophobicContact CD1-CB 3.99Å; L233-A254 HydrophobicContact CD2-CB 3.85Å; L233-W255 HydrophobicContact CB-CH2 4.27Å; L233-W255 HydrophobicContact CB-CZ2 3.99Å; L233-W255 HydrophobicContact CD2-CD2 3.48Å; L233-W255 VanDerWaalsContact CD2-CD2 3.48Å; L233-W255 HydrophobicContact CD2-CE3 3.85Å; L233-W255 HydrophobicContact CD2-CG 3.83Å; L233-W255 HydrophobicContact CD2-CH2 4.27Å; L233-W255 HydrophobicContact CD2-CZ2 3.96Å; L233-W255 HydrophobicContact CD2-CZ3 4.22Å; L233-W255 HydrophobicContact CG-CD2 4.18Å; L233-W255 HydrophobicContact CG-CH2 4.44Å; L233-W255 HydrophobicContact CG-CZ2 3.85Å
234	S	95.4	Very high	93.4	Very high	60 Å²	60	49.6 Å²	49.6	42%	0.42	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-43.6	171.7	-65.1	0	0	0	0	112	P230 L236 E237 E238 W255	P230-S234 WeakPolarHBondContact O-CB 3.38Å; P230-S234 PolarHBondContact O-N 2.86Å; P230-S234 PolarHBondContact O-OG 3.28Å; P230-S234 VanDerWaalsContact O-OG 3.1Å; S234-L236 VanDerWaalsContact C-N 3.34Å; S234-E237 PolarHBondContact O-N 3.26Å; S234-E238 PolarHBondContact O-N 2.71Å; S234-E238 VanDerWaalsContact O-N 3.07Å; S234-W255 WeakPolarHBondContact OG-CH2 3.07Å; S234-W255 WeakPolarHBondContact OG-CZ2 3.33Å
235	A	95.6	Very high	93.4	Very high	47 Å²	47	49.2 Å²	49.2	39%	0.388	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-40.1	176.1	0	0	0	0	0	111.8	A231 E232 E238 Q239	A231-A235 WeakPolarHBondContact O-CB 3.24Å; A231-A235 PolarHBondContact O-N 3.23Å; E232-A235 PolarHBondContact O-N 3.4Å; A235-E238 PolarHBondContact O-N 2.9Å; A235-Q239 VanDerWaalsContact O-CG 3.27Å; A235-Q239 WeakPolarHBondContact O-CG 3.38Å; A235-Q239 PolarHBondContact O-N 2.94Å
236	L	95.7	Very high	93.4	Very high	6 Å²	6	49 Å²	49	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-44.3	174.6	176.1	60.6	0	0	0	111.5	V194 L225 L228 E232 L233 S234 Q239 N240 I246	V194-L236 HydrophobicContact CG1-CD1 3.58Å; V194-L236 HydrophobicContact CG1-CD2 4.26Å; L225-L236 HydrophobicContact CD1-CD2 4.43Å; L225-L236 HydrophobicContact CD2-CD2 3.76Å; L228-L236 HydrophobicContact CD1-CD2 3.7Å; E232-L236 VanDerWaalsContact O-CB 3.32Å; E232-L236 WeakPolarHBondContact O-CB 3.35Å; E232-L236 PolarHBondContact O-N 2.83Å; L233-L236 HydrophobicContact CD1-CD2 4.3Å; L233-L236 WeakPolarHBondContact O-CB 3.4Å; L233-L236 PolarHBondContact O-N 3.34Å; S234-L236 VanDerWaalsContact C-N 3.34Å; L236-Q239 PolarHBondContact O-N 3.37Å; L236-N240 VanDerWaalsContact O-CB 3.25Å; L236-N240 WeakPolarHBondContact O-CB 3.24Å; L236-N240 PolarHBondContact O-N 2.95Å; L236-I246 HydrophobicContact CD1-CD1 4.01Å; L236-I246 HydrophobicContact CD2-CD1 3.94Å; L236-I246 HydrophobicContact CG-CD1 4.36Å
237	E	95.5	Very high	93.5	Very high	59 Å²	59	51.8 Å²	51.8	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-45.8	178.6	-167.9	-171.9	147.1	0	0	111.6	L233 S234 Q239 N240 R241 I251 W255	L233-E237 WeakPolarHBondContact O-CB 3.43Å; L233-E237 PolarHBondContact O-N 3.48Å; S234-E237 PolarHBondContact O-N 3.26Å; E237-Q239 PolarHBondContact O-N 3.39Å; E237-N240 PolarHBondContact O-N 3.15Å; E237-R241 WeakPolarHBondContact O-CG 3.38Å; E237-R241 PolarHBondContact O-N 3.37Å; E237-R241 IonicContact OE1-CZ 3.77Å; E237-R241 IonicContact OE1-NE 2.83Å; E237-R241 IonicContact OE1-NH2 2.86Å; E237-R241 PolarHBondContact OE1-NH2 2.92Å; E237-I251 HydrophobicContact CB-CG2 4.2Å; E237-I251 HydrophobicContact CG-CG2 4.14Å; E237-W255 PolarHBondContact OE2-NE1 3.31Å
238	E	94.8	Very high	93.5	Very high	87 Å²	87	55.1 Å²	55.1	41%	0.407	31%	0.313	S	S	.	.	H	α-helix	trans	-59.2	-47.8	175.6	-174.3	59.7	-135.8	0	0	111.7	S234 A235 N240 R241 Q242	S234-E238 PolarHBondContact O-N 2.71Å; S234-E238 VanDerWaalsContact O-N 3.07Å; A235-E238 PolarHBondContact O-N 2.9Å; E238-N240 VanDerWaalsContact C-N 3.27Å; E238-N240 PolarHBondContact O-N 3.49Å; E238-R241 PolarHBondContact O-N 3.02Å; E238-R241 IonicContact OE2-CZ 3.65Å; E238-R241 IonicContact OE2-NH1 2.65Å; E238-R241 PolarHBondContact OE2-NH1 3.17Å; E238-Q242 PolarHBondContact O-N 3.17Å
239	Q	92.8	Very high	93.4	Very high	89 Å²	89	62.7 Å²	62.7	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-37.3	176	-71.7	172.4	14.5	0	0	112.1	A235 L236 E237 R241 Q242 E243	A235-Q239 VanDerWaalsContact O-CG 3.27Å; A235-Q239 WeakPolarHBondContact O-CG 3.38Å; A235-Q239 PolarHBondContact O-N 2.94Å; L236-Q239 PolarHBondContact O-N 3.37Å; E237-Q239 PolarHBondContact O-N 3.39Å; Q239-R241 VanDerWaalsContact C-N 3.33Å; Q239-R241 PolarHBondContact O-N 3.47Å; Q239-Q242 PolarHBondContact O-N 3Å; Q239-E243 PolarHBondContact O-N 3.29Å
240	N	94.4	Very high	93.2	Very high	16 Å²	16	63.7 Å²	63.7	9%	0.086	35%	0.349	C	S	.	.	H	α-helix	trans	-72.9	-23	-179.7	-161.3	69.1	0	0	0	113.3	L236 E237 E238 E243 P244 L245 I246 I251	L236-N240 VanDerWaalsContact O-CB 3.25Å; L236-N240 WeakPolarHBondContact O-CB 3.24Å; L236-N240 PolarHBondContact O-N 2.95Å; E237-N240 PolarHBondContact O-N 3.15Å; E238-N240 VanDerWaalsContact C-N 3.27Å; E238-N240 PolarHBondContact O-N 3.49Å; N240-E243 CarbonylContact O-C 3.43Å; N240-P244 WeakPolarHBondContact O-CA 3.49Å; N240-L245 PolarHBondContact OD1-N 3.49Å; N240-I246 PolarHBondContact ND2-O 2.86Å; N240-I246 PolarHBondContact OD1-N 3.28Å; N240-I246 PolarHBondContact OD1-O 3.3Å; N240-I251 HydrophobicContact CB-CD1 3.96Å
241	R	92.9	Very high	93.2	Very high	150 Å²	150	61 Å²	61	57%	0.566	33%	0.332	S	S	*	.	H	α-helix	trans	-70.4	-33.8	169.3	-66.9	-175.8	-147.7	131	8	112.1	E237 E238 Q239	E237-R241 WeakPolarHBondContact O-CG 3.38Å; E237-R241 PolarHBondContact O-N 3.37Å; E237-R241 IonicContact OE1-CZ 3.77Å; E237-R241 IonicContact OE1-NE 2.83Å; E237-R241 IonicContact OE1-NH2 2.86Å; E237-R241 PolarHBondContact OE1-NH2 2.92Å; E238-R241 PolarHBondContact O-N 3.02Å; E238-R241 IonicContact OE2-CZ 3.65Å; E238-R241 IonicContact OE2-NH1 2.65Å; E238-R241 PolarHBondContact OE2-NH1 3.17Å; Q239-R241 VanDerWaalsContact C-N 3.33Å; Q239-R241 PolarHBondContact O-N 3.47Å
242	Q	91.1	Very high	93.1	Very high	149 Å²	149	61 Å²	61	70%	0.696	32%	0.323	S	S	*	.	H	α-helix	trans	-78.2	-44.4	179	-62.3	177	10.1	0	0	111.8	E238 Q239	E238-Q242 PolarHBondContact O-N 3.17Å; Q239-Q242 PolarHBondContact O-N 3Å
243	E	89.3	Confident	92.8	Very high	48 Å²	48	59.5 Å²	59.5	22%	0.224	32%	0.316	C	S	.	.	S	Bend	trans	-134.6	97.7	178.4	-176.1	-168.3	-124.2	0	0	109.4	R198 R202 Q239 N240 L245	R198-E243 IonicContact CZ-OE2 3.68Å; R198-E243 PolarHBondContact NH1-O 3.31Å; R198-E243 IonicContact NH1-OE2 3.8Å; R198-E243 PolarHBondContact NH1-OE2 2.88Å; R202-E243 IonicContact CZ-OE1 2.75Å; R202-E243 IonicContact CZ-OE2 2.9Å; R202-E243 VanDerWaalsContact CZ-OE2 3.24Å; R202-E243 VanDerWaalsContact NE-CD 3.31Å; R202-E243 IonicContact NE-OE1 3.43Å; R202-E243 PolarHBondContact NE-OE1 3.49Å; R202-E243 IonicContact NE-OE2 2.71Å; R202-E243 PolarHBondContact NE-OE2 2.99Å; R202-E243 IonicContact NH2-OE1 3.53Å; R202-E243 PolarHBondContact NH2-OE1 3.34Å; R202-E243 IonicContact NH2-OE2 3.24Å; R202-E243 PolarHBondContact NH2-OE2 2.92Å; Q239-E243 PolarHBondContact O-N 3.29Å; N240-E243 CarbonylContact O-C 3.43Å; E243-L245 PolarHBondContact O-N 3.46Å; E243-L245 VanDerWaalsContact O-N 3.13Å
244	P	90.9	Very high	92.6	Very high	81 Å²	81	59.5 Å²	59.5	53%	0.526	32%	0.316	S	S	.	.			trans	-59.9	116.8	-179.8	-24.8	34.6	0	0	0	111.4	N240	N240-P244 WeakPolarHBondContact O-CA 3.49Å
245	L	92.4	Very high	92.4	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.021	31%	0.31	C	S	.	.			trans	-121.7	-48.5	176.2	179.7	79.2	0	0	0	110.1	R198 A201 V212 A216 V220 N240 E243	R198-L245 HydrophobicContact CB-CD2 3.73Å; R198-L245 HydrophobicContact CG-CD2 4.09Å; A201-L245 HydrophobicContact CB-CD1 3.7Å; V212-L245 HydrophobicContact CG1-CD1 3.59Å; A216-L245 HydrophobicContact CB-CD1 3.38Å; A216-L245 HydrophobicContact CB-CG 4.09Å; V220-L245 HydrophobicContact CG1-CG 4.32Å; N240-L245 PolarHBondContact OD1-N 3.49Å; E243-L245 PolarHBondContact O-N 3.46Å; E243-L245 VanDerWaalsContact O-N 3.13Å
246	I	93.8	Very high	92	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.312	C	S	.	.	S	Bend	trans	-107.1	133.2	-172.9	-61.8	171.1	0	0	0	108.7	V194 V220 L223 L225 L236 N240 A248 Q250 I251	V194-I246 HydrophobicContact CG1-CD1 4.45Å; V220-I246 HydrophobicContact CB-CG1 4.36Å; V220-I246 HydrophobicContact CG1-CG1 4.02Å; L223-I246 HydrophobicContact CD1-CD1 4.37Å; L225-I246 HydrophobicContact CD1-CD1 4.11Å; L225-I246 HydrophobicContact CD1-CG2 3.81Å; L225-I246 HydrophobicContact CD2-CD1 4.06Å; L236-I246 HydrophobicContact CD1-CD1 4.01Å; L236-I246 HydrophobicContact CD2-CD1 3.94Å; L236-I246 HydrophobicContact CG-CD1 4.36Å; N240-I246 PolarHBondContact ND2-O 2.86Å; N240-I246 PolarHBondContact OD1-N 3.28Å; N240-I246 PolarHBondContact OD1-O 3.3Å; I246-A248 PolarHBondContact O-N 3.24Å; I246-Q250 HydrophobicContact CG2-CB 3.86Å; I246-I251 HydrophobicContact CB-CD1 4.46Å; I246-I251 HydrophobicContact CB-CG1 4.5Å; I246-I251 HydrophobicContact CG2-CD1 4.38Å; I246-I251 HydrophobicContact CG2-CG1 3.91Å
247	P	92.9	Very high	91.5	Very high	58 Å²	58	62.4 Å²	62.4	38%	0.377	31%	0.31	S	S	.	.			trans	-56.9	134.4	172.7	-25.4	34.7	0	0	0	111.8	E249 Q250	P247-E249 PolarHBondContact O-N 3.25Å; P247-E249 VanDerWaalsContact O-N 3.09Å; P247-Q250 HydrophobicContact CB-CG 4.44Å; P247-Q250 WeakPolarHBondContact O-CB 3.45Å; P247-Q250 PolarHBondContact O-N 3.46Å
248	A	91.6	Very high	90.9	Very high	70 Å²	70	60.9 Å²	60.9	58%	0.579	30%	0.303	S	S	*	.	H	α-helix	trans	-54.9	-33.5	-177.8	0	0	0	0	0	112.8	I246 Q250 I251 V252	I246-A248 PolarHBondContact O-N 3.24Å; A248-Q250 VanDerWaalsContact C-N 3.28Å; A248-Q250 PolarHBondContact O-N 3.31Å; A248-I251 PolarHBondContact O-N 2.8Å; A248-V252 WeakPolarHBondContact O-CG2 3.25Å; A248-V252 PolarHBondContact O-N 2.7Å
249	E	91.1	Very high	90.5	Very high	163 Å²	163	60.7 Å²	60.7	76%	0.762	32%	0.317	S	S	*	.	H	α-helix	trans	-56.1	-38.5	175.5	-62.3	179.6	179.5	0	0	113.1	P247 V252 E253	P247-E249 PolarHBondContact O-N 3.25Å; P247-E249 VanDerWaalsContact O-N 3.09Å; E249-V252 PolarHBondContact O-N 3.06Å; E249-E253 WeakPolarHBondContact O-CB 3.36Å; E249-E253 PolarHBondContact O-N 2.84Å
250	Q	90.9	Very high	89.9	Confident	44 Å²	44	61.2 Å²	61.2	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-70.9	-37	179.4	-65.1	-178.9	22.9	0	0	111.9	V220 L225 I246 P247 A248 E253 A254	V220-Q250 PolarHBondContact O-OE1 3.42Å; L225-Q250 HydrophobicContact CD1-CB 4.2Å; I246-Q250 HydrophobicContact CG2-CB 3.86Å; P247-Q250 HydrophobicContact CB-CG 4.44Å; P247-Q250 WeakPolarHBondContact O-CB 3.45Å; P247-Q250 PolarHBondContact O-N 3.46Å; A248-Q250 VanDerWaalsContact C-N 3.28Å; A248-Q250 PolarHBondContact O-N 3.31Å; Q250-E253 PolarHBondContact O-N 3.46Å; Q250-A254 PolarHBondContact O-N 3.43Å; Q250-A254 VanDerWaalsContact O-N 3.08Å
251	I	92.8	Very high	88.8	Confident	6 Å²	6	67.3 Å²	67.3	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-68.3	-42.7	175.9	-57.8	177.3	0	0	0	109.9	L225 L233 E237 N240 I246 A248 E253 A254 W255	L225-I251 HydrophobicContact CD1-CG1 4.36Å; L233-I251 HydrophobicContact CD1-CG2 4.24Å; E237-I251 HydrophobicContact CB-CG2 4.2Å; E237-I251 HydrophobicContact CG-CG2 4.14Å; N240-I251 HydrophobicContact CB-CD1 3.96Å; I246-I251 HydrophobicContact CB-CD1 4.46Å; I246-I251 HydrophobicContact CB-CG1 4.5Å; I246-I251 HydrophobicContact CG2-CD1 4.38Å; I246-I251 HydrophobicContact CG2-CG1 3.91Å; A248-I251 PolarHBondContact O-N 2.8Å; I251-E253 VanDerWaalsContact C-N 3.32Å; I251-E253 PolarHBondContact O-N 3.29Å; I251-A254 WeakPolarHBondContact O-CB 3.41Å; I251-A254 PolarHBondContact O-N 3.29Å; I251-W255 PolarHBondContact O-N 2.59Å
252	V	90.9	Very high	87.4	Confident	74 Å²	74	66.6 Å²	66.6	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-42.2	175.4	169.2	0	0	0	0	111	A248 E249 W255 K256	A248-V252 WeakPolarHBondContact O-CG2 3.25Å; A248-V252 PolarHBondContact O-N 2.7Å; E249-V252 PolarHBondContact O-N 3.06Å; V252-W255 PolarHBondContact O-N 2.98Å; V252-K256 WeakPolarHBondContact O-CG 3.4Å; V252-K256 PolarHBondContact O-N 3.33Å
253	E	88.8	Confident	85.8	Confident	34 Å²	34	59.8 Å²	59.8	16%	0.159	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-40.3	177.5	-162.5	57.5	-141.3	0	0	112	E249 Q250 I251 W255 K256 C257 A269	E249-E253 WeakPolarHBondContact O-CB 3.36Å; E249-E253 PolarHBondContact O-N 2.84Å; Q250-E253 PolarHBondContact O-N 3.46Å; I251-E253 VanDerWaalsContact C-N 3.32Å; I251-E253 PolarHBondContact O-N 3.29Å; E253-W255 VanDerWaalsContact C-N 3.34Å; E253-W255 PolarHBondContact O-N 3.13Å; E253-K256 WeakPolarHBondContact O-CB 3.5Å; E253-K256 PolarHBondContact O-N 3.35Å; E253-K256 VanDerWaalsContact O-N 3.16Å; E253-K256 WeakPolarHBondContact OE2-CD 3.48Å; E253-K256 IonicContact OE2-NZ 2.68Å; E253-K256 PolarHBondContact OE2-NZ 3.29Å; E253-C257 PolarHBondContact O-N 3.19Å; E253-C257 PolarHBondContact O-SG 3.49Å; E253-C257 VanDerWaalsContact O-SG 3.37Å; E253-A269 HydrophobicContact CG-CB 3.98Å
254	A	90	Very high	84.1	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-58.1	-46.2	172.5	0	0	0	0	0	111.6	L225 L233 Q250 I251 K256 C257 H258	L225-A254 HydrophobicContact CB-CB 3.74Å; L233-A254 HydrophobicContact CD1-CB 3.99Å; L233-A254 HydrophobicContact CD2-CB 3.85Å; Q250-A254 PolarHBondContact O-N 3.43Å; Q250-A254 VanDerWaalsContact O-N 3.08Å; I251-A254 WeakPolarHBondContact O-CB 3.41Å; I251-A254 PolarHBondContact O-N 3.29Å; A254-K256 VanDerWaalsContact C-N 3.32Å; A254-K256 PolarHBondContact O-N 2.91Å; A254-C257 WeakPolarHBondContact O-CB 3.21Å; A254-C257 PolarHBondContact O-N 3.32Å; A254-C257 VanDerWaalsContact O-N 3.15Å; A254-H258 PolarHBondContact O-CD2 3.47Å; A254-H258 PolarHBondContact O-N 2.83Å
255	W	91.2	Very high	82.2	Confident	77 Å²	77	65 Å²	65	29%	0.292	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-37.5	175.5	-81.2	124.2	0	0	0	113.3	P230 L233 S234 E237 I251 V252 E253 C257 H258 A259	P230-W255 HydrophobicContact CB-CH2 4.18Å; P230-W255 HydrophobicContact CB-CZ3 4.16Å; P230-W255 WeakPolarHBondContact O-CH2 3.48Å; L233-W255 HydrophobicContact CB-CH2 4.27Å; L233-W255 HydrophobicContact CB-CZ2 3.99Å; L233-W255 HydrophobicContact CD2-CD2 3.48Å; L233-W255 VanDerWaalsContact CD2-CD2 3.48Å; L233-W255 HydrophobicContact CD2-CE3 3.85Å; L233-W255 HydrophobicContact CD2-CG 3.83Å; L233-W255 HydrophobicContact CD2-CH2 4.27Å; L233-W255 HydrophobicContact CD2-CZ2 3.96Å; L233-W255 HydrophobicContact CD2-CZ3 4.22Å; L233-W255 HydrophobicContact CG-CD2 4.18Å; L233-W255 HydrophobicContact CG-CH2 4.44Å; L233-W255 HydrophobicContact CG-CZ2 3.85Å; S234-W255 WeakPolarHBondContact OG-CH2 3.07Å; S234-W255 WeakPolarHBondContact OG-CZ2 3.33Å; E237-W255 PolarHBondContact OE2-NE1 3.31Å; I251-W255 PolarHBondContact O-N 2.59Å; V252-W255 PolarHBondContact O-N 2.98Å; E253-W255 VanDerWaalsContact C-N 3.34Å; E253-W255 PolarHBondContact O-N 3.13Å; W255-C257 VanDerWaalsContact C-N 3.35Å; W255-C257 PolarHBondContact O-N 2.63Å; W255-H258 HydrophobicContact CE3-CB 4.4Å; W255-H258 WeakPolarHBondContact O-CB 3.46Å; W255-H258 PolarHBondContact O-N 3.49Å; W255-A259 PolarHBondContact O-N 3.08Å
256	K	88.2	Confident	80.2	Confident	95 Å²	95	65.4 Å²	65.4	41%	0.413	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-42	173.9	-69.8	178.1	-162.2	155.3	0	111.6	V252 E253 A254 H258 A259 L260	V252-K256 WeakPolarHBondContact O-CG 3.4Å; V252-K256 PolarHBondContact O-N 3.33Å; E253-K256 WeakPolarHBondContact O-CB 3.5Å; E253-K256 PolarHBondContact O-N 3.35Å; E253-K256 VanDerWaalsContact O-N 3.16Å; E253-K256 WeakPolarHBondContact OE2-CD 3.48Å; E253-K256 IonicContact OE2-NZ 2.68Å; E253-K256 PolarHBondContact OE2-NZ 3.29Å; A254-K256 VanDerWaalsContact C-N 3.32Å; A254-K256 PolarHBondContact O-N 2.91Å; K256-H258 VanDerWaalsContact C-N 3.29Å; K256-H258 PolarHBondContact O-N 3.02Å; K256-A259 PolarHBondContact O-N 3.28Å; K256-L260 HydrophobicContact CB-CD1 4.36Å; K256-L260 VanDerWaalsContact O-CB 3.31Å; K256-L260 WeakPolarHBondContact O-CB 3.41Å; K256-L260 WeakPolarHBondContact O-CG 3.37Å; K256-L260 PolarHBondContact O-N 3.39Å
257	C	84.1	Confident	78.2	Confident	1 Å²	1	76.5 Å²	76.5	1%	0.007	38%	0.377	C	S	.	.	H	α-helix	trans	-57.8	-42.1	175.5	-65.1	0	0	0	0	111.6	A226 E253 A254 W255 R261 L286	A226-C257 HydrophobicContact CB-CB 3.95Å; E253-C257 PolarHBondContact O-N 3.19Å; E253-C257 PolarHBondContact O-SG 3.49Å; E253-C257 VanDerWaalsContact O-SG 3.37Å; A254-C257 WeakPolarHBondContact O-CB 3.21Å; A254-C257 PolarHBondContact O-N 3.32Å; A254-C257 VanDerWaalsContact O-N 3.15Å; W255-C257 VanDerWaalsContact C-N 3.35Å; W255-C257 PolarHBondContact O-N 2.63Å; C257-R261 PolarHBondContact O-N 3.35Å; C257-R261 VanDerWaalsContact O-N 3.16Å; C257-L286 HydrophobicContact CB-CD2 3.77Å
258	H	84.1	Confident	76.6	Confident	28 Å²	28	77.3 Å²	77.3	13%	0.13	40%	0.396	C	S	.	.	H	α-helix	trans	-63.9	-44.1	174.9	-77.4	-87.1	0	0	0	113.1	L228 A254 W255 K256 H282	L228-H258 PolarHBondContact O-CE1 3Å; L228-H258 PolarHBondContact O-NE2 3.36Å; A254-H258 PolarHBondContact O-CD2 3.47Å; A254-H258 PolarHBondContact O-N 2.83Å; W255-H258 HydrophobicContact CE3-CB 4.4Å; W255-H258 WeakPolarHBondContact O-CB 3.46Å; W255-H258 PolarHBondContact O-N 3.49Å; K256-H258 VanDerWaalsContact C-N 3.29Å; K256-H258 PolarHBondContact O-N 3.02Å; H258-H282 AromaticContact CE1-CD2 3.28Å; H258-H282 PolarHBondContact CE1-CD2 2.96Å; H258-H282 AromaticContact CE1-CE1 3.58Å; H258-H282 AromaticContact CE1-CG 3.88Å; H258-H282 AromaticContact CE1-NE2 3.07Å; H258-H282 PolarHBondContact CE1-NE2 2.88Å; H258-H282 AromaticContact ND1-CD2 3.45Å; H258-H282 PolarHBondContact ND1-CD2 2.85Å; H258-H282 AromaticContact ND1-CG 3.85Å; H258-H282 AromaticContact ND1-NE2 3.75Å; H258-H282 AromaticContact NE2-NE2 3.81Å
259	A	85.6	Confident	75.3	Confident	83 Å²	83	75 Å²	75	69%	0.686	38%	0.376	S	S	*	.	H	α-helix	trans	-71.4	-43	-177.2	0	0	0	0	0	112.6	W255 K256	W255-A259 PolarHBondContact O-N 3.08Å; K256-A259 PolarHBondContact O-N 3.28Å
260	L	81.1	Confident	74.3	Confident	99 Å²	99	69.8 Å²	69.8	52%	0.518	36%	0.357	S	S	.	.	H	α-helix	trans	-80.6	-18.9	-174.9	-65.1	173.8	0	0	0	113.2	K256 R262 A266	K256-L260 HydrophobicContact CB-CD1 4.36Å; K256-L260 VanDerWaalsContact O-CB 3.31Å; K256-L260 WeakPolarHBondContact O-CB 3.41Å; K256-L260 WeakPolarHBondContact O-CG 3.37Å; K256-L260 PolarHBondContact O-N 3.39Å; L260-R262 HydrophobicContact CB-CB 4.38Å; L260-R262 PolarHBondContact O-N 3.11Å; L260-A266 HydrophobicContact CD1-CB 4.12Å
261	R	72	Confident	73.6	Confident	144 Å²	144	68 Å²	68	54%	0.543	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	42.6	-173.5	-61	-177.5	-176.3	-119.6	-0.2	111.6	C257 F285	C257-R261 PolarHBondContact O-N 3.35Å; C257-R261 VanDerWaalsContact O-N 3.16Å; R261-F285 HydrophobicContact CB-CB 3.78Å; R261-F285 HydrophobicContact CB-CD1 4.06Å; R261-F285 HydrophobicContact CB-CD2 4.21Å; R261-F285 HydrophobicContact CB-CG 3.76Å; R261-F285 HydrophobicContact CG-CB 4.47Å; R261-F285 HydrophobicContact CG-CD2 4.07Å; R261-F285 HydrophobicContact CG-CE2 4.49Å; R261-F285 HydrophobicContact CG-CG 4.13Å
262	R	63.6	Low	73.3	Confident	136 Å²	136	75.2 Å²	75.2	51%	0.513	38%	0.376	S	S	.	.			trans	-131.5	119.2	179.6	-74.3	177.1	-179.9	-146	-8.8	109.2	L260 E265 F285	L260-R262 HydrophobicContact CB-CB 4.38Å; L260-R262 PolarHBondContact O-N 3.11Å; R262-E265 HydrophobicContact CB-CB 4.26Å; R262-E265 WeakPolarHBondContact CD-OE2 3.49Å; R262-E265 IonicContact CZ-OE2 3.85Å; R262-E265 IonicContact NE-OE2 3.74Å; R262-E265 IonicContact NH1-OE2 3.71Å; R262-E265 PolarHBondContact NH1-OE2 3.17Å; R262-E265 IonicContact NH2-OE2 3.82Å; R262-F285 CarbonylContact C-O 3.54Å
263	G	56.9	Low	73.2	Confident	5 Å²	5	75.6 Å²	75.6	5%	0.052	37%	0.369	C	S	.	.	S	Bend	trans	-81.1	-23.1	-170.4	0	0	0	0	0	117	C271 F285 L286	G263-C271 WeakPolarHBondContact O-CB 3.48Å; G263-C271 PolarHBondContact O-SG 3.2Å; G263-F285 WeakPolarHBondContact CA-O 3.4Å; G263-F285 PolarHBondContact N-O 2.84Å; G263-L286 VanDerWaalsContact CA-CA 3.47Å; G263-L286 VanDerWaalsContact CA-O 3.23Å; G263-L286 WeakPolarHBondContact CA-O 3.38Å
264	D	53.3	Low	73.3	Confident	103 Å²	103	74.2 Å²	74.2	55%	0.551	36%	0.363	S	S	*	.	S	Bend	trans	-140.4	-15.1	179.2	-91.9	-36.9	0	0	0	113.7	A266 L288	D264-A266 PolarHBondContact O-N 2.72Å; D264-L288 HydrophobicContact CB-CD1 3.96Å; D264-L288 VanDerWaalsContact OD2-CD1 3.29Å; D264-L288 WeakPolarHBondContact OD2-CD1 3.46Å
265	E	50.5	Low	73.5	Confident	136 Å²	136	82.2 Å²	82.2	64%	0.636	39%	0.393	S	S	*	.	S	Bend	trans	-75.2	-16.4	178	-64.8	-171.9	170.3	0	0	112.6	R262 R267	R262-E265 HydrophobicContact CB-CB 4.26Å; R262-E265 WeakPolarHBondContact CD-OE2 3.49Å; R262-E265 IonicContact CZ-OE2 3.85Å; R262-E265 IonicContact NE-OE2 3.74Å; R262-E265 IonicContact NH1-OE2 3.71Å; R262-E265 PolarHBondContact NH1-OE2 3.17Å; R262-E265 IonicContact NH2-OE2 3.82Å; E265-R267 PolarHBondContact O-N 3.47Å
266	A	50.8	Low	73.5	Confident	13 Å²	13	79.3 Å²	79.3	11%	0.107	39%	0.387	C	S	.	.	S	Bend	trans	-87.6	97.4	165.6	0	0	0	0	0	108.3	L260 D264 G268	L260-A266 HydrophobicContact CD1-CB 4.12Å; D264-A266 PolarHBondContact O-N 2.72Å; A266-G268 PolarHBondContact O-N 3.29Å; A266-G268 VanDerWaalsContact O-N 3.15Å
267	R	51.8	Low	73.7	Confident	236 Å²	236	75.6 Å²	75.6	89%	0.891	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	112.9	-171.9	-65.6	176.9	175.5	-174.3	-2.4	112	E265	E265-R267 PolarHBondContact O-N 3.47Å
268	G	59.7	Low	74.1	Confident	76 Å²	76	80.3 Å²	80.3	78%	0.784	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.1	-7.3	150.9	0	0	0	0	0	118.8	A266	A266-G268 PolarHBondContact O-N 3.29Å; A266-G268 VanDerWaalsContact O-N 3.15Å
269	A	63.1	Low	74.4	Confident	20 Å²	20	84.4 Å²	84.4	17%	0.165	43%	0.426	C	S	.	.			trans	-98.8	134.5	178.5	0	0	0	0	0	112.3	E253 C271	E253-A269 HydrophobicContact CG-CB 3.98Å; A269-C271 PolarHBondContact O-N 3.33Å; A269-C271 VanDerWaalsContact O-N 3.15Å; A269-C271 PolarHBondContact O-SG 3.23Å
270	P	71.6	Confident	74.6	Confident	54 Å²	54	82.2 Å²	82.2	35%	0.351	40%	0.4	S	S	.	.			trans	-70	110.8	174.8	26.7	-31	0	0	0	110.5	R224	R224-P270 WeakPolarHBondContact CB-O 3.31Å; R224-P270 HydrophobicContact CG-CB 4.1Å; R224-P270 HydrophobicContact CG-CG 4.12Å
271	C	76.7	Confident	74.8	Confident	8 Å²	8	85.2 Å²	85.2	5%	0.054	41%	0.411	C	S	.	.			trans	-106.8	-2.1	-176.4	-68.3	0	0	0	0	114.4	G263 A269 R273 L286	G263-C271 WeakPolarHBondContact O-CB 3.48Å; G263-C271 PolarHBondContact O-SG 3.2Å; A269-C271 PolarHBondContact O-N 3.33Å; A269-C271 VanDerWaalsContact O-N 3.15Å; A269-C271 PolarHBondContact O-SG 3.23Å; C271-R273 PolarHBondContact O-N 3.5Å; C271-L286 HydrophobicContact CB-CB 4.43Å
272	R	85.4	Confident	75.4	Confident	157 Å²	157	79.8 Å²	79.8	59%	0.592	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-69.2	131.5	178.9	-171.6	175.2	-175.9	-169.1	7.6	110.3	D184 R224 L227	D184-R272 WeakPolarHBondContact OD1-CD 3.16Å; D184-R272 IonicContact OD1-NE 2.79Å; D184-R272 WeakPolarHBondContact OD2-CD 3.28Å; D184-R272 IonicContact OD2-CZ 3.87Å; D184-R272 IonicContact OD2-NE 2.63Å; D184-R272 PolarHBondContact OD2-NE 2.88Å; D184-R272 IonicContact OD2-NH1 3.3Å; D184-R272 PolarHBondContact OD2-NH1 3.47Å; R224-R272 WeakPolarHBondContact CD-O 3.41Å; R224-R272 PolarHBondContact NH1-O 3.41Å; L227-R272 WeakPolarHBondContact CD1-O 3.41Å
273	R	88.8	Confident	76.5	Confident	81 Å²	81	73.6 Å²	73.6	31%	0.306	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-73.6	145.1	178.7	-69.1	-178.7	-67.3	166.4	2.4	112.4	L227 C271 T277 D287	L227-R273 HydrophobicContact CD1-CB 4.5Å; L227-R273 HydrophobicContact CD1-CG 4.12Å; L227-R273 HydrophobicContact CD2-CG 3.79Å; C271-R273 PolarHBondContact O-N 3.5Å; R273-T277 HydrophobicContact CB-CG2 4.46Å; R273-T277 HydrophobicContact CG-CG2 4.13Å; R273-D287 IonicContact CZ-OD2 3.79Å; R273-D287 VanDerWaalsContact CZ-OD2 3.26Å; R273-D287 IonicContact NE-OD2 3.99Å; R273-D287 PolarHBondContact NE-OD2 3.25Å; R273-D287 IonicContact NH2-OD2 3.26Å; R273-D287 PolarHBondContact NH2-OD2 3.47Å
274	R	92.1	Very high	77.6	Confident	6 Å²	6	81 Å²	81	2%	0.023	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-83.6	160.7	164.8	-59.6	-172.7	-161.4	-94.9	-0.9	109.7	L181 S183 D184 E190 L193 E222 G276 T277	L181-R274 VanDerWaalsContact C-NH1 3.31Å; L181-R274 PolarHBondContact O-NH1 2.73Å; L181-R274 PolarHBondContact O-NH2 3.2Å; S183-R274 PolarHBondContact O-NH1 3.26Å; D184-R274 CarbonylContact O-C 3.5Å; D184-R274 VanDerWaalsContact O-CA 3.24Å; D184-R274 WeakPolarHBondContact O-CA 3.39Å; E190-R274 VanDerWaalsContact OE1-CD 3.31Å; E190-R274 WeakPolarHBondContact OE1-CD 3.26Å; E190-R274 IonicContact OE1-CZ 3.11Å; E190-R274 IonicContact OE1-NE 2.97Å; E190-R274 PolarHBondContact OE1-NE 3.21Å; E190-R274 IonicContact OE1-NH2 3.85Å; L193-R274 VanDerWaalsContact CD1-CD 3.49Å; E222-R274 PolarHBondContact O-NH2 2.98Å; E222-R274 VanDerWaalsContact O-NH2 3.11Å; R274-G276 PolarHBondContact O-N 2.86Å; R274-T277 PolarHBondContact N-OG1 3.39Å; R274-T277 WeakPolarHBondContact O-CB 3.31Å; R274-T277 PolarHBondContact O-N 3.39Å; R274-T277 PolarHBondContact O-OG1 3.4Å; R274-T277 VanDerWaalsContact O-OG1 3.12Å
275	R	92.9	Very high	78.7	Confident	168 Å²	168	78.9 Å²	78.9	63%	0.634	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-39.3	178.3	-176.9	-177.5	-67.5	-169.8	0.5	112.7	D184 K185 L186	D184-R275 PolarHBondContact O-N 3.17Å; K185-R275 WeakPolarHBondContact O-CB 3.24Å; L186-R275 PolarHBondContact O-N 3.45Å
276	G	91.6	Very high	79.8	Confident	16 Å²	16	72.6 Å²	72.6	17%	0.165	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	8.4	-179.8	0	0	0	0	0	115.6	L186 V188 D189 R274 L278	L186-G276 PolarHBondContact O-N 3.29Å; V188-G276 CarbonylContact C-O 3.54Å; V188-G276 CarbonylContact O-C 3.46Å; D189-G276 PolarHBondContact N-O 2.95Å; R274-G276 PolarHBondContact O-N 2.86Å; G276-L278 PolarHBondContact O-N 3.43Å
277	T	93	Very high	80.3	Confident	18 Å²	18	72.9 Å²	72.9	11%	0.11	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-63.3	122.6	177.7	-58.9	0	0	0	0	110.3	L227 R273 R274	L227-T277 HydrophobicContact CB-CG2 4.43Å; L227-T277 HydrophobicContact CD1-CG2 4.31Å; R273-T277 HydrophobicContact CB-CG2 4.46Å; R273-T277 HydrophobicContact CG-CG2 4.13Å; R274-T277 PolarHBondContact N-OG1 3.39Å; R274-T277 WeakPolarHBondContact O-CB 3.31Å; R274-T277 PolarHBondContact O-N 3.39Å; R274-T277 PolarHBondContact O-OG1 3.4Å; R274-T277 VanDerWaalsContact O-OG1 3.12Å
278	L	92.5	Very high	80.4	Confident	99 Å²	99	67.7 Å²	67.7	52%	0.518	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-67.2	134.3	176.8	-64.8	174.3	0	0	0	110	D189 G276 R280 H283	D189-L278 HydrophobicContact CB-CD1 4.21Å; D189-L278 HydrophobicContact CB-CG 4.04Å; D189-L278 WeakPolarHBondContact OD1-CB 3.23Å; D189-L278 PolarHBondContact OD1-N 3.35Å; G276-L278 PolarHBondContact O-N 3.43Å; L278-R280 PolarHBondContact O-N 3.46Å; L278-R280 PolarHBondContact O-NH1 3.41Å; L278-H283 PolarHBondContact O-CE1 3.17Å
279	P	89.4	Confident	79.9	Confident	115 Å²	115	68.3 Å²	68.3	75%	0.747	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-66.3	130.2	-177.3	27.5	-34.1	0	0	0	110.9
280	R	90	Very high	78.7	Confident	36 Å²	36	75.3 Å²	75.3	14%	0.136	36%	0.36	C	S	.	.			trans	-127.9	150.2	174.7	-57.2	172	178.8	79.5	-13.3	110	D189 L227 E232 L278 H282 H283	D189-R280 VanDerWaalsContact CG-NH2 3.33Å; D189-R280 IonicContact OD1-CZ 3.45Å; D189-R280 IonicContact OD1-NH1 2.78Å; D189-R280 PolarHBondContact OD1-NH1 2.96Å; D189-R280 IonicContact OD1-NH2 3.2Å; D189-R280 PolarHBondContact OD1-NH2 3.45Å; D189-R280 IonicContact OD2-CZ 3.73Å; D189-R280 IonicContact OD2-NH1 3.66Å; D189-R280 IonicContact OD2-NH2 2.75Å; D189-R280 PolarHBondContact OD2-NH2 2.88Å; L227-R280 VanDerWaalsContact O-CD 3.28Å; L227-R280 WeakPolarHBondContact O-CD 3.37Å; L227-R280 PolarHBondContact O-NE 3.13Å; L227-R280 PolarHBondContact O-NH1 3.27Å; E232-R280 IonicContact OE1-NH2 3.24Å; E232-R280 PolarHBondContact OE1-NH2 3.17Å; E232-R280 IonicContact OE2-CZ 3.3Å; E232-R280 VanDerWaalsContact OE2-CZ 3.3Å; E232-R280 IonicContact OE2-NE 3.02Å; E232-R280 PolarHBondContact OE2-NE 2.88Å; E232-R280 IonicContact OE2-NH2 2.73Å; E232-R280 PolarHBondContact OE2-NH2 3.23Å; L278-R280 PolarHBondContact O-N 3.46Å; L278-R280 PolarHBondContact O-NH1 3.41Å; R280-H282 PolarHBondContact O-N 3.27Å; R280-H282 VanDerWaalsContact O-N 3.16Å; R280-H283 PolarHBondContact N-ND1 3.49Å; R280-H283 VanDerWaalsContact N-ND1 3.14Å; R280-H283 VanDerWaalsContact O-CB 3.31Å; R280-H283 WeakPolarHBondContact O-CB 3.23Å; R280-H283 PolarHBondContact O-N 2.91Å; R280-H283 VanDerWaalsContact O-N 3.09Å
281	E	85.5	Confident	76.9	Confident	163 Å²	163	85.6 Å²	85.6	76%	0.762	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.5	-172.8	-66.6	-168.1	168.4	0	0	114.5	H283 R284	E281-H283 VanDerWaalsContact C-N 3.34Å; E281-R284 WeakPolarHBondContact O-CG 3.38Å; E281-R284 PolarHBondContact O-NE 2.9Å
282	H	84.2	Confident	76.9	Confident	29 Å²	29	89.5 Å²	89.5	13%	0.134	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-81.3	-14.5	-178.3	67.7	-75.9	0	0	0	112.9	A226 L228 H258 R280 R284 F285 L286	A226-H282 PolarHBondContact O-NE2 3.33Å; L228-H282 PolarHBondContact O-CE1 3.09Å; L228-H282 PolarHBondContact O-NE2 3.01Å; H258-H282 AromaticContact CE1-CD2 3.28Å; H258-H282 PolarHBondContact CE1-CD2 2.96Å; H258-H282 AromaticContact CE1-CE1 3.58Å; H258-H282 AromaticContact CE1-CG 3.88Å; H258-H282 AromaticContact CE1-NE2 3.07Å; H258-H282 PolarHBondContact CE1-NE2 2.88Å; H258-H282 AromaticContact ND1-CD2 3.45Å; H258-H282 PolarHBondContact ND1-CD2 2.85Å; H258-H282 AromaticContact ND1-CG 3.85Å; H258-H282 AromaticContact ND1-NE2 3.75Å; H258-H282 AromaticContact NE2-NE2 3.81Å; R280-H282 PolarHBondContact O-N 3.27Å; R280-H282 VanDerWaalsContact O-N 3.16Å; H282-R284 PolarHBondContact O-N 3.37Å; H282-F285 WeakPolarHBondContact O-CB 3.18Å; H282-F285 WeakPolarHBondContact O-CD2 3.17Å; H282-F285 PolarHBondContact O-N 3.15Å; H282-L286 VanDerWaalsContact CD2-CD1 3.47Å; H282-L286 WeakPolarHBondContact CD2-CD1 3.4Å
283	H	85.9	Confident	76.5	Confident	7 Å²	7	85.9 Å²	85.9	3%	0.032	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-60.2	-28.6	179.9	-67.1	173.6	0	0	0	113.2	L227 L278 R280 E281 F285 L286 D287	L227-H283 PolarHBondContact O-NE2 2.87Å; L278-H283 PolarHBondContact O-CE1 3.17Å; R280-H283 PolarHBondContact N-ND1 3.49Å; R280-H283 VanDerWaalsContact N-ND1 3.14Å; R280-H283 VanDerWaalsContact O-CB 3.31Å; R280-H283 WeakPolarHBondContact O-CB 3.23Å; R280-H283 PolarHBondContact O-N 2.91Å; R280-H283 VanDerWaalsContact O-N 3.09Å; E281-H283 VanDerWaalsContact C-N 3.34Å; H283-F285 PolarHBondContact O-N 3.45Å; H283-L286 PolarHBondContact O-N 2.62Å; H283-D287 PolarHBondContact O-N 3.22Å; H283-D287 VanDerWaalsContact O-N 3.07Å
284	R	80.8	Confident	75.8	Confident	159 Å²	159	86.2 Å²	86.2	60%	0.6	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-58.6	-19.7	174.7	69.8	-174.4	151.7	156.4	-0.5	114	E281 H282	E281-R284 WeakPolarHBondContact O-CG 3.38Å; E281-R284 PolarHBondContact O-NE 2.9Å; H282-R284 PolarHBondContact O-N 3.37Å
285	F	76.8	Confident	74.8	Confident	60 Å²	60	90.9 Å²	90.9	26%	0.263	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-100.5	-9.9	178.6	-51.2	-66.5	0	0	0	112.7	R261 R262 G263 H282 H283	R261-F285 HydrophobicContact CB-CB 3.78Å; R261-F285 HydrophobicContact CB-CD1 4.06Å; R261-F285 HydrophobicContact CB-CD2 4.21Å; R261-F285 HydrophobicContact CB-CG 3.76Å; R261-F285 HydrophobicContact CG-CB 4.47Å; R261-F285 HydrophobicContact CG-CD2 4.07Å; R261-F285 HydrophobicContact CG-CE2 4.49Å; R261-F285 HydrophobicContact CG-CG 4.13Å; R262-F285 CarbonylContact C-O 3.54Å; G263-F285 WeakPolarHBondContact CA-O 3.4Å; G263-F285 PolarHBondContact N-O 2.84Å; H282-F285 WeakPolarHBondContact O-CB 3.18Å; H282-F285 WeakPolarHBondContact O-CD2 3.17Å; H282-F285 PolarHBondContact O-N 3.15Å; H283-F285 PolarHBondContact O-N 3.45Å
286	L	72.6	Confident	73.7	Confident	3 Å²	3	86.1 Å²	86.1	2%	0.016	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-31.7	-174	-63.4	-175.9	0	0	0	113.5	A226 L227 C257 G263 C271 H282 H283	A226-L286 HydrophobicContact CB-CD1 4.23Å; A226-L286 WeakPolarHBondContact O-CD1 3.39Å; L227-L286 HydrophobicContact CD2-CD1 4.41Å; C257-L286 HydrophobicContact CB-CD2 3.77Å; G263-L286 VanDerWaalsContact CA-CA 3.47Å; G263-L286 VanDerWaalsContact CA-O 3.23Å; G263-L286 WeakPolarHBondContact CA-O 3.38Å; C271-L286 HydrophobicContact CB-CB 4.43Å; H282-L286 VanDerWaalsContact CD2-CD1 3.47Å; H282-L286 WeakPolarHBondContact CD2-CD1 3.4Å; H283-L286 PolarHBondContact O-N 2.62Å
287	D	61.8	Low	72.5	Confident	20 Å²	20	90.8 Å²	90.8	11%	0.107	44%	0.441	C	S	.	.			trans	-103.8	109.5	-177	-164	-7.7	0	0	0	109.7	R273 H283 S289	R273-D287 IonicContact CZ-OD2 3.79Å; R273-D287 VanDerWaalsContact CZ-OD2 3.26Å; R273-D287 IonicContact NE-OD2 3.99Å; R273-D287 PolarHBondContact NE-OD2 3.25Å; R273-D287 IonicContact NH2-OD2 3.26Å; R273-D287 PolarHBondContact NH2-OD2 3.47Å; H283-D287 PolarHBondContact O-N 3.22Å; H283-D287 VanDerWaalsContact O-N 3.07Å; D287-S289 PolarHBondContact O-N 3.2Å; D287-S289 VanDerWaalsContact O-N 3.13Å; D287-S289 VanDerWaalsContact OD1-CB 3.25Å; D287-S289 WeakPolarHBondContact OD1-CB 3.27Å; D287-S289 PolarHBondContact OD1-N 3.49Å; D287-S289 PolarHBondContact OD1-OG 2.88Å
288	L	53.1	Low	71.1	Confident	126 Å²	126	96 Å²	96	66%	0.66	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-8.4	176.3	-72.1	179	0	0	0	113.1	D264 F290	D264-L288 HydrophobicContact CB-CD1 3.96Å; D264-L288 VanDerWaalsContact OD2-CD1 3.29Å; D264-L288 WeakPolarHBondContact OD2-CD1 3.46Å; L288-F290 PolarHBondContact O-N 3.41Å
289	S	49.7	Very low	69.4	Low	89 Å²	89	95.8 Å²	95.8	62%	0.622	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	9.5	178.2	-40.3	0	0	0	0	114.1	D287	D287-S289 PolarHBondContact O-N 3.2Å; D287-S289 VanDerWaalsContact O-N 3.13Å; D287-S289 VanDerWaalsContact OD1-CB 3.25Å; D287-S289 WeakPolarHBondContact OD1-CB 3.27Å; D287-S289 PolarHBondContact OD1-N 3.49Å; D287-S289 PolarHBondContact OD1-OG 2.88Å
290	F	38.6	Very low	67.7	Low	167 Å²	167	94.2 Å²	94.2	73%	0.732	44%	0.437	S	S	*	.			trans	-111	62.6	170.5	-111.9	-87.2	0	0	0	110.7	L288	L288-F290 PolarHBondContact O-N 3.41Å
291	K	33.9	Very low	65.7	Low	271 Å²	271	99.5 Å²	99.5	100%	1.178	46%	0.464	S	S	*	.			trans	-142.6	0	150.7	-92	-170.6	-180	177	0	109.2

Retrieved 291 of 291 residues in 136.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).