A0A096NNN1_PAPAN Loading...

Protein NDRG2

Contributes to the regulation of the Wnt signaling pathway. Down-regulates CTNNB1-mediated transcriptional activation of target genes, such as CCND1, and may thereby act as tumor suppressor. May be involved in dendritic cell and neuron differentiation. Contributes to the regulation of the Wnt signaling pathway. Down-regulates CTNNB1-mediated transcriptional activation of target genes. May be involved in neuron differentiation.

AlphaFold DB , UniProt , Accession A0A096NNN1, Species PAPAN (Papio anubis, Olive baboon), Gene NDRG2, Length 371 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	41.1	Very low	42.3	Very low	249 Å²	249	168.3 Å²	168.3	100%	1.227	87%	0.872	S	S	*	*				0	131.7	0	-100.1	-174.1	-98.1	0	0	106.6
2	A	41.4	Very low	42.4	Very low	100 Å²	100	170 Å²	170	83%	0.826	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-62.9	139.6	-157	0	0	0	0	0	115.3
3	E	39.6	Very low	42.5	Very low	198 Å²	198	170.6 Å²	170.6	93%	0.925	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-73.7	131.2	160.7	-74.6	178.7	149	0	0	109.2
4	L	43.7	Very low	42.3	Very low	178 Å²	178	167.1 Å²	167.1	93%	0.932	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-81.1	118.4	176	-77.5	157.7	0	0	0	109.1
5	Q	41.5	Very low	42.5	Very low	185 Å²	185	167.1 Å²	167.1	86%	0.864	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-94	116.1	174.4	-156	169.6	17.4	0	0	108.6	V7	Q5-V7 PolarHBondContact O-N 3.4Å
6	E	45.2	Very low	43.1	Very low	194 Å²	194	166.6 Å²	166.6	91%	0.907	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-66.4	122.3	172.2	-81	-179.4	154.9	0	0	110.1
7	V	42.2	Very low	43.3	Very low	126 Å²	126	163.8 Å²	163.8	76%	0.764	85%	0.854	S	S	*	*			trans	-91.3	113.6	172.8	179.3	0	0	0	0	108	Q5 I9	Q5-V7 PolarHBondContact O-N 3.4Å; V7-I9 PolarHBondContact O-N 3.41Å
8	Q	39.3	Very low	43.7	Very low	176 Å²	176	158.4 Å²	158.4	82%	0.822	85%	0.845	S	S	*	*			trans	-69.8	123.4	168.1	-74.7	-179.9	-13	0	0	109.5
9	I	43.6	Very low	44.3	Very low	154 Å²	154	158.8 Å²	158.8	79%	0.79	84%	0.841	S	S	*	*			trans	-88.5	106.5	171.9	-58.5	169.6	0	0	0	107.3	V7	V7-I9 PolarHBondContact O-N 3.41Å
10	T	44.5	Very low	45.5	Very low	121 Å²	121	154.8 Å²	154.8	74%	0.742	82%	0.823	S	S	*	*			trans	-111.8	93.5	164.8	-2.7	0	0	0	0	107.9
11	E	43.7	Very low	46.5	Very low	170 Å²	170	152.4 Å²	152.4	79%	0.794	82%	0.816	S	S	*	*			trans	-107.2	85.3	161.3	-91	-163.5	144.4	0	0	108.4	K13	E11-K13 PolarHBondContact O-N 3.19Å
12	E	43.3	Very low	47.9	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	79%	0.79	S	S	*	*			trans	-88.1	87.5	155.5	-75.8	-164.9	165.7	0	0	107.9
13	K	43.1	Very low	49.3	Very low	178 Å²	178	144.6 Å²	144.6	77%	0.774	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-78.1	124.4	164.7	-151.9	174.4	-170.3	173.5	0	106.9	E11 L15	E11-K13 PolarHBondContact O-N 3.19Å; K13-L15 PolarHBondContact O-N 3.21Å; K13-L15 VanDerWaalsContact O-N 3.1Å
14	P	39.7	Very low	50.8	Low	121 Å²	121	137.2 Å²	137.2	79%	0.786	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-63.9	119.9	176.2	-12.4	25.4	0	0	0	108.1	L16	P14-L16 PolarHBondContact O-N 3.32Å
15	L	45.4	Very low	52.2	Low	167 Å²	167	135.7 Å²	135.7	87%	0.874	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-57	125.9	164.9	-70.4	166.5	0	0	0	106.9	K13	K13-L15 PolarHBondContact O-N 3.21Å; K13-L15 VanDerWaalsContact O-N 3.1Å
16	L	52.5	Low	53.9	Low	159 Å²	159	133.4 Å²	133.4	83%	0.832	72%	0.715	S	S	*	*			trans	-44	131.4	172	-72.2	158.9	0	0	0	108.6	P14 G18	P14-L16 PolarHBondContact O-N 3.32Å; L16-G18 PolarHBondContact O-N 2.81Å
17	P	46.9	Very low	55.1	Low	120 Å²	120	126.9 Å²	126.9	78%	0.779	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-56.3	119.6	175.3	-1.8	6.1	0	0	0	107.7	Q19	P17-Q19 PolarHBondContact O-N 2.74Å
18	G	49.9	Very low	56.6	Low	66 Å²	66	127.6 Å²	127.6	68%	0.68	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-53.1	125.7	176.3	0	0	0	0	0	108.8	L16 T20	L16-G18 PolarHBondContact O-N 2.81Å; G18-T20 PolarHBondContact O-N 3.23Å
19	Q	55.8	Low	58.1	Low	166 Å²	166	124.6 Å²	124.6	78%	0.776	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-50.5	118.5	172.5	-75.5	173.4	-32	0	0	107.8	P17	P17-Q19 PolarHBondContact O-N 2.74Å
20	T	67.5	Low	59.3	Low	79 Å²	79	119.4 Å²	119.4	49%	0.485	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-61.2	146.5	175.2	50.9	0	0	0	0	108.4	G18 E22 A23 A24	G18-T20 PolarHBondContact O-N 3.23Å; T20-E22 PolarHBondContact O-N 3.31Å; T20-A23 PolarHBondContact O-N 3.28Å; T20-A23 WeakPolarHBondContact OG1-CB 3.39Å; T20-A23 PolarHBondContact OG1-N 3.2Å; T20-A24 PolarHBondContact O-N 3.45Å
21	P	67.5	Low	60.3	Low	105 Å²	105	115.9 Å²	115.9	68%	0.682	64%	0.641	S	S	*	*	H	α-helix	trans	-54.6	-25.5	177.2	-26.5	34.1	0	0	0	113.7	K25	P21-K25 WeakPolarHBondContact O-CG 3.38Å; P21-K25 PolarHBondContact O-N 2.88Å
22	E	70.6	Confident	61.3	Low	144 Å²	144	112.4 Å²	112.4	67%	0.673	63%	0.625	S	S	*	*	H	α-helix	trans	-73.2	-46.6	173.5	-73.8	176.6	156.9	0	0	112.4	T20 A24 K25 E26	T20-E22 PolarHBondContact O-N 3.31Å; E22-A24 VanDerWaalsContact C-N 3.27Å; E22-A24 PolarHBondContact O-N 2.94Å; E22-K25 PolarHBondContact O-N 2.67Å; E22-K25 VanDerWaalsContact O-N 3.14Å; E22-E26 WeakPolarHBondContact O-CG 3.27Å; E22-E26 PolarHBondContact O-N 2.94Å
23	A	70.1	Confident	62.5	Low	41 Å²	41	107.2 Å²	107.2	34%	0.339	60%	0.602	S	S	.	*	H	α-helix	trans	-63.5	-33.7	176.3	0	0	0	0	0	112.3	T20 A27	T20-A23 PolarHBondContact O-N 3.28Å; T20-A23 WeakPolarHBondContact OG1-CB 3.39Å; T20-A23 PolarHBondContact OG1-N 3.2Å; A23-A27 WeakPolarHBondContact O-CB 3.43Å; A23-A27 PolarHBondContact O-N 3.04Å
24	A	70.8	Confident	63.4	Low	42 Å²	42	103.2 Å²	103.2	35%	0.347	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-42.2	173.1	0	0	0	0	0	112.1	T20 E22 A27 E28	T20-A24 PolarHBondContact O-N 3.45Å; E22-A24 VanDerWaalsContact C-N 3.27Å; E22-A24 PolarHBondContact O-N 2.94Å; A24-A27 PolarHBondContact O-N 3.41Å; A24-E28 WeakPolarHBondContact O-CB 3.31Å; A24-E28 PolarHBondContact O-N 2.94Å
25	K	73.2	Confident	64.7	Low	146 Å²	146	99.3 Å²	99.3	64%	0.635	56%	0.561	S	S	*	*	H	α-helix	trans	-67.1	-38.6	175.6	-79.7	177.7	177.8	-177.9	0	112.9	P21 E22 E28 L29	P21-K25 WeakPolarHBondContact O-CG 3.38Å; P21-K25 PolarHBondContact O-N 2.88Å; E22-K25 PolarHBondContact O-N 2.67Å; E22-K25 VanDerWaalsContact O-N 3.14Å; K25-E28 PolarHBondContact O-N 3.08Å; K25-L29 WeakPolarHBondContact O-CB 3.24Å; K25-L29 PolarHBondContact O-N 3.38Å
26	E	76.7	Confident	65.8	Low	138 Å²	138	96.1 Å²	96.1	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-65.6	-41.5	175.4	-73.9	179.1	170.8	0	0	111.4	E22 L29 A30	E22-E26 WeakPolarHBondContact O-CG 3.27Å; E22-E26 PolarHBondContact O-N 2.94Å; E26-L29 PolarHBondContact O-N 3.11Å; E26-A30 VanDerWaalsContact O-CB 3.3Å; E26-A30 WeakPolarHBondContact O-CB 3.4Å; E26-A30 PolarHBondContact O-N 3.47Å
27	A	70.5	Confident	66.9	Low	57 Å²	57	94.8 Å²	94.8	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-39.3	174.4	0	0	0	0	0	112.3	A23 A24 A30 A31	A23-A27 WeakPolarHBondContact O-CB 3.43Å; A23-A27 PolarHBondContact O-N 3.04Å; A24-A27 PolarHBondContact O-N 3.41Å; A27-A30 PolarHBondContact O-N 2.98Å; A27-A31 VanDerWaalsContact O-CB 3.28Å; A27-A31 WeakPolarHBondContact O-CB 3.18Å; A27-A31 PolarHBondContact O-N 3.03Å
28	E	73.4	Confident	68.9	Low	141 Å²	141	89.9 Å²	89.9	66%	0.659	51%	0.506	S	S	*	.	H	α-helix	trans	-65.5	-43.2	175.3	-172.5	174.8	-172.4	0	0	111.6	A24 K25 A31 Q32	A24-E28 WeakPolarHBondContact O-CB 3.31Å; A24-E28 PolarHBondContact O-N 2.94Å; K25-E28 PolarHBondContact O-N 3.08Å; E28-A31 PolarHBondContact O-N 3.2Å; E28-Q32 WeakPolarHBondContact O-CB 3.36Å; E28-Q32 PolarHBondContact O-N 3.23Å
29	L	72.3	Confident	70.9	Confident	112 Å²	112	91.7 Å²	91.7	59%	0.586	50%	0.497	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.9	-174.2	71.9	0	0	0	111.4	K25 E26 A31 Q32 I33	K25-L29 WeakPolarHBondContact O-CB 3.24Å; K25-L29 PolarHBondContact O-N 3.38Å; E26-L29 PolarHBondContact O-N 3.11Å; L29-A31 VanDerWaalsContact C-N 3.35Å; L29-Q32 PolarHBondContact O-N 3.46Å; L29-I33 HydrophobicContact CG-CD1 4.05Å; L29-I33 VanDerWaalsContact O-CG1 3.23Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 3.46Å
30	A	68.4	Low	72.8	Confident	46 Å²	46	88.2 Å²	88.2	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-41	176.7	0	0	0	0	0	111.8	E26 A27 I33 L34	E26-A30 VanDerWaalsContact O-CB 3.3Å; E26-A30 WeakPolarHBondContact O-CB 3.4Å; E26-A30 PolarHBondContact O-N 3.47Å; A27-A30 PolarHBondContact O-N 2.98Å; A30-I33 PolarHBondContact O-N 3.31Å; A30-L34 VanDerWaalsContact O-CG 3.3Å; A30-L34 WeakPolarHBondContact O-CG 3.34Å; A30-L34 PolarHBondContact O-N 3.12Å
31	A	64.9	Low	74.2	Confident	46 Å²	46	86.5 Å²	86.5	38%	0.38	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174	0	0	0	0	0	111.5	A27 E28 L29 L34 L35	A27-A31 VanDerWaalsContact O-CB 3.28Å; A27-A31 WeakPolarHBondContact O-CB 3.18Å; A27-A31 PolarHBondContact O-N 3.03Å; E28-A31 PolarHBondContact O-N 3.2Å; L29-A31 VanDerWaalsContact C-N 3.35Å; A31-L34 PolarHBondContact O-N 3.03Å; A31-L35 WeakPolarHBondContact O-CB 3.4Å; A31-L35 WeakPolarHBondContact O-CD1 3.25Å; A31-L35 WeakPolarHBondContact O-CG 3.48Å; A31-L35 PolarHBondContact O-N 3.07Å
32	Q	65.1	Low	75.7	Confident	97 Å²	97	84.5 Å²	84.5	45%	0.453	46%	0.462	S	S	.	.	H	α-helix	trans	-62.7	-43.3	176.4	-171.1	60.3	49.8	0	0	111.8	E28 L29 L34 L35 D36	E28-Q32 WeakPolarHBondContact O-CB 3.36Å; E28-Q32 PolarHBondContact O-N 3.23Å; L29-Q32 PolarHBondContact O-N 3.46Å; Q32-L34 VanDerWaalsContact C-N 3.34Å; Q32-L34 PolarHBondContact O-N 3.49Å; Q32-L35 PolarHBondContact O-N 3.4Å; Q32-D36 PolarHBondContact NE2-OD1 3.13Å; Q32-D36 VanDerWaalsContact NE2-OD1 3.15Å; Q32-D36 VanDerWaalsContact O-CG 3.32Å; Q32-D36 PolarHBondContact O-N 3.17Å
33	I	67.6	Low	77	Confident	81 Å²	81	78.6 Å²	78.6	42%	0.415	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-43.7	175.9	-69.3	164.2	0	0	0	110.9	L29 A30 L35 D36 Q37	L29-I33 HydrophobicContact CG-CD1 4.05Å; L29-I33 VanDerWaalsContact O-CG1 3.23Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 3.46Å; A30-I33 PolarHBondContact O-N 3.31Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 3Å; I33-D36 PolarHBondContact O-N 3.05Å; I33-Q37 WeakPolarHBondContact O-CG 3.43Å; I33-Q37 PolarHBondContact O-N 2.97Å
34	L	63.5	Low	78.3	Confident	94 Å²	94	83.4 Å²	83.4	49%	0.492	45%	0.451	S	S	.	.	H	α-helix	trans	-66.1	-36.2	177.8	-71.8	170.1	0	0	0	112.4	A30 A31 Q32 D36 Q37 G38	A30-L34 VanDerWaalsContact O-CG 3.3Å; A30-L34 WeakPolarHBondContact O-CG 3.34Å; A30-L34 PolarHBondContact O-N 3.12Å; A31-L34 PolarHBondContact O-N 3.03Å; Q32-L34 VanDerWaalsContact C-N 3.34Å; Q32-L34 PolarHBondContact O-N 3.49Å; L34-D36 VanDerWaalsContact C-N 3.32Å; L34-Q37 PolarHBondContact O-N 2.95Å; L34-G38 PolarHBondContact O-N 3.18Å
35	L	65.8	Low	79.6	Confident	39 Å²	39	82.1 Å²	82.1	20%	0.204	44%	0.439	C	S	.	.	H	α-helix	trans	-68.9	-31.1	175.7	-71	166	0	0	0	112.7	A31 Q32 I33 T57	A31-L35 WeakPolarHBondContact O-CB 3.4Å; A31-L35 WeakPolarHBondContact O-CD1 3.25Å; A31-L35 WeakPolarHBondContact O-CG 3.48Å; A31-L35 PolarHBondContact O-N 3.07Å; Q32-L35 PolarHBondContact O-N 3.4Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 3Å; L35-T57 HydrophobicContact CD1-CG2 3.5Å; L35-T57 HydrophobicContact CD2-CG2 3.59Å; L35-T57 HydrophobicContact CG-CG2 4.2Å
36	D	69.4	Low	80.7	Confident	99 Å²	99	80.2 Å²	80.2	53%	0.529	44%	0.442	S	S	.	.	H	α-helix	trans	-79.8	-25.2	177.1	-71	-11.1	0	0	0	112.5	Q32 I33 L34 Y55	Q32-D36 PolarHBondContact NE2-OD1 3.13Å; Q32-D36 VanDerWaalsContact NE2-OD1 3.15Å; Q32-D36 VanDerWaalsContact O-CG 3.32Å; Q32-D36 PolarHBondContact O-N 3.17Å; I33-D36 PolarHBondContact O-N 3.05Å; L34-D36 VanDerWaalsContact C-N 3.32Å; D36-Y55 WeakPolarHBondContact O-CE1 3.47Å
37	Q	75.9	Confident	81.7	Confident	132 Å²	132	77.3 Å²	77.3	62%	0.617	43%	0.425	S	S	*	.	H	α-helix	trans	-78.7	-20.4	176.6	-74.6	179.2	5.9	0	0	113.7	I33 L34	I33-Q37 WeakPolarHBondContact O-CG 3.43Å; I33-Q37 PolarHBondContact O-N 2.97Å; L34-Q37 PolarHBondContact O-N 2.95Å
38	G	87.2	Confident	82.9	Confident	17 Å²	17	75.6 Å²	75.6	18%	0.175	41%	0.413	C	S	.	.			trans	77.3	140.3	-178	0	0	0	0	0	112.3	L34 V54 Y55	L34-G38 PolarHBondContact O-N 3.18Å; G38-V54 CarbonylContact C-O 3.54Å; G38-V54 VanDerWaalsContact CA-O 3.29Å; G38-V54 WeakPolarHBondContact CA-O 3.41Å; G38-Y55 VanDerWaalsContact N-CE1 3.31Å
39	Q	93.1	Very high	84.1	Confident	104 Å²	104	70.8 Å²	70.8	49%	0.486	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.5	177.7	-64.5	-173.7	-10	0	0	109.2	H41 T53 V54	Q39-H41 WeakPolarHBondContact CB-NE2 3.23Å; Q39-H41 PolarHBondContact O-CD2 2.8Å; Q39-T53 CarbonylContact O-C 3.59Å; Q39-T53 WeakPolarHBondContact O-CA 3.4Å; Q39-V54 PolarHBondContact N-O 3.17Å; Q39-V54 PolarHBondContact O-N 2.92Å
40	T	96	Very high	85.3	Confident	93 Å²	93	65.5 Å²	65.5	57%	0.571	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.6	176.3	-60.2	0	0	0	0	110	T51 F52 T53	T40-T51 HydrophobicContact CG2-CG2 3.62Å; T40-F52 WeakPolarHBondContact CA-O 3.26Å; T40-T53 PolarHBondContact OG1-OG1 3.39Å; T40-T53 VanDerWaalsContact OG1-OG1 3.09Å
41	H	97.3	Very high	86.7	Confident	42 Å²	42	64.1 Å²	64.1	19%	0.194	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	161	176.4	-59.8	-97.2	0	0	0	109.3	Q39 T51 F52 Y134	Q39-H41 WeakPolarHBondContact CB-NE2 3.23Å; Q39-H41 PolarHBondContact O-CD2 2.8Å; H41-T51 WeakPolarHBondContact O-CA 3.42Å; H41-F52 HydrophobicContact CB-CD2 4.14Å; H41-F52 HydrophobicContact CB-CE1 4.12Å; H41-F52 HydrophobicContact CB-CE2 3.53Å; H41-F52 HydrophobicContact CB-CZ 3.52Å; H41-F52 PolarHBondContact N-O 3.2Å; H41-F52 PolarHBondContact O-N 3.32Å; H41-Y134 HydrophobicContact CB-CE1 4.1Å; H41-Y134 AromaticContact CG-CE1 3.99Å; H41-Y134 AromaticContact ND1-CE1 3.62Å; H41-Y134 AromaticContact ND1-CZ 3.89Å; H41-Y134 PolarHBondContact ND1-OH 2.87Å
42	S	97.5	Very high	88.3	Confident	63 Å²	63	62 Å²	62	44%	0.441	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	136.4	173.7	155.1	0	0	0	0	107.5	S49 V50	S42-S49 PolarHBondContact OG-OG 3.42Å; S42-V50 WeakPolarHBondContact CA-O 3.47Å
43	V	97.8	Very high	89.9	Confident	21 Å²	21	57.4 Å²	57.4	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.8	178.6	68	0	0	0	0	109.9	T45 S49 V50 F52 C130 V131 Y134	V43-T45 HydrophobicContact CG1-CG2 4.43Å; V43-S49 WeakPolarHBondContact O-CA 3.39Å; V43-S49 PolarHBondContact O-OG 3.14Å; V43-V50 HydrophobicContact CG1-CG1 3.45Å; V43-V50 VanDerWaalsContact CG1-CG1 3.45Å; V43-V50 PolarHBondContact N-O 3.41Å; V43-V50 PolarHBondContact O-N 2.99Å; V43-F52 HydrophobicContact CB-CE1 4.07Å; V43-F52 HydrophobicContact CG1-CD1 4.45Å; V43-F52 HydrophobicContact CG1-CE1 3.7Å; V43-C130 HydrophobicContact CG1-CB 4.38Å; V43-C130 HydrophobicContact CG2-CB 4.43Å; V43-V131 HydrophobicContact CG1-CG2 3.95Å; V43-Y134 HydrophobicContact CB-CD2 4.49Å; V43-Y134 HydrophobicContact CG2-CD2 4.17Å; V43-Y134 HydrophobicContact CG2-CG 4.45Å
44	E	97.9	Very high	91.3	Very high	141 Å²	141	54.5 Å²	54.5	66%	0.659	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	134.1	173.8	-67.5	-57.4	138.5	0	0	110.7	S49	E44-S49 WeakPolarHBondContact OE1-CB 3.36Å; E44-S49 PolarHBondContact OE1-OG 2.81Å
45	T	97.8	Very high	92.8	Very high	15 Å²	15	51.5 Å²	51.5	9%	0.092	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	167.7	175.4	82.5	0	0	0	0	109.6	V43 Y47 G48 V50 M127 C130	V43-T45 HydrophobicContact CG1-CG2 4.43Å; T45-Y47 PolarHBondContact O-N 2.96Å; T45-Y47 PolarHBondContact OG1-N 2.44Å; T45-G48 WeakPolarHBondContact CA-O 3.5Å; T45-G48 WeakPolarHBondContact CB-O 3.38Å; T45-G48 PolarHBondContact N-O 3.29Å; T45-G48 PolarHBondContact O-N 3.28Å; T45-G48 VanDerWaalsContact O-N 3.16Å; T45-G48 PolarHBondContact OG1-O 2.88Å; T45-V50 HydrophobicContact CG2-CG1 3.85Å; T45-M127 HydrophobicContact CG2-CB 4.01Å; T45-M127 HydrophobicContact CG2-CG 4.04Å; T45-C130 HydrophobicContact CG2-CB 3.85Å
46	P	97.6	Very high	93.9	Very high	107 Å²	107	50.3 Å²	50.3	70%	0.695	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.1	175.1	-26.3	36.4	0	0	0	114.8
47	Y	97.4	Very high	94.6	Very high	77 Å²	77	49.2 Å²	49.2	30%	0.302	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	20	-175.6	-44.4	-69.4	0	0	0	112.6	T45 Q123 D126 M127	T45-Y47 PolarHBondContact O-N 2.96Å; T45-Y47 PolarHBondContact OG1-N 2.44Å; Y47-Q123 HydrophobicContact CD1-CB 4.17Å; Y47-Q123 HydrophobicContact CD1-CG 4.01Å; Y47-Q123 HydrophobicContact CD2-CB 3.89Å; Y47-Q123 HydrophobicContact CD2-CG 4.39Å; Y47-Q123 WeakPolarHBondContact CD2-O 3.44Å; Y47-Q123 HydrophobicContact CE1-CB 4.25Å; Y47-Q123 HydrophobicContact CE1-CG 3.72Å; Y47-Q123 HydrophobicContact CE2-CB 3.97Å; Y47-Q123 HydrophobicContact CE2-CG 4.12Å; Y47-Q123 HydrophobicContact CG-CB 3.98Å; Y47-Q123 HydrophobicContact CG-CG 4.32Å; Y47-D126 HydrophobicContact CE2-CB 3.71Å; Y47-D126 PolarHBondContact OH-OD2 3.41Å; Y47-M127 HydrophobicContact CD2-CG 4.43Å; Y47-M127 WeakPolarHBondContact O-CE 3.4Å
48	G	95.9	Very high	94.8	Very high	21 Å²	21	47.5 Å²	47.5	22%	0.216	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	108.4	-177.4	-178.3	0	0	0	0	0	113	T45	T45-G48 WeakPolarHBondContact CA-O 3.5Å; T45-G48 WeakPolarHBondContact CB-O 3.38Å; T45-G48 PolarHBondContact N-O 3.29Å; T45-G48 PolarHBondContact O-N 3.28Å; T45-G48 VanDerWaalsContact O-N 3.16Å; T45-G48 PolarHBondContact OG1-O 2.88Å
49	S	96.9	Very high	94.5	Very high	39 Å²	39	50.4 Å²	50.4	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	142	-178.7	-160.4	0	0	0	0	111.5	S42 V43 E44	S42-S49 PolarHBondContact OG-OG 3.42Å; V43-S49 WeakPolarHBondContact O-CA 3.39Å; V43-S49 PolarHBondContact O-OG 3.14Å; E44-S49 WeakPolarHBondContact OE1-CB 3.36Å; E44-S49 PolarHBondContact OE1-OG 2.81Å
50	V	98.1	Very high	93.8	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.9	171.7	65.5	0	0	0	0	109.8	S42 V43 T45 V100 D101 M127 V131	S42-V50 WeakPolarHBondContact CA-O 3.47Å; V43-V50 HydrophobicContact CG1-CG1 3.45Å; V43-V50 VanDerWaalsContact CG1-CG1 3.45Å; V43-V50 PolarHBondContact N-O 3.41Å; V43-V50 PolarHBondContact O-N 2.99Å; T45-V50 HydrophobicContact CG2-CG1 3.85Å; V50-V100 HydrophobicContact CG2-CG1 3.71Å; V50-D101 WeakPolarHBondContact CG2-O 3.49Å; V50-M127 HydrophobicContact CB-SD 4.17Å; V50-M127 HydrophobicContact CG1-CB 4.47Å; V50-V131 HydrophobicContact CG1-CG2 3.68Å
51	T	98.5	Very high	93.2	Very high	18 Å²	18	56.5 Å²	56.5	11%	0.11	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	139.9	179.5	-63.1	0	0	0	0	109.6	T40 H41 D101 E106	T40-T51 HydrophobicContact CG2-CG2 3.62Å; H41-T51 WeakPolarHBondContact O-CA 3.42Å; T51-D101 PolarHBondContact O-N 3.46Å; T51-E106 HydrophobicContact CG2-CB 3.89Å; T51-E106 HydrophobicContact CG2-CG 4.14Å
52	F	98.4	Very high	92.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	148.9	175.8	56.4	-86.1	0	0	0	111.3	T40 H41 V43 V54 V98 H99 V100 V131 Y134 L135	T40-F52 WeakPolarHBondContact CA-O 3.26Å; H41-F52 HydrophobicContact CB-CD2 4.14Å; H41-F52 HydrophobicContact CB-CE1 4.12Å; H41-F52 HydrophobicContact CB-CE2 3.53Å; H41-F52 HydrophobicContact CB-CZ 3.52Å; H41-F52 PolarHBondContact N-O 3.2Å; H41-F52 PolarHBondContact O-N 3.32Å; V43-F52 HydrophobicContact CB-CE1 4.07Å; V43-F52 HydrophobicContact CG1-CD1 4.45Å; V43-F52 HydrophobicContact CG1-CE1 3.7Å; F52-V54 HydrophobicContact CD2-CG2 3.84Å; F52-V54 HydrophobicContact CE2-CG2 3.94Å; F52-V98 HydrophobicContact CB-CG1 4.29Å; F52-V98 HydrophobicContact CD2-CG1 3.99Å; F52-V98 HydrophobicContact CG-CG1 4.38Å; F52-H99 CarbonylContact C-O 3.57Å; F52-H99 WeakPolarHBondContact CA-O 3.19Å; F52-H99 WeakPolarHBondContact CB-O 3.5Å; F52-V100 HydrophobicContact CB-CG2 4.23Å; F52-V131 HydrophobicContact CD1-CB 4.49Å; F52-V131 HydrophobicContact CD1-CG1 3.89Å; F52-V131 HydrophobicContact CD1-CG2 3.92Å; F52-V131 HydrophobicContact CD2-CG1 4.09Å; F52-V131 HydrophobicContact CE1-CB 4.43Å; F52-V131 HydrophobicContact CE1-CG1 3.98Å; F52-V131 HydrophobicContact CE1-CG2 4.06Å; F52-V131 HydrophobicContact CE2-CG1 4.15Å; F52-V131 HydrophobicContact CG-CG1 3.95Å; F52-V131 HydrophobicContact CZ-CG1 4.1Å; F52-Y134 HydrophobicContact CE2-CD1 4.3Å; F52-Y134 AromaticContact CZ-CD1 3.66Å; F52-Y134 HydrophobicContact CZ-CD1 3.66Å; F52-Y134 HydrophobicContact CZ-CE1 4.04Å; F52-Y134 HydrophobicContact CZ-CG 4.34Å; F52-L135 HydrophobicContact CD2-CD1 4.22Å; F52-L135 HydrophobicContact CE2-CD1 3.76Å; F52-L135 HydrophobicContact CE2-CD2 3.97Å; F52-L135 HydrophobicContact CE2-CG 3.92Å; F52-L135 HydrophobicContact CZ-CG 4.42Å
53	T	98.1	Very high	92.8	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.9	177.6	-54.5	0	0	0	0	110.4	Q39 T40 Y55 H99	Q39-T53 CarbonylContact O-C 3.59Å; Q39-T53 WeakPolarHBondContact O-CA 3.4Å; T40-T53 PolarHBondContact OG1-OG1 3.39Å; T40-T53 VanDerWaalsContact OG1-OG1 3.09Å; T53-Y55 HydrophobicContact CG2-CD2 3.96Å; T53-Y55 HydrophobicContact CG2-CE2 3.34Å; T53-H99 PolarHBondContact N-O 3.01Å; T53-H99 PolarHBondContact O-N 3.23Å
54	V	96.7	Very high	92.7	Very high	19 Å²	19	54.7 Å²	54.7	12%	0.115	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134	-180	-176.6	0	0	0	0	109.9	G38 Q39 F52 V96 R97 V98 L135	G38-V54 CarbonylContact C-O 3.54Å; G38-V54 VanDerWaalsContact CA-O 3.29Å; G38-V54 WeakPolarHBondContact CA-O 3.41Å; Q39-V54 PolarHBondContact N-O 3.17Å; Q39-V54 PolarHBondContact O-N 2.92Å; F52-V54 HydrophobicContact CD2-CG2 3.84Å; F52-V54 HydrophobicContact CE2-CG2 3.94Å; V54-V96 HydrophobicContact CG1-CG1 3.66Å; V54-R97 CarbonylContact C-O 3.6Å; V54-R97 VanDerWaalsContact CA-O 3.29Å; V54-R97 WeakPolarHBondContact CA-O 3.43Å; V54-V98 HydrophobicContact CG2-CG2 4.48Å; V54-L135 HydrophobicContact CG2-CD1 3.87Å; V54-L135 HydrophobicContact CG2-CD2 3.88Å
55	Y	94.8	Very high	92.7	Very high	31 Å²	31	48 Å²	48	12%	0.122	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.2	170.9	-61.2	-107.6	0	0	0	112.6	D36 G38 T53 Y75 V96 R97 H99	D36-Y55 WeakPolarHBondContact O-CE1 3.47Å; G38-Y55 VanDerWaalsContact N-CE1 3.31Å; T53-Y55 HydrophobicContact CG2-CD2 3.96Å; T53-Y55 HydrophobicContact CG2-CE2 3.34Å; Y55-Y75 HydrophobicContact CE2-CE2 4.29Å; Y55-Y75 PolarHBondContact OH-OH 3.26Å; Y55-Y75 VanDerWaalsContact OH-OH 3.12Å; Y55-V96 WeakPolarHBondContact O-CA 3.48Å; Y55-R97 PolarHBondContact N-O 3.01Å; Y55-R97 PolarHBondContact O-N 3.41Å; Y55-H99 AromaticContact CD2-CD2 3.65Å; Y55-H99 AromaticContact CE2-CD2 3.68Å
56	G	89.8	Confident	92.7	Very high	15 Å²	15	47.2 Å²	47.2	16%	0.155	26%	0.259	C	S	.	.	S	Bend	trans	79.8	172.1	-178.5	0	0	0	0	0	113.4
57	T	83.7	Confident	92.8	Very high	75 Å²	75	42.1 Å²	42.1	46%	0.46	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-101.3	137.1	-178.3	42.3	0	0	0	0	111.7	L35 K59 V96	L35-T57 HydrophobicContact CD1-CG2 3.5Å; L35-T57 HydrophobicContact CD2-CG2 3.59Å; L35-T57 HydrophobicContact CG-CG2 4.2Å; T57-K59 PolarHBondContact O-N 3.27Å; T57-K59 VanDerWaalsContact O-N 3.17Å; T57-V96 VanDerWaalsContact O-CG2 3.3Å; T57-V96 WeakPolarHBondContact O-CG2 3.35Å
58	P	79.8	Confident	92.9	Very high	96 Å²	96	38.6 Å²	38.6	62%	0.623	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-52.7	121.5	173.9	-27.4	34.9	0	0	0	111.8	V96 F137	P58-V96 HydrophobicContact CB-CG2 4.22Å; P58-V96 HydrophobicContact CG-CG2 4.06Å; P58-F137 HydrophobicContact CG-CZ 4.36Å
59	K	81.6	Confident	93	Very high	79 Å²	79	37.6 Å²	37.6	34%	0.343	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-100.2	129.7	170.6	-63	-164.4	-171.6	-173.9	0	108.5	T57 K61 R62 Q93 N94	T57-K59 PolarHBondContact O-N 3.27Å; T57-K59 VanDerWaalsContact O-N 3.17Å; K59-K61 PolarHBondContact O-N 2.96Å; K59-R62 HydrophobicContact CB-CB 4.22Å; K59-R62 HydrophobicContact CB-CG 3.93Å; K59-R62 PolarHBondContact O-N 3.38Å; K59-Q93 VanDerWaalsContact CE-O 3.28Å; K59-Q93 WeakPolarHBondContact CE-O 3.48Å; K59-Q93 PolarHBondContact NZ-O 3.3Å; K59-N94 PolarHBondContact NZ-OD1 3.05Å
60	P	78.3	Confident	93.1	Very high	121 Å²	121	35.7 Å²	35.7	79%	0.786	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	138.1	177.9	-25.5	33.3	0	0	0	111.6	R62	P60-R62 PolarHBondContact O-N 2.96Å
61	K	82.6	Confident	93.1	Very high	204 Å²	204	35.7 Å²	35.7	89%	0.887	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	25.8	177.5	-48.6	179.9	179	-177.7	0	114.6	K59	K59-K61 PolarHBondContact O-N 2.96Å
62	R	90.6	Very high	93	Very high	86 Å²	86	35 Å²	35	33%	0.325	19%	0.185	S	C	.	.			trans	-116.1	133.3	170.1	-66.3	-69.4	-179.4	161.8	-5.4	109.1	K59 P60	K59-R62 HydrophobicContact CB-CB 4.22Å; K59-R62 HydrophobicContact CB-CG 3.93Å; K59-R62 PolarHBondContact O-N 3.38Å; P60-R62 PolarHBondContact O-N 2.96Å
63	P	95.4	Very high	93	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	19%	0.186	C	C	.	.			trans	-64.7	159	170.5	28.5	-35.5	0	0	0	110.1	F95 T139 I141 E164 Y316	P63-F95 HydrophobicContact CG-CE1 4.3Å; P63-F95 WeakPolarHBondContact O-CD1 3.44Å; P63-T139 WeakPolarHBondContact CA-O 3.45Å; P63-T139 WeakPolarHBondContact CB-O 3.34Å; P63-I141 HydrophobicContact CB-CG1 4.22Å; P63-I141 HydrophobicContact CG-CD1 3.62Å; P63-I141 HydrophobicContact CG-CG1 3.8Å; P63-E164 WeakPolarHBondContact CG-OE2 3.29Å; P63-Y316 VanDerWaalsContact CD-OH 3.23Å; P63-Y316 WeakPolarHBondContact CD-OH 3.32Å; P63-Y316 HydrophobicContact CG-CE2 3.91Å
64	A	96.6	Very high	93	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	146.1	164.5	0	0	0	0	0	110.2	L66 V96 V98 F137 T139 V140 I141	A64-L66 PolarHBondContact O-N 3.15Å; A64-V96 CarbonylContact C-O 3.43Å; A64-V96 WeakPolarHBondContact CA-O 3.42Å; A64-V96 HydrophobicContact CB-CB 4.4Å; A64-V98 HydrophobicContact CB-CG2 4.04Å; A64-F137 HydrophobicContact CB-CD1 4.01Å; A64-F137 HydrophobicContact CB-CD2 3.97Å; A64-F137 HydrophobicContact CB-CE1 4.07Å; A64-F137 HydrophobicContact CB-CE2 4.03Å; A64-F137 HydrophobicContact CB-CG 3.99Å; A64-F137 HydrophobicContact CB-CZ 4.1Å; A64-T139 PolarHBondContact N-O 2.89Å; A64-V140 HydrophobicContact CB-CG1 4.31Å; A64-V140 CarbonylContact O-C 3.54Å; A64-V140 VanDerWaalsContact O-CA 3.23Å; A64-V140 WeakPolarHBondContact O-CA 3.28Å; A64-V140 WeakPolarHBondContact O-CB 3.46Å; A64-I141 PolarHBondContact O-N 2.8Å
65	I	98.2	Very high	93.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	108.6	165.3	-63.7	172.5	0	0	0	106.9	T67 F83 I92 F95 V96 R97 V98 I141 V143 F307	I65-T67 HydrophobicContact CG2-CG2 4.43Å; I65-F83 HydrophobicContact CG2-CE1 4.05Å; I65-F83 HydrophobicContact CG2-CZ 3.93Å; I65-I92 HydrophobicContact CD1-CG2 4.24Å; I65-F95 HydrophobicContact CD1-CB 3.67Å; I65-F95 HydrophobicContact CD1-CD1 4.3Å; I65-F95 HydrophobicContact CD1-CD2 3.95Å; I65-F95 HydrophobicContact CD1-CG 3.72Å; I65-F95 HydrophobicContact CG1-CB 3.87Å; I65-F95 HydrophobicContact CG1-CD1 4.16Å; I65-F95 HydrophobicContact CG1-CG 4Å; I65-V96 PolarHBondContact N-O 3.49Å; I65-R97 CarbonylContact O-C 3.52Å; I65-R97 WeakPolarHBondContact O-CA 3.43Å; I65-V98 PolarHBondContact O-N 3.31Å; I65-I141 CarbonylContact C-O 3.53Å; I65-I141 WeakPolarHBondContact CA-O 3.39Å; I65-V143 HydrophobicContact CG2-CG2 4.07Å; I65-F307 HydrophobicContact CD1-CE1 4Å; I65-F307 HydrophobicContact CD1-CZ 3.92Å; I65-F307 HydrophobicContact CG1-CZ 4.45Å
66	L	98.8	Very high	93.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.6	179.3	-172.9	150.3	0	0	0	109.6	A64 V98 V100 I128 L132 V140 I141 G142 V143 L152	A64-L66 PolarHBondContact O-N 3.15Å; L66-V98 CarbonylContact C-O 3.58Å; L66-V98 VanDerWaalsContact CA-O 3.31Å; L66-V98 WeakPolarHBondContact CA-O 3.46Å; L66-V98 HydrophobicContact CD1-CG1 4.44Å; L66-V98 HydrophobicContact CG-CB 4.45Å; L66-V100 HydrophobicContact CD1-CG2 4.26Å; L66-V100 HydrophobicContact CD2-CG2 4.09Å; L66-V100 HydrophobicContact CG-CG2 4.07Å; L66-I128 HydrophobicContact CD1-CG2 4.03Å; L66-L132 HydrophobicContact CD1-CD2 3.84Å; L66-V140 HydrophobicContact CB-CB 4.11Å; L66-V140 HydrophobicContact CB-CG1 4.08Å; L66-V140 HydrophobicContact CD1-CG1 4.3Å; L66-I141 PolarHBondContact N-O 2.93Å; L66-G142 CarbonylContact O-C 3.53Å; L66-G142 WeakPolarHBondContact O-CA 3.32Å; L66-V143 PolarHBondContact O-N 3.31Å; L66-L152 HydrophobicContact CD2-CD2 3.53Å
67	T	98.9	Very high	93.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	141.9	179.1	75.4	0	0	0	0	112.3	I65 F79 F83 V98 H99 V100 V143	I65-T67 HydrophobicContact CG2-CG2 4.43Å; T67-F79 HydrophobicContact CG2-CD2 4.35Å; T67-F79 HydrophobicContact CG2-CG 4.38Å; T67-F83 HydrophobicContact CG2-CE1 4.49Å; T67-F83 HydrophobicContact CG2-CE2 3.8Å; T67-F83 HydrophobicContact CG2-CZ 3.59Å; T67-V98 PolarHBondContact N-O 3.49Å; T67-H99 WeakPolarHBondContact CG2-ND1 3.4Å; T67-H99 WeakPolarHBondContact OG1-CA 3.12Å; T67-H99 PolarHBondContact OG1-ND1 2.93Å; T67-V100 PolarHBondContact O-N 2.75Å; T67-V143 CarbonylContact C-O 3.58Å; T67-V143 WeakPolarHBondContact CA-O 3.47Å; T67-V143 HydrophobicContact CG2-CB 4.27Å
68	Y	98.9	Very high	94.2	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.6	174.4	-145.3	-62.5	0	0	0	109.9	F79 V100 A102 I128 V143 G144 V145 G148 I151	Y68-F79 WeakPolarHBondContact O-CE2 3.45Å; Y68-V100 HydrophobicContact CD2-CB 4.19Å; Y68-V100 HydrophobicContact CD2-CG1 4.09Å; Y68-V100 HydrophobicContact CE2-CB 4.37Å; Y68-V100 HydrophobicContact CE2-CG1 3.76Å; Y68-A102 HydrophobicContact CE1-CB 3.92Å; Y68-I128 HydrophobicContact CD2-CD1 4.26Å; Y68-I128 HydrophobicContact CE2-CD1 4.41Å; Y68-I128 HydrophobicContact CE2-CG1 4.44Å; Y68-V143 PolarHBondContact N-O 2.82Å; Y68-G144 WeakPolarHBondContact O-CA 3.39Å; Y68-V145 PolarHBondContact O-N 3.01Å; Y68-G148 WeakPolarHBondContact O-CA 3.38Å; Y68-I151 HydrophobicContact CD1-CD1 3.88Å; Y68-I151 HydrophobicContact CD2-CG2 3.94Å; Y68-I151 HydrophobicContact CE1-CD1 3.39Å; Y68-I151 HydrophobicContact CE2-CD1 4.47Å; Y68-I151 HydrophobicContact CE2-CG2 3.77Å; Y68-I151 HydrophobicContact CG-CG2 4.39Å
69	H	98.9	Very high	95.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-86.4	167.9	-170.1	65.5	77.1	0	0	0	113.3	L73 C78 F79 V100 D101 A102 G148 Y233	H69-L73 PolarHBondContact CE1-O 3.19Å; H69-L73 PolarHBondContact ND1-O 3.48Å; H69-C78 HydrophobicContact CB-CB 3.53Å; H69-F79 HydrophobicContact CB-CD2 4.49Å; H69-F79 HydrophobicContact CB-CE2 4.19Å; H69-V100 PolarHBondContact CD2-O 3.31Å; H69-D101 IonicContact CD2-OD1 2.83Å; H69-D101 IonicContact NE2-OD1 3.88Å; H69-A102 PolarHBondContact NE2-N 3.13Å; H69-G148 PolarHBondContact O-N 3.05Å; H69-Y233 PolarHBondContact O-OH 3.43Å
70	D	98.8	Very high	95.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-83.3	169.5	175.9	-152.7	-2.8	0	0	0	112.7	L73 V145 A147 H200 L201	D70-L73 HydrophobicContact CB-CD1 4.4Å; D70-L73 PolarHBondContact O-N 3.41Å; D70-V145 WeakPolarHBondContact CA-O 3.43Å; D70-V145 HydrophobicContact CB-CB 4.06Å; D70-V145 HydrophobicContact CB-CG1 3.98Å; D70-V145 WeakPolarHBondContact CB-O 3.47Å; D70-V145 PolarHBondContact N-O 2.61Å; D70-A147 PolarHBondContact OD1-N 2.93Å; D70-H200 VanDerWaalsContact CG-NE2 3.32Å; D70-H200 IonicContact OD1-NE2 3.8Å; D70-H200 PolarHBondContact OD1-NE2 3.41Å; D70-H200 VanDerWaalsContact OD1-NE2 3.13Å; D70-H200 IonicContact OD2-CD2 2.97Å; D70-H200 IonicContact OD2-CE1 3.79Å; D70-H200 IonicContact OD2-NE2 2.67Å; D70-H200 PolarHBondContact OD2-NE2 3.02Å; D70-L201 HydrophobicContact CB-CD2 4.1Å
71	V	98.1	Very high	96.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	140.9	176.6	-178.4	0	0	0	0	111.4	L73 A147 I197 I230 Y233 W234 Y237	V71-L73 PolarHBondContact O-N 3.31Å; V71-A147 HydrophobicContact CG2-CB 3.79Å; V71-I197 HydrophobicContact CG1-CD1 4.35Å; V71-I197 HydrophobicContact CG1-CG1 4.45Å; V71-I230 HydrophobicContact CG1-CG2 4.48Å; V71-Y233 HydrophobicContact CB-CD1 4.31Å; V71-Y233 HydrophobicContact CB-CE1 4.43Å; V71-Y233 HydrophobicContact CG1-CD1 4.4Å; V71-Y233 HydrophobicContact CG2-CD1 3.95Å; V71-Y233 HydrophobicContact CG2-CE1 3.93Å; V71-Y233 HydrophobicContact CG2-CG 4.26Å; V71-W234 HydrophobicContact CB-CE3 4.27Å; V71-W234 HydrophobicContact CG1-CB 3.71Å; V71-W234 HydrophobicContact CG1-CD2 4.43Å; V71-W234 HydrophobicContact CG1-CE3 3.87Å; V71-W234 HydrophobicContact CG1-CG 4.45Å; V71-W234 HydrophobicContact CG2-CE3 4.4Å; V71-Y237 HydrophobicContact CG2-CD1 4.44Å; V71-Y237 HydrophobicContact CG2-CG 4.09Å
72	G	97.1	Very high	97.4	Very high	4 Å²	4	16.4 Å²	16.4	4%	0.041	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-4.5	-178.8	0	0	0	0	0	114.1
73	L	98.3	Very high	97.6	Very high	6 Å²	6	12.8 Å²	12.8	3%	0.031	7%	0.066	C	C	.	.			trans	-115.7	174	177.6	-53	-176	0	0	0	110.5	H69 D70 V71 S77 C78 L201 Y217	H69-L73 PolarHBondContact CE1-O 3.19Å; H69-L73 PolarHBondContact ND1-O 3.48Å; D70-L73 HydrophobicContact CB-CD1 4.4Å; D70-L73 PolarHBondContact O-N 3.41Å; V71-L73 PolarHBondContact O-N 3.31Å; L73-S77 WeakPolarHBondContact CA-OG 3.23Å; L73-S77 WeakPolarHBondContact CB-OG 3.33Å; L73-C78 HydrophobicContact CB-CB 3.99Å; L73-C78 HydrophobicContact CD1-CB 3.88Å; L73-L201 HydrophobicContact CD1-CD2 4.2Å; L73-L201 HydrophobicContact CD2-CD1 4.03Å; L73-L201 HydrophobicContact CG-CD1 4.2Å; L73-L201 HydrophobicContact CG-CD2 4.38Å; L73-Y217 HydrophobicContact CD2-CD1 3.59Å; L73-Y217 HydrophobicContact CD2-CE1 3.55Å
74	N	98	Very high	97.6	Very high	31 Å²	31	18.6 Å²	18.6	17%	0.166	9%	0.093	C	C	.	.			trans	-136	-177.7	164.2	66.2	15.4	0	0	0	108.3	K76 S77 C78 D101 M105	N74-K76 PolarHBondContact O-N 3.34Å; N74-K76 WeakPolarHBondContact OD1-CB 3.39Å; N74-K76 PolarHBondContact OD1-N 3.22Å; N74-K76 VanDerWaalsContact OD1-N 3.12Å; N74-S77 PolarHBondContact N-OG 3.05Å; N74-S77 PolarHBondContact O-N 2.94Å; N74-S77 PolarHBondContact O-OG 2.74Å; N74-S77 PolarHBondContact OD1-N 3.37Å; N74-S77 PolarHBondContact OD1-OG 2.87Å; N74-C78 WeakPolarHBondContact O-CB 3.49Å; N74-C78 PolarHBondContact O-N 3.33Å; N74-D101 WeakPolarHBondContact CB-OD1 3.19Å; N74-M105 HydrophobicContact CB-CB 4.46Å; N74-M105 WeakPolarHBondContact CB-O 3.42Å; N74-M105 PolarHBondContact ND2-O 3.21Å
75	Y	97.3	Very high	97.5	Very high	13 Å²	13	21.9 Å²	21.9	5%	0.051	11%	0.108	C	C	.	.	H	α-helix	trans	-59.5	-35.4	-176.9	92.1	-95.3	0	0	0	112.6	Y55 C78 F79 Q80 H99 D101	Y55-Y75 HydrophobicContact CE2-CE2 4.29Å; Y55-Y75 PolarHBondContact OH-OH 3.26Å; Y55-Y75 VanDerWaalsContact OH-OH 3.12Å; Y75-C78 PolarHBondContact O-N 2.63Å; Y75-F79 PolarHBondContact O-N 3.05Å; Y75-Q80 PolarHBondContact O-N 2.58Å; Y75-Q80 VanDerWaalsContact O-N 3.1Å; Y75-H99 HydrophobicContact CD1-CB 4.36Å; Y75-H99 HydrophobicContact CD2-CB 3.75Å; Y75-H99 AromaticContact CD2-CG 3.87Å; Y75-H99 HydrophobicContact CE2-CB 4.47Å; Y75-H99 HydrophobicContact CG-CB 3.69Å; Y75-D101 WeakPolarHBondContact CD1-OD1 3.27Å; Y75-D101 WeakPolarHBondContact CD1-OD2 3.47Å; Y75-D101 PolarHBondContact N-OD1 2.89Å
76	K	96.9	Very high	97.3	Very high	74 Å²	74	24.2 Å²	24.2	32%	0.322	13%	0.132	S	C	.	.	H	α-helix	trans	-67	-44.3	-179.3	-67.3	-172.5	177.4	-179.6	0	111.8	N74 Q80 E107	N74-K76 PolarHBondContact O-N 3.34Å; N74-K76 WeakPolarHBondContact OD1-CB 3.39Å; N74-K76 PolarHBondContact OD1-N 3.22Å; N74-K76 VanDerWaalsContact OD1-N 3.12Å; K76-Q80 WeakPolarHBondContact O-CB 3.34Å; K76-E107 IonicContact NZ-OE2 2.87Å; K76-E107 PolarHBondContact NZ-OE2 3.36Å
77	S	97.6	Very high	97	Very high	14 Å²	14	28.1 Å²	28.1	10%	0.098	15%	0.153	C	C	.	.	H	α-helix	trans	-81.6	-21.6	178.6	59.7	0	0	0	0	113.1	L73 N74 Y217	L73-S77 WeakPolarHBondContact CA-OG 3.23Å; L73-S77 WeakPolarHBondContact CB-OG 3.33Å; N74-S77 PolarHBondContact N-OG 3.05Å; N74-S77 PolarHBondContact O-N 2.94Å; N74-S77 PolarHBondContact O-OG 2.74Å; N74-S77 PolarHBondContact OD1-N 3.37Å; N74-S77 PolarHBondContact OD1-OG 2.87Å; S77-Y217 WeakPolarHBondContact O-CE1 3.37Å; S77-Y217 PolarHBondContact O-OH 2.99Å
78	C	98.4	Very high	96.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-92.6	-45.5	-177.8	-167.2	0	0	0	0	113.6	H69 L73 N74 Y75 Q296	H69-C78 HydrophobicContact CB-CB 3.53Å; L73-C78 HydrophobicContact CB-CB 3.99Å; L73-C78 HydrophobicContact CD1-CB 3.88Å; N74-C78 WeakPolarHBondContact O-CB 3.49Å; N74-C78 PolarHBondContact O-N 3.33Å; Y75-C78 PolarHBondContact O-N 2.63Å; C78-Q296 VanDerWaalsContact O-CG 3.31Å; C78-Q296 WeakPolarHBondContact O-CG 3.28Å
79	F	98.3	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-25.8	-167.3	-70.2	-64.8	0	0	0	114.9	T67 Y68 H69 Y75 P81 L82 F83 V143 V145	T67-F79 HydrophobicContact CG2-CD2 4.35Å; T67-F79 HydrophobicContact CG2-CG 4.38Å; Y68-F79 WeakPolarHBondContact O-CE2 3.45Å; H69-F79 HydrophobicContact CB-CD2 4.49Å; H69-F79 HydrophobicContact CB-CE2 4.19Å; Y75-F79 PolarHBondContact O-N 3.05Å; F79-P81 VanDerWaalsContact C-CD 3.44Å; F79-P81 VanDerWaalsContact C-N 3.29Å; F79-L82 WeakPolarHBondContact O-CB 3.08Å; F79-L82 PolarHBondContact O-N 3.17Å; F79-F83 HydrophobicContact CB-CD2 3.88Å; F79-F83 HydrophobicContact CB-CE2 4.09Å; F79-F83 HydrophobicContact CD1-CE2 4.04Å; F79-F83 HydrophobicContact CG-CE2 4.31Å; F79-F83 WeakPolarHBondContact O-CD2 3.37Å; F79-F83 PolarHBondContact O-N 3.26Å; F79-V143 HydrophobicContact CE1-CG1 3.77Å; F79-V143 HydrophobicContact CZ-CG1 4.28Å; F79-V143 WeakPolarHBondContact CZ-O 3.26Å; F79-V145 HydrophobicContact CE1-CG2 3.73Å; F79-V145 HydrophobicContact CZ-CG2 3.61Å
80	Q	95.9	Very high	96	Very high	59 Å²	59	37 Å²	37	28%	0.276	19%	0.194	S	C	.	.	H	α-helix	trans	-53.2	-41	-177.8	-173.4	177.7	-89.9	0	0	113.2	Y75 K76 L82 F83 Q84	Y75-Q80 PolarHBondContact O-N 2.58Å; Y75-Q80 VanDerWaalsContact O-N 3.1Å; K76-Q80 WeakPolarHBondContact O-CB 3.34Å; Q80-L82 VanDerWaalsContact C-N 3.35Å; Q80-L82 PolarHBondContact O-N 3.39Å; Q80-F83 PolarHBondContact O-N 2.95Å; Q80-Q84 HydrophobicContact CG-CG 3.99Å; Q80-Q84 VanDerWaalsContact CG-NE2 3.31Å; Q80-Q84 VanDerWaalsContact O-CB 3.25Å; Q80-Q84 WeakPolarHBondContact O-CB 3.38Å; Q80-Q84 VanDerWaalsContact O-CG 3.29Å; Q80-Q84 WeakPolarHBondContact O-CG 3.23Å; Q80-Q84 PolarHBondContact O-N 2.88Å
81	P	96.8	Very high	95.6	Very high	50 Å²	50	37.1 Å²	37.1	33%	0.325	20%	0.195	S	C	.	.	H	α-helix	trans	-60	-40.3	175	-25.9	37.5	0	0	0	113.8	F79 F85 L297	F79-P81 VanDerWaalsContact C-CD 3.44Å; F79-P81 VanDerWaalsContact C-N 3.29Å; P81-F85 PolarHBondContact O-N 3.17Å; P81-L297 HydrophobicContact CB-CD2 4.05Å; P81-L297 HydrophobicContact CG-CD2 3.79Å
82	L	97.6	Very high	95.3	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-48.6	176.9	176	66.7	0	0	0	110.9	F79 Q80 Q84 F85 M88 Q296 P300 L303	F79-L82 WeakPolarHBondContact O-CB 3.08Å; F79-L82 PolarHBondContact O-N 3.17Å; Q80-L82 VanDerWaalsContact C-N 3.35Å; Q80-L82 PolarHBondContact O-N 3.39Å; L82-Q84 VanDerWaalsContact C-N 3.31Å; L82-Q84 PolarHBondContact O-N 2.86Å; L82-F85 WeakPolarHBondContact O-CB 3.41Å; L82-F85 PolarHBondContact O-N 2.85Å; L82-F85 VanDerWaalsContact O-N 3.13Å; L82-M88 HydrophobicContact CD1-CE 3.79Å; L82-M88 HydrophobicContact CD2-CE 4.13Å; L82-M88 HydrophobicContact CG-CE 3.84Å; L82-M88 VanDerWaalsContact O-CB 3.28Å; L82-M88 WeakPolarHBondContact O-CB 3.46Å; L82-M88 WeakPolarHBondContact O-CG 3.39Å; L82-Q296 HydrophobicContact CB-CB 4.39Å; L82-Q296 HydrophobicContact CD2-CB 4.15Å; L82-P300 HydrophobicContact CD1-CB 4.03Å; L82-L303 HydrophobicContact CD1-CB 4.47Å; L82-L303 HydrophobicContact CD1-CD2 4.07Å; L82-L303 HydrophobicContact CD1-CG 4.36Å; L82-L303 HydrophobicContact CD2-CD2 3.88Å
83	F	95.9	Very high	94.9	Very high	10 Å²	10	42.8 Å²	42.8	4%	0.044	22%	0.221	C	C	.	.	H	α-helix	trans	-72.9	-23.8	-175.5	-80	-102.8	0	0	0	112.6	I65 T67 F79 Q80 F85 Q89 I92 R97 H99	I65-F83 HydrophobicContact CG2-CE1 4.05Å; I65-F83 HydrophobicContact CG2-CZ 3.93Å; T67-F83 HydrophobicContact CG2-CE1 4.49Å; T67-F83 HydrophobicContact CG2-CE2 3.8Å; T67-F83 HydrophobicContact CG2-CZ 3.59Å; F79-F83 HydrophobicContact CB-CD2 3.88Å; F79-F83 HydrophobicContact CB-CE2 4.09Å; F79-F83 HydrophobicContact CD1-CE2 4.04Å; F79-F83 HydrophobicContact CG-CE2 4.31Å; F79-F83 WeakPolarHBondContact O-CD2 3.37Å; F79-F83 PolarHBondContact O-N 3.26Å; Q80-F83 PolarHBondContact O-N 2.95Å; F83-F85 VanDerWaalsContact C-N 3.34Å; F83-Q89 PolarHBondContact O-NE2 3.35Å; F83-I92 HydrophobicContact CB-CD1 4.32Å; F83-I92 HydrophobicContact CD1-CD1 3.89Å; F83-I92 HydrophobicContact CD1-CG2 3.88Å; F83-I92 HydrophobicContact CE1-CG2 3.89Å; F83-I92 WeakPolarHBondContact O-CD1 3.34Å; F83-R97 HydrophobicContact CD1-CG 4.22Å; F83-R97 HydrophobicContact CE1-CG 4.08Å; F83-H99 AromaticContact CD1-CE1 3.83Å; F83-H99 AromaticContact CD2-CE1 3.93Å; F83-H99 AromaticContact CE1-CE1 3.92Å; F83-H99 AromaticContact CG-CE1 3.84Å
84	Q	94.2	Very high	94.5	Very high	123 Å²	123	44.5 Å²	44.5	58%	0.575	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-4	171.3	-69.5	179	-15.5	0	0	113.6	Q80 L82 G86	Q80-Q84 HydrophobicContact CG-CG 3.99Å; Q80-Q84 VanDerWaalsContact CG-NE2 3.31Å; Q80-Q84 VanDerWaalsContact O-CB 3.25Å; Q80-Q84 WeakPolarHBondContact O-CB 3.38Å; Q80-Q84 VanDerWaalsContact O-CG 3.29Å; Q80-Q84 WeakPolarHBondContact O-CG 3.23Å; Q80-Q84 PolarHBondContact O-N 2.88Å; L82-Q84 VanDerWaalsContact C-N 3.31Å; L82-Q84 PolarHBondContact O-N 2.86Å; Q84-G86 PolarHBondContact O-N 2.8Å
85	F	95	Very high	94.3	Very high	69 Å²	69	43.2 Å²	43.2	30%	0.303	22%	0.223	S	C	.	.	S	Bend	trans	-65	135	176.4	-170.3	-109.7	0	0	0	110.7	P81 L82 F83 D87 M88 Q89 P300 G301	P81-F85 PolarHBondContact O-N 3.17Å; L82-F85 WeakPolarHBondContact O-CB 3.41Å; L82-F85 PolarHBondContact O-N 2.85Å; L82-F85 VanDerWaalsContact O-N 3.13Å; F83-F85 VanDerWaalsContact C-N 3.34Å; F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 HydrophobicContact CD1-CB 3.95Å; F85-D87 HydrophobicContact CE1-CB 3.76Å; F85-D87 PolarHBondContact O-N 2.89Å; F85-M88 HydrophobicContact CB-CB 4.22Å; F85-M88 WeakPolarHBondContact O-CA 3.46Å; F85-M88 WeakPolarHBondContact O-CB 3.48Å; F85-M88 PolarHBondContact O-N 3.12Å; F85-Q89 PolarHBondContact O-N 2.79Å; F85-P300 HydrophobicContact CB-CB 4.32Å; F85-P300 HydrophobicContact CD2-CB 4.14Å; F85-P300 HydrophobicContact CD2-CG 4.01Å; F85-P300 HydrophobicContact CE2-CG 4.25Å; F85-P300 HydrophobicContact CG-CB 4.08Å; F85-P300 HydrophobicContact CG-CG 4.45Å; F85-G301 VanDerWaalsContact CE1-CA 3.44Å
86	G	93.1	Very high	94.2	Very high	50 Å²	50	42.8 Å²	42.8	52%	0.515	22%	0.221	S	C	.	.	H	α-helix	trans	-54	-45.3	-171.1	0	0	0	0	0	113.8	Q84 M88 Q89	Q84-G86 PolarHBondContact O-N 2.8Å; G86-M88 VanDerWaalsContact C-N 3.28Å; G86-M88 PolarHBondContact O-N 2.81Å; G86-Q89 WeakPolarHBondContact O-CB 3.45Å; G86-Q89 PolarHBondContact O-N 2.93Å
87	D	92.8	Very high	94.1	Very high	81 Å²	81	40.3 Å²	40.3	43%	0.433	21%	0.21	S	C	.	.	H	α-helix	trans	-69.4	-27	179.1	-61.6	-13.1	0	0	0	112.3	F85 Q89 E90 T304	F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 HydrophobicContact CD1-CB 3.95Å; F85-D87 HydrophobicContact CE1-CB 3.76Å; F85-D87 PolarHBondContact O-N 2.89Å; D87-Q89 VanDerWaalsContact C-N 3.34Å; D87-E90 PolarHBondContact O-N 3.07Å; D87-T304 HydrophobicContact CB-CG2 3.81Å
88	M	95	Very high	94.2	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-72.3	-32.1	178.8	-176.2	57.9	80.7	0	0	110.8	L82 F85 G86 E90 I91 I92 T304 F307	L82-M88 HydrophobicContact CD1-CE 3.79Å; L82-M88 HydrophobicContact CD2-CE 4.13Å; L82-M88 HydrophobicContact CG-CE 3.84Å; L82-M88 VanDerWaalsContact O-CB 3.28Å; L82-M88 WeakPolarHBondContact O-CB 3.46Å; L82-M88 WeakPolarHBondContact O-CG 3.39Å; F85-M88 HydrophobicContact CB-CB 4.22Å; F85-M88 WeakPolarHBondContact O-CA 3.46Å; F85-M88 WeakPolarHBondContact O-CB 3.48Å; F85-M88 PolarHBondContact O-N 3.12Å; G86-M88 VanDerWaalsContact C-N 3.28Å; G86-M88 PolarHBondContact O-N 2.81Å; M88-E90 VanDerWaalsContact C-N 3.26Å; M88-E90 PolarHBondContact O-N 3.29Å; M88-I91 WeakPolarHBondContact O-CB 3.41Å; M88-I91 PolarHBondContact O-N 2.84Å; M88-I91 HydrophobicContact SD-CB 4.23Å; M88-I91 HydrophobicContact SD-CD1 4.04Å; M88-I92 HydrophobicContact CG-CD1 4.49Å; M88-I92 HydrophobicContact CG-CG2 3.86Å; M88-I92 WeakPolarHBondContact O-CG1 3.36Å; M88-I92 PolarHBondContact O-N 3.04Å; M88-I92 HydrophobicContact SD-CG2 3.69Å; M88-T304 HydrophobicContact CB-CG2 3.96Å; M88-T304 HydrophobicContact CE-CG2 4.06Å; M88-T304 HydrophobicContact SD-CG2 4.33Å; M88-F307 HydrophobicContact CE-CB 4.43Å; M88-F307 HydrophobicContact CE-CD1 3.74Å; M88-F307 HydrophobicContact CE-CE1 4.45Å; M88-F307 HydrophobicContact CE-CG 4.4Å; M88-F307 HydrophobicContact SD-CD1 3.79Å; M88-F307 HydrophobicContact SD-CE1 4.14Å
89	Q	91.3	Very high	94.2	Very high	81 Å²	81	40 Å²	40	38%	0.379	21%	0.207	S	C	.	.	H	α-helix	trans	-57.2	-38.9	175.8	-66.5	-67.5	-31.2	0	0	112.2	F83 F85 G86 D87 I91 I92 Q93	F83-Q89 PolarHBondContact O-NE2 3.35Å; F85-Q89 PolarHBondContact O-N 2.79Å; G86-Q89 WeakPolarHBondContact O-CB 3.45Å; G86-Q89 PolarHBondContact O-N 2.93Å; D87-Q89 VanDerWaalsContact C-N 3.34Å; Q89-I91 PolarHBondContact O-N 3.5Å; Q89-I92 PolarHBondContact O-N 3.44Å; Q89-Q93 WeakPolarHBondContact O-CB 3.38Å; Q89-Q93 WeakPolarHBondContact O-CG 3.48Å; Q89-Q93 PolarHBondContact O-N 2.96Å; Q89-Q93 VanDerWaalsContact O-N 3.12Å
90	E	89.9	Confident	94.2	Very high	106 Å²	106	40.1 Å²	40.1	50%	0.495	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-29.3	177	-62.3	-169.4	171.3	0	0	113	D87 M88 Q93 M317	D87-E90 PolarHBondContact O-N 3.07Å; M88-E90 VanDerWaalsContact C-N 3.26Å; M88-E90 PolarHBondContact O-N 3.29Å; E90-Q93 WeakPolarHBondContact O-CG 3.28Å; E90-Q93 PolarHBondContact O-NE2 3.35Å; E90-M317 WeakPolarHBondContact O-CE 3.44Å
91	I	91.4	Very high	94.3	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-81	-57.1	178.2	-58.6	174.5	0	0	0	109.5	M88 Q89 Q93 N94 F95 T304 F307 K308 L311	M88-I91 WeakPolarHBondContact O-CB 3.41Å; M88-I91 PolarHBondContact O-N 2.84Å; M88-I91 HydrophobicContact SD-CB 4.23Å; M88-I91 HydrophobicContact SD-CD1 4.04Å; Q89-I91 PolarHBondContact O-N 3.5Å; I91-Q93 VanDerWaalsContact C-N 3.3Å; I91-Q93 PolarHBondContact O-N 3.2Å; I91-N94 PolarHBondContact O-N 3.01Å; I91-F95 HydrophobicContact CG2-CE2 4.49Å; I91-F95 WeakPolarHBondContact O-CD2 3.36Å; I91-T304 HydrophobicContact CD1-CG2 3.72Å; I91-F307 HydrophobicContact CD1-CD1 4.21Å; I91-F307 HydrophobicContact CG2-CD1 4.16Å; I91-F307 HydrophobicContact CG2-CE1 4.02Å; I91-K308 HydrophobicContact CD1-CB 3.76Å; I91-K308 HydrophobicContact CD1-CG 4.44Å; I91-K308 HydrophobicContact CG1-CB 4.48Å; I91-L311 HydrophobicContact CG2-CD1 3.26Å
92	I	90.9	Very high	94.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-75.3	-15.2	-166.3	69.8	176.6	0	0	0	113.6	I65 F83 M88 Q89 N94 F95 R97	I65-I92 HydrophobicContact CD1-CG2 4.24Å; F83-I92 HydrophobicContact CB-CD1 4.32Å; F83-I92 HydrophobicContact CD1-CD1 3.89Å; F83-I92 HydrophobicContact CD1-CG2 3.88Å; F83-I92 HydrophobicContact CE1-CG2 3.89Å; F83-I92 WeakPolarHBondContact O-CD1 3.34Å; M88-I92 HydrophobicContact CG-CD1 4.49Å; M88-I92 HydrophobicContact CG-CG2 3.86Å; M88-I92 WeakPolarHBondContact O-CG1 3.36Å; M88-I92 PolarHBondContact O-N 3.04Å; M88-I92 HydrophobicContact SD-CG2 3.69Å; Q89-I92 PolarHBondContact O-N 3.44Å; I92-N94 PolarHBondContact O-N 2.87Å; I92-F95 PolarHBondContact O-N 3.35Å; I92-F95 VanDerWaalsContact O-N 3.07Å; I92-R97 HydrophobicContact CB-CG 4.29Å
93	Q	88.7	Confident	94.5	Very high	121 Å²	121	35 Å²	35	57%	0.565	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.3	169.1	65.3	178.5	-19.9	0	0	113.4	K59 Q89 E90 I91	K59-Q93 VanDerWaalsContact CE-O 3.28Å; K59-Q93 WeakPolarHBondContact CE-O 3.48Å; K59-Q93 PolarHBondContact NZ-O 3.3Å; Q89-Q93 WeakPolarHBondContact O-CB 3.38Å; Q89-Q93 WeakPolarHBondContact O-CG 3.48Å; Q89-Q93 PolarHBondContact O-N 2.96Å; Q89-Q93 VanDerWaalsContact O-N 3.12Å; E90-Q93 WeakPolarHBondContact O-CG 3.28Å; E90-Q93 PolarHBondContact O-NE2 3.35Å; I91-Q93 VanDerWaalsContact C-N 3.3Å; I91-Q93 PolarHBondContact O-N 3.2Å
94	N	89.3	Confident	94.6	Very high	42 Å²	42	34.7 Å²	34.7	23%	0.225	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1	178.9	-67.8	-55.6	0	0	0	114.7	K59 I91 I92 M317	K59-N94 PolarHBondContact NZ-OD1 3.05Å; I91-N94 PolarHBondContact O-N 3.01Å; I92-N94 PolarHBondContact O-N 2.87Å; N94-M317 HydrophobicContact CB-SD 3.97Å; N94-M317 PolarHBondContact ND2-SD 3.17Å
95	F	93.6	Very high	94.8	Very high	3 Å²	3	29 Å²	29	1%	0.013	15%	0.153	C	C	.	.	S	Bend	trans	-133.5	149.9	-175.4	-62.3	-92.3	0	0	0	110.5	P63 I65 I91 I92 R97 I141 L311 Y316 M317	P63-F95 HydrophobicContact CG-CE1 4.3Å; P63-F95 WeakPolarHBondContact O-CD1 3.44Å; I65-F95 HydrophobicContact CD1-CB 3.67Å; I65-F95 HydrophobicContact CD1-CD1 4.3Å; I65-F95 HydrophobicContact CD1-CD2 3.95Å; I65-F95 HydrophobicContact CD1-CG 3.72Å; I65-F95 HydrophobicContact CG1-CB 3.87Å; I65-F95 HydrophobicContact CG1-CD1 4.16Å; I65-F95 HydrophobicContact CG1-CG 4Å; I91-F95 HydrophobicContact CG2-CE2 4.49Å; I91-F95 WeakPolarHBondContact O-CD2 3.36Å; I92-F95 PolarHBondContact O-N 3.35Å; I92-F95 VanDerWaalsContact O-N 3.07Å; F95-R97 WeakPolarHBondContact O-CD 3.4Å; F95-I141 HydrophobicContact CE1-CD1 4.22Å; F95-L311 HydrophobicContact CE2-CD1 4.02Å; F95-L311 HydrophobicContact CZ-CD1 4.22Å; F95-L311 HydrophobicContact CZ-CD2 4.3Å; F95-Y316 HydrophobicContact CE1-CD2 4.43Å; F95-Y316 HydrophobicContact CE1-CG 4.39Å; F95-Y316 HydrophobicContact CZ-CD2 4.43Å; F95-Y316 HydrophobicContact CZ-CG 4.14Å; F95-M317 HydrophobicContact CE2-CG 4.25Å; F95-M317 HydrophobicContact CE2-SD 4.31Å
96	V	95.4	Very high	94.9	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.024	15%	0.146	C	C	.	.			trans	-76.9	140	160.7	176.9	0	0	0	0	107.9	V54 Y55 T57 P58 A64 I65 V98 F137	V54-V96 HydrophobicContact CG1-CG1 3.66Å; Y55-V96 WeakPolarHBondContact O-CA 3.48Å; T57-V96 VanDerWaalsContact O-CG2 3.3Å; T57-V96 WeakPolarHBondContact O-CG2 3.35Å; P58-V96 HydrophobicContact CB-CG2 4.22Å; P58-V96 HydrophobicContact CG-CG2 4.06Å; A64-V96 CarbonylContact C-O 3.43Å; A64-V96 WeakPolarHBondContact CA-O 3.42Å; A64-V96 HydrophobicContact CB-CB 4.4Å; I65-V96 PolarHBondContact N-O 3.49Å; V96-V98 HydrophobicContact CG1-CG2 4.28Å; V96-F137 HydrophobicContact CB-CE1 4.32Å; V96-F137 HydrophobicContact CB-CE2 4.4Å; V96-F137 HydrophobicContact CB-CZ 3.67Å; V96-F137 HydrophobicContact CG1-CE2 3.92Å; V96-F137 HydrophobicContact CG1-CZ 3.63Å; V96-F137 HydrophobicContact CG2-CE1 4.43Å; V96-F137 HydrophobicContact CG2-CZ 3.87Å
97	R	96.3	Very high	94.8	Very high	23 Å²	23	31.7 Å²	31.7	9%	0.087	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.9	176.5	-55.6	85.7	67.4	178.2	0.4	108	V54 Y55 I65 F83 I92 F95	V54-R97 CarbonylContact C-O 3.6Å; V54-R97 VanDerWaalsContact CA-O 3.29Å; V54-R97 WeakPolarHBondContact CA-O 3.43Å; Y55-R97 PolarHBondContact N-O 3.01Å; Y55-R97 PolarHBondContact O-N 3.41Å; I65-R97 CarbonylContact O-C 3.52Å; I65-R97 WeakPolarHBondContact O-CA 3.43Å; F83-R97 HydrophobicContact CD1-CG 4.22Å; F83-R97 HydrophobicContact CE1-CG 4.08Å; I92-R97 HydrophobicContact CB-CG 4.29Å; F95-R97 WeakPolarHBondContact O-CD 3.4Å
98	V	98.2	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	100.9	177.1	-176.6	0	0	0	0	106.9	F52 V54 A64 I65 L66 T67 V96 V100 V131 L135 F137	F52-V98 HydrophobicContact CB-CG1 4.29Å; F52-V98 HydrophobicContact CD2-CG1 3.99Å; F52-V98 HydrophobicContact CG-CG1 4.38Å; V54-V98 HydrophobicContact CG2-CG2 4.48Å; A64-V98 HydrophobicContact CB-CG2 4.04Å; I65-V98 PolarHBondContact O-N 3.31Å; L66-V98 CarbonylContact C-O 3.58Å; L66-V98 VanDerWaalsContact CA-O 3.31Å; L66-V98 WeakPolarHBondContact CA-O 3.46Å; L66-V98 HydrophobicContact CD1-CG1 4.44Å; L66-V98 HydrophobicContact CG-CB 4.45Å; T67-V98 PolarHBondContact N-O 3.49Å; V96-V98 HydrophobicContact CG1-CG2 4.28Å; V98-V100 HydrophobicContact CG1-CG2 4.35Å; V98-V131 HydrophobicContact CG1-CG1 3.91Å; V98-L135 HydrophobicContact CB-CD1 4.44Å; V98-L135 HydrophobicContact CG1-CD1 3.89Å; V98-L135 HydrophobicContact CG2-CD1 3.62Å; V98-F137 HydrophobicContact CG2-CE2 4.31Å
99	H	98.6	Very high	95	Very high	7 Å²	7	32 Å²	32	3%	0.032	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	106.2	179.7	-67.5	-58.1	0	0	0	109.2	F52 T53 Y55 T67 Y75 F83	F52-H99 CarbonylContact C-O 3.57Å; F52-H99 WeakPolarHBondContact CA-O 3.19Å; F52-H99 WeakPolarHBondContact CB-O 3.5Å; T53-H99 PolarHBondContact N-O 3.01Å; T53-H99 PolarHBondContact O-N 3.23Å; Y55-H99 AromaticContact CD2-CD2 3.65Å; Y55-H99 AromaticContact CE2-CD2 3.68Å; T67-H99 WeakPolarHBondContact CG2-ND1 3.4Å; T67-H99 WeakPolarHBondContact OG1-CA 3.12Å; T67-H99 PolarHBondContact OG1-ND1 2.93Å; Y75-H99 HydrophobicContact CD1-CB 4.36Å; Y75-H99 HydrophobicContact CD2-CB 3.75Å; Y75-H99 AromaticContact CD2-CG 3.87Å; Y75-H99 HydrophobicContact CE2-CB 4.47Å; Y75-H99 HydrophobicContact CG-CB 3.69Å; F83-H99 AromaticContact CD1-CE1 3.83Å; F83-H99 AromaticContact CD2-CE1 3.93Å; F83-H99 AromaticContact CE1-CE1 3.92Å; F83-H99 AromaticContact CG-CE1 3.84Å
100	V	98.8	Very high	95.2	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.8	179.8	-177.1	0	0	0	0	109.3	V50 F52 L66 T67 Y68 H69 V98	V50-V100 HydrophobicContact CG2-CG1 3.71Å; F52-V100 HydrophobicContact CB-CG2 4.23Å; L66-V100 HydrophobicContact CD1-CG2 4.26Å; L66-V100 HydrophobicContact CD2-CG2 4.09Å; L66-V100 HydrophobicContact CG-CG2 4.07Å; T67-V100 PolarHBondContact O-N 2.75Å; Y68-V100 HydrophobicContact CD2-CB 4.19Å; Y68-V100 HydrophobicContact CD2-CG1 4.09Å; Y68-V100 HydrophobicContact CE2-CB 4.37Å; Y68-V100 HydrophobicContact CE2-CG1 3.76Å; H69-V100 PolarHBondContact CD2-O 3.31Å; V98-V100 HydrophobicContact CG1-CG2 4.35Å
101	D	98.7	Very high	95.6	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.3	163.9	-71.8	-43.1	0	0	0	108.7	V50 T51 H69 N74 Y75 E106	V50-D101 WeakPolarHBondContact CG2-O 3.49Å; T51-D101 PolarHBondContact O-N 3.46Å; H69-D101 IonicContact CD2-OD1 2.83Å; H69-D101 IonicContact NE2-OD1 3.88Å; N74-D101 WeakPolarHBondContact CB-OD1 3.19Å; Y75-D101 WeakPolarHBondContact CD1-OD1 3.27Å; Y75-D101 WeakPolarHBondContact CD1-OD2 3.47Å; Y75-D101 PolarHBondContact N-OD1 2.89Å; D101-E106 HydrophobicContact CB-CB 3.97Å
102	A	98.8	Very high	95.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-58.3	147.9	172	0	0	0	0	0	109.3	Y68 H69 G104 M105 Y233	Y68-A102 HydrophobicContact CE1-CB 3.92Å; H69-A102 PolarHBondContact NE2-N 3.13Å; A102-G104 PolarHBondContact O-N 3.43Å; A102-G104 VanDerWaalsContact O-N 3.17Å; A102-M105 HydrophobicContact CB-CB 4.48Å; A102-M105 HydrophobicContact CB-CG 3.79Å; A102-M105 VanDerWaalsContact O-CB 3.26Å; A102-M105 WeakPolarHBondContact O-CB 3.35Å; A102-M105 VanDerWaalsContact O-CG 3.28Å; A102-M105 WeakPolarHBondContact O-CG 3.42Å; A102-M105 PolarHBondContact O-N 3.49Å; A102-Y233 HydrophobicContact CB-CD1 4.24Å; A102-Y233 HydrophobicContact CB-CE1 3.91Å; A102-Y233 HydrophobicContact CB-CE2 4.43Å
103	P	98.6	Very high	96.2	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.019	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	124.1	-174.8	-27.9	33.5	0	0	0	112.6	M105 F112 Y118 L124 M127	P103-M105 VanDerWaalsContact C-N 3.34Å; P103-M105 VanDerWaalsContact O-CE 3.31Å; P103-M105 WeakPolarHBondContact O-CE 3.34Å; P103-F112 HydrophobicContact CB-CZ 4.41Å; P103-Y118 HydrophobicContact CB-CE2 4.22Å; P103-Y118 WeakPolarHBondContact O-CE2 3.33Å; P103-Y118 PolarHBondContact O-OH 3.46Å; P103-L124 HydrophobicContact CG-CD2 3.8Å; P103-M127 HydrophobicContact CG-CE 3.75Å; P103-M127 HydrophobicContact CG-SD 3.71Å
104	G	97.8	Very high	96.4	Very high	3 Å²	3	40.7 Å²	40.7	3%	0.031	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	8.7	178.5	0	0	0	0	0	115.2	A102 E106 A109 N226 N229	A102-G104 PolarHBondContact O-N 3.43Å; A102-G104 VanDerWaalsContact O-N 3.17Å; G104-E106 WeakPolarHBondContact CA-OE2 3.39Å; G104-E106 PolarHBondContact N-OE2 2.82Å; G104-A109 WeakPolarHBondContact O-CB 3.4Å; G104-N226 PolarHBondContact O-ND2 2.8Å; G104-N229 PolarHBondContact O-ND2 3.12Å; G104-N229 VanDerWaalsContact O-ND2 3.08Å
105	M	98.3	Very high	96.7	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	26%	0.259	C	S	.	.			trans	-103.1	-11.5	176.6	-49.6	-55.2	146.1	0	0	113	N74 A102 P103 Y118 N229 I230 Y233	N74-M105 HydrophobicContact CB-CB 4.46Å; N74-M105 WeakPolarHBondContact CB-O 3.42Å; N74-M105 PolarHBondContact ND2-O 3.21Å; A102-M105 HydrophobicContact CB-CB 4.48Å; A102-M105 HydrophobicContact CB-CG 3.79Å; A102-M105 VanDerWaalsContact O-CB 3.26Å; A102-M105 WeakPolarHBondContact O-CB 3.35Å; A102-M105 VanDerWaalsContact O-CG 3.28Å; A102-M105 WeakPolarHBondContact O-CG 3.42Å; A102-M105 PolarHBondContact O-N 3.49Å; P103-M105 VanDerWaalsContact C-N 3.34Å; P103-M105 VanDerWaalsContact O-CE 3.31Å; P103-M105 WeakPolarHBondContact O-CE 3.34Å; M105-Y118 HydrophobicContact CE-CE2 4.16Å; M105-Y118 WeakPolarHBondContact CE-OH 3.39Å; M105-N229 HydrophobicContact CE-CB 4.06Å; M105-N229 VanDerWaalsContact CE-O 3.23Å; M105-N229 WeakPolarHBondContact CE-O 3.41Å; M105-I230 HydrophobicContact SD-CB 4.46Å; M105-I230 HydrophobicContact SD-CG1 3.77Å; M105-Y233 VanDerWaalsContact CE-CB 3.44Å; M105-Y233 HydrophobicContact CE-CD1 4.23Å; M105-Y233 HydrophobicContact CE-CG 4.15Å; M105-Y233 HydrophobicContact CG-CD1 4.34Å; M105-Y233 HydrophobicContact SD-CD1 4.41Å
106	E	96.9	Very high	96.8	Very high	37 Å²	37	44.5 Å²	44.5	17%	0.173	27%	0.271	C	S	.	.	S	Bend	trans	-61.5	155	175.5	71.3	-78.7	-175.3	0	0	111.8	T51 D101 G104 G108 A109	T51-E106 HydrophobicContact CG2-CB 3.89Å; T51-E106 HydrophobicContact CG2-CG 4.14Å; D101-E106 HydrophobicContact CB-CB 3.97Å; G104-E106 WeakPolarHBondContact CA-OE2 3.39Å; G104-E106 PolarHBondContact N-OE2 2.82Å; E106-G108 PolarHBondContact O-N 3.1Å; E106-A109 VanDerWaalsContact CD-CB 3.5Å; E106-A109 HydrophobicContact CG-CB 3.97Å; E106-A109 VanDerWaalsContact O-CB 3.25Å; E106-A109 WeakPolarHBondContact O-CB 3.23Å; E106-A109 PolarHBondContact O-N 3.42Å; E106-A109 VanDerWaalsContact O-N 3.09Å; E106-A109 WeakPolarHBondContact OE1-CB 3.32Å
107	E	92.7	Very high	96.9	Very high	138 Å²	138	52.4 Å²	52.4	65%	0.645	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	125.5	-179	-171	176.1	-177.4	0	0	111.3	K76 A109	K76-E107 IonicContact NZ-OE2 2.87Å; K76-E107 PolarHBondContact NZ-OE2 3.36Å; E107-A109 VanDerWaalsContact C-N 3.31Å
108	G	93.8	Very high	97	Very high	77 Å²	77	52.6 Å²	52.6	79%	0.794	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	13.5	-177.1	0	0	0	0	0	114.3	E106	E106-G108 PolarHBondContact O-N 3.1Å
109	A	96.4	Very high	97	Very high	13 Å²	13	52.8 Å²	52.8	11%	0.107	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-54.2	134.5	175.2	0	0	0	0	0	111.9	G104 E106 E107	G104-A109 WeakPolarHBondContact O-CB 3.4Å; E106-A109 VanDerWaalsContact CD-CB 3.5Å; E106-A109 HydrophobicContact CG-CB 3.97Å; E106-A109 VanDerWaalsContact O-CB 3.25Å; E106-A109 WeakPolarHBondContact O-CB 3.23Å; E106-A109 PolarHBondContact O-N 3.42Å; E106-A109 VanDerWaalsContact O-N 3.09Å; E106-A109 WeakPolarHBondContact OE1-CB 3.32Å; E107-A109 VanDerWaalsContact C-N 3.31Å
110	P	96.4	Very high	97	Very high	99 Å²	99	54.7 Å²	54.7	64%	0.643	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-66.7	145.7	171.1	29.5	-33.7	0	0	0	110.4	N229	P110-N229 PolarHBondContact O-ND2 3.24Å
111	V	97.4	Very high	97	Very high	71 Å²	71	54.8 Å²	54.8	43%	0.43	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-69.1	132.8	173.3	-177.4	0	0	0	0	109.3	D228 N229	V111-D228 HydrophobicContact CG1-CB 3.89Å; V111-N229 WeakPolarHBondContact CA-OD1 3.27Å
112	F	97.7	Very high	97	Very high	47 Å²	47	56.2 Å²	56.2	21%	0.206	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-65.7	149.6	176.7	-72.4	-60	0	0	0	111.5	P103 Y116 Y118 N229 L232	P103-F112 HydrophobicContact CB-CZ 4.41Å; F112-Y116 HydrophobicContact CB-CD1 4.01Å; F112-Y116 HydrophobicContact CB-CD2 4.33Å; F112-Y116 HydrophobicContact CB-CG 3.81Å; F112-Y116 AromaticContact CD1-CD1 3.95Å; F112-Y116 HydrophobicContact CD1-CD1 3.95Å; F112-Y116 AromaticContact CD1-CD2 3.89Å; F112-Y116 HydrophobicContact CD1-CD2 3.89Å; F112-Y116 AromaticContact CD1-CE1 3.81Å; F112-Y116 HydrophobicContact CD1-CE1 3.81Å; F112-Y116 AromaticContact CD1-CE2 3.76Å; F112-Y116 HydrophobicContact CD1-CE2 3.76Å; F112-Y116 AromaticContact CD1-CG 3.99Å; F112-Y116 HydrophobicContact CD1-CG 3.99Å; F112-Y116 AromaticContact CD1-CZ 3.72Å; F112-Y116 HydrophobicContact CD2-CD1 4.09Å; F112-Y116 HydrophobicContact CD2-CE1 4.16Å; F112-Y116 HydrophobicContact CE1-CD1 4.47Å; F112-Y116 AromaticContact CE1-CE1 3.88Å; F112-Y116 HydrophobicContact CE1-CE1 3.88Å; F112-Y116 HydrophobicContact CE1-CE2 4.04Å; F112-Y116 AromaticContact CE1-CZ 3.64Å; F112-Y116 HydrophobicContact CE2-CE1 4.23Å; F112-Y116 AromaticContact CG-CD1 3.75Å; F112-Y116 HydrophobicContact CG-CD1 3.75Å; F112-Y116 HydrophobicContact CG-CD2 4.3Å; F112-Y116 AromaticContact CG-CE1 3.96Å; F112-Y116 HydrophobicContact CG-CE1 3.96Å; F112-Y116 AromaticContact CG-CG 3.93Å; F112-Y116 HydrophobicContact CG-CG 3.93Å; F112-Y116 HydrophobicContact CZ-CE1 4.1Å; F112-Y118 HydrophobicContact CD2-CD2 4.29Å; F112-Y118 HydrophobicContact CD2-CE2 4.4Å; F112-Y118 HydrophobicContact CE2-CD2 4.03Å; F112-Y118 AromaticContact CE2-CE2 3.77Å; F112-Y118 HydrophobicContact CE2-CE2 3.77Å; F112-N229 HydrophobicContact CD2-CB 4.17Å; F112-N229 VanDerWaalsContact CD2-CG 3.49Å; F112-N229 VanDerWaalsContact CD2-OD1 3.27Å; F112-N229 WeakPolarHBondContact CD2-OD1 3.5Å; F112-N229 HydrophobicContact CE2-CB 4.46Å; F112-N229 PolarHBondContact N-OD1 3.32Å; F112-L232 HydrophobicContact CB-CD1 4.1Å; F112-L232 HydrophobicContact CD2-CD1 4.04Å; F112-L232 HydrophobicContact CG-CD1 4.48Å
113	P	97.1	Very high	97	Very high	91 Å²	91	59.3 Å²	59.3	59%	0.591	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-66.1	156.1	177.9	28.6	-35.1	0	0	0	111.7	G115 Y116	P113-G115 PolarHBondContact O-N 3.01Å; P113-Y116 HydrophobicContact CG-CD2 4.22Å; P113-Y116 WeakPolarHBondContact O-CB 3.44Å; P113-Y116 PolarHBondContact O-N 2.88Å
114	L	94.5	Very high	97	Very high	188 Å²	188	59.1 Å²	59.1	98%	0.984	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	132	175.6	-171.6	70.6	0	0	0	111	Y116	L114-Y116 VanDerWaalsContact C-N 3.32Å
115	G	93.8	Very high	97	Very high	59 Å²	59	59 Å²	59	61%	0.608	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	7	-178.5	0	0	0	0	0	114.7	P113 Q117	P113-G115 PolarHBondContact O-N 3.01Å; G115-Q117 PolarHBondContact O-N 2.81Å; G115-Q117 PolarHBondContact O-NE2 3.47Å; G115-Q117 VanDerWaalsContact O-NE2 3.12Å
116	Y	96.6	Very high	97	Very high	66 Å²	66	61.4 Å²	61.4	26%	0.259	36%	0.356	S	S	.	.			trans	-53.5	131.7	173	-174.3	-97.4	0	0	0	111.3	F112 P113 L114 Y118 L232	F112-Y116 HydrophobicContact CB-CD1 4.01Å; F112-Y116 HydrophobicContact CB-CD2 4.33Å; F112-Y116 HydrophobicContact CB-CG 3.81Å; F112-Y116 AromaticContact CD1-CD1 3.95Å; F112-Y116 HydrophobicContact CD1-CD1 3.95Å; F112-Y116 AromaticContact CD1-CD2 3.89Å; F112-Y116 HydrophobicContact CD1-CD2 3.89Å; F112-Y116 AromaticContact CD1-CE1 3.81Å; F112-Y116 HydrophobicContact CD1-CE1 3.81Å; F112-Y116 AromaticContact CD1-CE2 3.76Å; F112-Y116 HydrophobicContact CD1-CE2 3.76Å; F112-Y116 AromaticContact CD1-CG 3.99Å; F112-Y116 HydrophobicContact CD1-CG 3.99Å; F112-Y116 AromaticContact CD1-CZ 3.72Å; F112-Y116 HydrophobicContact CD2-CD1 4.09Å; F112-Y116 HydrophobicContact CD2-CE1 4.16Å; F112-Y116 HydrophobicContact CE1-CD1 4.47Å; F112-Y116 AromaticContact CE1-CE1 3.88Å; F112-Y116 HydrophobicContact CE1-CE1 3.88Å; F112-Y116 HydrophobicContact CE1-CE2 4.04Å; F112-Y116 AromaticContact CE1-CZ 3.64Å; F112-Y116 HydrophobicContact CE2-CE1 4.23Å; F112-Y116 AromaticContact CG-CD1 3.75Å; F112-Y116 HydrophobicContact CG-CD1 3.75Å; F112-Y116 HydrophobicContact CG-CD2 4.3Å; F112-Y116 AromaticContact CG-CE1 3.96Å; F112-Y116 HydrophobicContact CG-CE1 3.96Å; F112-Y116 AromaticContact CG-CG 3.93Å; F112-Y116 HydrophobicContact CG-CG 3.93Å; F112-Y116 HydrophobicContact CZ-CE1 4.1Å; P113-Y116 HydrophobicContact CG-CD2 4.22Å; P113-Y116 WeakPolarHBondContact O-CB 3.44Å; P113-Y116 PolarHBondContact O-N 2.88Å; L114-Y116 VanDerWaalsContact C-N 3.32Å; Y116-Y118 HydrophobicContact CD1-CD2 4.31Å; Y116-Y118 HydrophobicContact CE1-CD2 4.06Å; Y116-Y118 PolarHBondContact O-N 3.49Å; Y116-L232 HydrophobicContact CD1-CD1 4.27Å
117	Q	96.9	Very high	97.1	Very high	170 Å²	170	59.8 Å²	59.8	79%	0.794	35%	0.349	S	S	*	.			trans	-87.3	90.9	178.5	-62.9	-59.3	-58.1	0	0	108.8	G115	G115-Q117 PolarHBondContact O-N 2.81Å; G115-Q117 PolarHBondContact O-NE2 3.47Å; G115-Q117 VanDerWaalsContact O-NE2 3.12Å
118	Y	98.4	Very high	97.4	Very high	27 Å²	27	53.3 Å²	53.3	11%	0.106	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-67.6	141.2	179.5	-161.9	-94.9	0	0	0	111.5	P103 M105 F112 Y116 L124 L232 Y233	P103-Y118 HydrophobicContact CB-CE2 4.22Å; P103-Y118 WeakPolarHBondContact O-CE2 3.33Å; P103-Y118 PolarHBondContact O-OH 3.46Å; M105-Y118 HydrophobicContact CE-CE2 4.16Å; M105-Y118 WeakPolarHBondContact CE-OH 3.39Å; F112-Y118 HydrophobicContact CD2-CD2 4.29Å; F112-Y118 HydrophobicContact CD2-CE2 4.4Å; F112-Y118 HydrophobicContact CE2-CD2 4.03Å; F112-Y118 AromaticContact CE2-CE2 3.77Å; F112-Y118 HydrophobicContact CE2-CE2 3.77Å; Y116-Y118 HydrophobicContact CD1-CD2 4.31Å; Y116-Y118 HydrophobicContact CE1-CD2 4.06Å; Y116-Y118 PolarHBondContact O-N 3.49Å; Y118-L124 HydrophobicContact CE1-CD1 4.36Å; Y118-L232 HydrophobicContact CD1-CB 4.39Å; Y118-L232 HydrophobicContact CD2-CB 3.75Å; Y118-L232 HydrophobicContact CD2-CD1 4.2Å; Y118-L232 HydrophobicContact CE2-CB 4.49Å; Y118-L232 HydrophobicContact CG-CB 3.69Å; Y118-Y233 AromaticContact CE1-CD2 3.9Å; Y118-Y233 HydrophobicContact CE1-CD2 3.9Å; Y118-Y233 HydrophobicContact CE1-CG 4.23Å
119	P	98.5	Very high	97.6	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.019	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-60.2	139.8	-179.3	-21.8	31.7	0	0	0	112.8	Q123 L124 M127 S236	P119-Q123 HydrophobicContact CB-CB 3.96Å; P119-L124 HydrophobicContact CB-CD2 3.71Å; P119-L124 HydrophobicContact CB-CG 4Å; P119-L124 HydrophobicContact CG-CD2 4.07Å; P119-M127 HydrophobicContact CB-CE 4.07Å; P119-M127 HydrophobicContact CG-CE 3.56Å; P119-S236 WeakPolarHBondContact O-CB 3.49Å; P119-S236 PolarHBondContact O-OG 3Å
120	S	98.6	Very high	97.7	Very high	48 Å²	48	51.3 Å²	51.3	34%	0.336	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-65.3	160.1	166.6	62.5	0	0	0	0	111.3	D122 Q123 L124 S236	S120-D122 PolarHBondContact O-N 3Å; S120-Q123 CarbonylContact O-C 3.58Å; S120-Q123 WeakPolarHBondContact O-CA 3.32Å; S120-Q123 WeakPolarHBondContact O-CB 3.38Å; S120-Q123 PolarHBondContact O-N 3.26Å; S120-Q123 VanDerWaalsContact OG-CG 3.31Å; S120-Q123 WeakPolarHBondContact OG-CG 3.26Å; S120-Q123 PolarHBondContact OG-N 3.32Å; S120-Q123 PolarHBondContact OG-OE1 2.94Å; S120-L124 WeakPolarHBondContact O-CG 3.38Å; S120-L124 PolarHBondContact O-N 3.32Å; S120-S236 VanDerWaalsContact CA-OG 3.28Å; S120-S236 WeakPolarHBondContact CA-OG 3.31Å
121	L	98.6	Very high	97.8	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-58.1	-32	177.3	-58.6	-165.9	0	0	0	113.4	L124 A125 Y150 I151 Y233 S236 Y237 R240	L121-L124 HydrophobicContact CD2-CD1 3.94Å; L121-L124 PolarHBondContact O-N 2.87Å; L121-A125 PolarHBondContact O-N 3.4Å; L121-Y150 HydrophobicContact CB-CD1 3.75Å; L121-Y150 HydrophobicContact CB-CE1 3.6Å; L121-Y150 HydrophobicContact CD1-CD1 3.33Å; L121-Y150 HydrophobicContact CD1-CE1 3.73Å; L121-Y150 HydrophobicContact CD1-CG 3.8Å; L121-Y150 HydrophobicContact CG-CD1 4.22Å; L121-Y150 HydrophobicContact CG-CE1 4.34Å; L121-I151 HydrophobicContact CB-CG1 4.16Å; L121-I151 HydrophobicContact CD2-CD1 4.12Å; L121-I151 HydrophobicContact CD2-CG1 4.19Å; L121-Y233 HydrophobicContact CD2-CD2 4.49Å; L121-Y233 HydrophobicContact CD2-CE2 3.93Å; L121-S236 PolarHBondContact N-OG 2.93Å; L121-Y237 HydrophobicContact CD1-CD2 3.84Å; L121-R240 HydrophobicContact CD1-CB 3.6Å; L121-R240 HydrophobicContact CG-CB 4.25Å
122	D	98.4	Very high	97.8	Very high	34 Å²	34	43.7 Å²	43.7	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-42.3	174.9	-64.6	-17.7	0	0	0	110.8	S120 A125 D126 Y150 R154	S120-D122 PolarHBondContact O-N 3Å; D122-A125 WeakPolarHBondContact O-CB 3.35Å; D122-A125 PolarHBondContact O-N 3.06Å; D122-D126 PolarHBondContact O-N 2.65Å; D122-D126 VanDerWaalsContact O-N 3.11Å; D122-Y150 PolarHBondContact OD1-OH 3.14Å; D122-R154 IonicContact OD1-CZ 2.72Å; D122-R154 IonicContact OD1-NE 3.7Å; D122-R154 PolarHBondContact OD1-NE 3.2Å; D122-R154 IonicContact OD1-NH2 3.68Å
123	Q	98.7	Very high	97.7	Very high	65 Å²	65	48.1 Å²	48.1	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-68.7	-33.7	175.1	-69.8	168.3	-46.7	0	0	112.7	Y47 P119 S120 A125 D126 M127	Y47-Q123 HydrophobicContact CD1-CB 4.17Å; Y47-Q123 HydrophobicContact CD1-CG 4.01Å; Y47-Q123 HydrophobicContact CD2-CB 3.89Å; Y47-Q123 HydrophobicContact CD2-CG 4.39Å; Y47-Q123 WeakPolarHBondContact CD2-O 3.44Å; Y47-Q123 HydrophobicContact CE1-CB 4.25Å; Y47-Q123 HydrophobicContact CE1-CG 3.72Å; Y47-Q123 HydrophobicContact CE2-CB 3.97Å; Y47-Q123 HydrophobicContact CE2-CG 4.12Å; Y47-Q123 HydrophobicContact CG-CB 3.98Å; Y47-Q123 HydrophobicContact CG-CG 4.32Å; P119-Q123 HydrophobicContact CB-CB 3.96Å; S120-Q123 CarbonylContact O-C 3.58Å; S120-Q123 WeakPolarHBondContact O-CA 3.32Å; S120-Q123 WeakPolarHBondContact O-CB 3.38Å; S120-Q123 PolarHBondContact O-N 3.26Å; S120-Q123 VanDerWaalsContact OG-CG 3.31Å; S120-Q123 WeakPolarHBondContact OG-CG 3.26Å; S120-Q123 PolarHBondContact OG-N 3.32Å; S120-Q123 PolarHBondContact OG-OE1 2.94Å; Q123-A125 VanDerWaalsContact C-N 3.3Å; Q123-D126 WeakPolarHBondContact O-CB 3.36Å; Q123-D126 PolarHBondContact O-N 3.42Å; Q123-M127 WeakPolarHBondContact O-CG 3.29Å; Q123-M127 PolarHBondContact O-N 2.88Å
124	L	98.8	Very high	97.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-36.7	172.1	-68	177.6	0	0	0	111.4	P103 Y118 P119 S120 L121 D126 M127 I151 Y233	P103-L124 HydrophobicContact CG-CD2 3.8Å; Y118-L124 HydrophobicContact CE1-CD1 4.36Å; P119-L124 HydrophobicContact CB-CD2 3.71Å; P119-L124 HydrophobicContact CB-CG 4Å; P119-L124 HydrophobicContact CG-CD2 4.07Å; S120-L124 WeakPolarHBondContact O-CG 3.38Å; S120-L124 PolarHBondContact O-N 3.32Å; L121-L124 HydrophobicContact CD2-CD1 3.94Å; L121-L124 PolarHBondContact O-N 2.87Å; L124-D126 VanDerWaalsContact C-N 3.33Å; L124-M127 HydrophobicContact CD2-CE 4.05Å; L124-M127 HydrophobicContact CD2-SD 3.89Å; L124-M127 WeakPolarHBondContact O-CB 3.5Å; L124-M127 PolarHBondContact O-N 3.32Å; L124-I151 HydrophobicContact CB-CD1 3.93Å; L124-I151 HydrophobicContact CB-CG1 4.21Å; L124-I151 HydrophobicContact CB-CG2 4.35Å; L124-I151 HydrophobicContact CD1-CD1 3.7Å; L124-I151 HydrophobicContact CG-CD1 4.48Å; L124-Y233 HydrophobicContact CD1-CD2 3.96Å; L124-Y233 HydrophobicContact CD1-CE2 3.56Å
125	A	98.8	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-38.3	173.5	0	0	0	0	0	111.7	L121 D122 Q123 M127 I128 I151 R154	L121-A125 PolarHBondContact O-N 3.4Å; D122-A125 WeakPolarHBondContact O-CB 3.35Å; D122-A125 PolarHBondContact O-N 3.06Å; Q123-A125 VanDerWaalsContact C-N 3.3Å; A125-M127 PolarHBondContact O-N 3.13Å; A125-I128 WeakPolarHBondContact O-CB 3.34Å; A125-I128 PolarHBondContact O-N 3.12Å; A125-I128 VanDerWaalsContact O-N 3.17Å; A125-I151 HydrophobicContact CB-CG2 4.04Å; A125-I151 WeakPolarHBondContact CB-O 3.43Å; A125-R154 HydrophobicContact CB-CB 4Å; A125-R154 HydrophobicContact CB-CG 3.73Å
126	D	98.6	Very high	97.8	Very high	54 Å²	54	46.2 Å²	46.2	29%	0.289	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11	176.1	-70	-14.4	0	0	0	113.9	Y47 D122 Q123 L124 P129	Y47-D126 HydrophobicContact CE2-CB 3.71Å; Y47-D126 PolarHBondContact OH-OD2 3.41Å; D122-D126 PolarHBondContact O-N 2.65Å; D122-D126 VanDerWaalsContact O-N 3.11Å; Q123-D126 WeakPolarHBondContact O-CB 3.36Å; Q123-D126 PolarHBondContact O-N 3.42Å; L124-D126 VanDerWaalsContact C-N 3.33Å; D126-P129 WeakPolarHBondContact O-CD 3.38Å
127	M	98.7	Very high	97.6	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-25.6	172.4	-62.7	-177.4	170.9	0	0	113	T45 Y47 V50 P103 P119 Q123 L124 A125 C130 V131	T45-M127 HydrophobicContact CG2-CB 4.01Å; T45-M127 HydrophobicContact CG2-CG 4.04Å; Y47-M127 HydrophobicContact CD2-CG 4.43Å; Y47-M127 WeakPolarHBondContact O-CE 3.4Å; V50-M127 HydrophobicContact CB-SD 4.17Å; V50-M127 HydrophobicContact CG1-CB 4.47Å; P103-M127 HydrophobicContact CG-CE 3.75Å; P103-M127 HydrophobicContact CG-SD 3.71Å; P119-M127 HydrophobicContact CB-CE 4.07Å; P119-M127 HydrophobicContact CG-CE 3.56Å; Q123-M127 WeakPolarHBondContact O-CG 3.29Å; Q123-M127 PolarHBondContact O-N 2.88Å; L124-M127 HydrophobicContact CD2-CE 4.05Å; L124-M127 HydrophobicContact CD2-SD 3.89Å; L124-M127 WeakPolarHBondContact O-CB 3.5Å; L124-M127 PolarHBondContact O-N 3.32Å; A125-M127 PolarHBondContact O-N 3.13Å; M127-C130 WeakPolarHBondContact O-CB 3.3Å; M127-C130 PolarHBondContact O-N 2.84Å; M127-C130 VanDerWaalsContact O-N 3.15Å; M127-V131 PolarHBondContact O-N 3.47Å
128	I	98.7	Very high	97.5	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-41.9	-174.6	-63.8	169.5	0	0	0	112.6	L66 Y68 A125 C130 V131 L132 I151 L152 Y155	L66-I128 HydrophobicContact CD1-CG2 4.03Å; Y68-I128 HydrophobicContact CD2-CD1 4.26Å; Y68-I128 HydrophobicContact CE2-CD1 4.41Å; Y68-I128 HydrophobicContact CE2-CG1 4.44Å; A125-I128 WeakPolarHBondContact O-CB 3.34Å; A125-I128 PolarHBondContact O-N 3.12Å; A125-I128 VanDerWaalsContact O-N 3.17Å; I128-C130 PolarHBondContact O-N 2.91Å; I128-V131 WeakPolarHBondContact O-CB 3.4Å; I128-V131 PolarHBondContact O-N 3.27Å; I128-L132 HydrophobicContact CG2-CG 4.28Å; I128-L132 PolarHBondContact O-N 2.89Å; I128-I151 HydrophobicContact CD1-CG2 4.03Å; I128-L152 HydrophobicContact CD1-CD2 3.81Å; I128-Y155 HydrophobicContact CB-CD2 3.76Å; I128-Y155 HydrophobicContact CB-CE2 3.86Å; I128-Y155 HydrophobicContact CB-CG 4.14Å; I128-Y155 HydrophobicContact CD1-CD1 4.21Å; I128-Y155 HydrophobicContact CD1-CD2 4.24Å; I128-Y155 HydrophobicContact CD1-CG 3.82Å; I128-Y155 HydrophobicContact CG2-CD1 4.02Å; I128-Y155 HydrophobicContact CG2-CD2 3.94Å; I128-Y155 HydrophobicContact CG2-CE1 3.74Å; I128-Y155 HydrophobicContact CG2-CE2 3.68Å; I128-Y155 HydrophobicContact CG2-CG 4.11Å
129	P	98.5	Very high	97.4	Very high	23 Å²	23	40.9 Å²	40.9	15%	0.149	22%	0.217	C	C	.	.	H	α-helix	trans	-51.1	-40.2	172.3	-27.5	32.9	0	0	0	113.9	D126 V131 L132 Q133 Y155	D126-P129 WeakPolarHBondContact O-CD 3.38Å; P129-V131 VanDerWaalsContact C-N 3.34Å; P129-V131 PolarHBondContact O-N 3.1Å; P129-L132 PolarHBondContact O-N 3.45Å; P129-Q133 WeakPolarHBondContact O-CB 3.42Å; P129-Q133 WeakPolarHBondContact O-CG 3.49Å; P129-Q133 PolarHBondContact O-N 2.73Å; P129-Y155 HydrophobicContact CG-CD2 4.49Å; P129-Y155 HydrophobicContact CG-CE2 3.88Å
130	C	98.2	Very high	97.4	Very high	26 Å²	26	40.8 Å²	40.8	18%	0.176	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-39.9	178.8	-61.5	0	0	0	0	111.7	V43 T45 M127 I128 Y134	V43-C130 HydrophobicContact CG1-CB 4.38Å; V43-C130 HydrophobicContact CG2-CB 4.43Å; T45-C130 HydrophobicContact CG2-CB 3.85Å; M127-C130 WeakPolarHBondContact O-CB 3.3Å; M127-C130 PolarHBondContact O-N 2.84Å; M127-C130 VanDerWaalsContact O-N 3.15Å; I128-C130 PolarHBondContact O-N 2.91Å; C130-Y134 WeakPolarHBondContact O-CB 3.3Å; C130-Y134 PolarHBondContact O-N 3.24Å
131	V	98.1	Very high	97.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-46.4	175.8	178.9	0	0	0	0	111	V43 V50 F52 V98 M127 I128 P129 Y134 L135	V43-V131 HydrophobicContact CG1-CG2 3.95Å; V50-V131 HydrophobicContact CG1-CG2 3.68Å; F52-V131 HydrophobicContact CD1-CB 4.49Å; F52-V131 HydrophobicContact CD1-CG1 3.89Å; F52-V131 HydrophobicContact CD1-CG2 3.92Å; F52-V131 HydrophobicContact CD2-CG1 4.09Å; F52-V131 HydrophobicContact CE1-CB 4.43Å; F52-V131 HydrophobicContact CE1-CG1 3.98Å; F52-V131 HydrophobicContact CE1-CG2 4.06Å; F52-V131 HydrophobicContact CE2-CG1 4.15Å; F52-V131 HydrophobicContact CG-CG1 3.95Å; F52-V131 HydrophobicContact CZ-CG1 4.1Å; V98-V131 HydrophobicContact CG1-CG1 3.91Å; M127-V131 PolarHBondContact O-N 3.47Å; I128-V131 WeakPolarHBondContact O-CB 3.4Å; I128-V131 PolarHBondContact O-N 3.27Å; P129-V131 VanDerWaalsContact C-N 3.34Å; P129-V131 PolarHBondContact O-N 3.1Å; V131-Y134 PolarHBondContact O-N 3.01Å; V131-L135 HydrophobicContact CG1-CD1 4.21Å; V131-L135 PolarHBondContact O-N 2.85Å; V131-L135 VanDerWaalsContact O-N 3.12Å
132	L	97.1	Very high	97.4	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-40.5	-179.7	-60.7	-165.5	0	0	0	112.5	L66 I128 P129 L135 N136 F137 V140 Y155	L66-L132 HydrophobicContact CD1-CD2 3.84Å; I128-L132 HydrophobicContact CG2-CG 4.28Å; I128-L132 PolarHBondContact O-N 2.89Å; P129-L132 PolarHBondContact O-N 3.45Å; L132-L135 CarbonylContact O-C 3.56Å; L132-L135 PolarHBondContact O-N 3.34Å; L132-N136 WeakPolarHBondContact O-CA 3.03Å; L132-N136 PolarHBondContact O-N 2.97Å; L132-F137 HydrophobicContact CD2-CB 4.33Å; L132-F137 PolarHBondContact O-N 3.35Å; L132-V140 HydrophobicContact CD1-CG1 3.92Å; L132-V140 HydrophobicContact CD2-CG1 3.45Å; L132-V140 VanDerWaalsContact CD2-CG1 3.45Å; L132-V140 HydrophobicContact CG-CG1 4.35Å; L132-Y155 WeakPolarHBondContact CD1-OH 3.34Å
133	Q	96.9	Very high	97.4	Very high	140 Å²	140	37 Å²	37	65%	0.654	19%	0.194	S	C	*	.	H	α-helix	trans	-62.5	-44.9	175.6	-74.2	170.9	10.9	0	0	111.4	P129 L135 N136	P129-Q133 WeakPolarHBondContact O-CB 3.42Å; P129-Q133 WeakPolarHBondContact O-CG 3.49Å; P129-Q133 PolarHBondContact O-N 2.73Å; Q133-L135 VanDerWaalsContact C-N 3.27Å; Q133-L135 PolarHBondContact O-N 3.29Å; Q133-N136 PolarHBondContact O-N 3.44Å
134	Y	96.7	Very high	97.4	Very high	115 Å²	115	34 Å²	34	45%	0.451	18%	0.179	S	C	.	.	H	α-helix	trans	-58.1	-40.9	176.7	179.9	-87.4	0	0	0	112	H41 V43 F52 C130 V131	H41-Y134 HydrophobicContact CB-CE1 4.1Å; H41-Y134 AromaticContact CG-CE1 3.99Å; H41-Y134 AromaticContact ND1-CE1 3.62Å; H41-Y134 AromaticContact ND1-CZ 3.89Å; H41-Y134 PolarHBondContact ND1-OH 2.87Å; V43-Y134 HydrophobicContact CB-CD2 4.49Å; V43-Y134 HydrophobicContact CG2-CD2 4.17Å; V43-Y134 HydrophobicContact CG2-CG 4.45Å; F52-Y134 HydrophobicContact CE2-CD1 4.3Å; F52-Y134 AromaticContact CZ-CD1 3.66Å; F52-Y134 HydrophobicContact CZ-CD1 3.66Å; F52-Y134 HydrophobicContact CZ-CE1 4.04Å; F52-Y134 HydrophobicContact CZ-CG 4.34Å; C130-Y134 WeakPolarHBondContact O-CB 3.3Å; C130-Y134 PolarHBondContact O-N 3.24Å; V131-Y134 PolarHBondContact O-N 3.01Å
135	L	94.8	Very high	97.4	Very high	35 Å²	35	34 Å²	34	18%	0.183	18%	0.179	C	C	.	.	H	α-helix	trans	-87	-4.8	-179	-66.6	176.5	0	0	0	114.7	F52 V54 V98 V131 L132 Q133 F137	F52-L135 HydrophobicContact CD2-CD1 4.22Å; F52-L135 HydrophobicContact CE2-CD1 3.76Å; F52-L135 HydrophobicContact CE2-CD2 3.97Å; F52-L135 HydrophobicContact CE2-CG 3.92Å; F52-L135 HydrophobicContact CZ-CG 4.42Å; V54-L135 HydrophobicContact CG2-CD1 3.87Å; V54-L135 HydrophobicContact CG2-CD2 3.88Å; V98-L135 HydrophobicContact CB-CD1 4.44Å; V98-L135 HydrophobicContact CG1-CD1 3.89Å; V98-L135 HydrophobicContact CG2-CD1 3.62Å; V131-L135 HydrophobicContact CG1-CD1 4.21Å; V131-L135 PolarHBondContact O-N 2.85Å; V131-L135 VanDerWaalsContact O-N 3.12Å; L132-L135 CarbonylContact O-C 3.56Å; L132-L135 PolarHBondContact O-N 3.34Å; Q133-L135 VanDerWaalsContact C-N 3.27Å; Q133-L135 PolarHBondContact O-N 3.29Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 HydrophobicContact CB-CD2 3.46Å; L135-F137 VanDerWaalsContact CB-CD2 3.46Å; L135-F137 HydrophobicContact CB-CE2 3.79Å; L135-F137 HydrophobicContact CD1-CD2 4.05Å; L135-F137 HydrophobicContact CD1-CE2 4.08Å; L135-F137 HydrophobicContact CG-CD2 4.39Å; L135-F137 HydrophobicContact CG-CE2 4.48Å; L135-F137 PolarHBondContact O-N 2.95Å
136	N	94.3	Very high	97.4	Very high	149 Å²	149	34 Å²	34	80%	0.797	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	37	-171.8	-61	-76.8	0	0	0	114.1	L132 Q133	L132-N136 WeakPolarHBondContact O-CA 3.03Å; L132-N136 PolarHBondContact O-N 2.97Å; Q133-N136 PolarHBondContact O-N 3.44Å
137	F	93.6	Very high	97.4	Very high	33 Å²	33	31.4 Å²	31.4	15%	0.145	17%	0.165	C	C	.	.			trans	-91.1	131.8	170.3	-75.5	-64.4	0	0	0	110.9	P58 A64 V96 V98 L132 L135	P58-F137 HydrophobicContact CG-CZ 4.36Å; A64-F137 HydrophobicContact CB-CD1 4.01Å; A64-F137 HydrophobicContact CB-CD2 3.97Å; A64-F137 HydrophobicContact CB-CE1 4.07Å; A64-F137 HydrophobicContact CB-CE2 4.03Å; A64-F137 HydrophobicContact CB-CG 3.99Å; A64-F137 HydrophobicContact CB-CZ 4.1Å; V96-F137 HydrophobicContact CB-CE1 4.32Å; V96-F137 HydrophobicContact CB-CE2 4.4Å; V96-F137 HydrophobicContact CB-CZ 3.67Å; V96-F137 HydrophobicContact CG1-CE2 3.92Å; V96-F137 HydrophobicContact CG1-CZ 3.63Å; V96-F137 HydrophobicContact CG2-CE1 4.43Å; V96-F137 HydrophobicContact CG2-CZ 3.87Å; V98-F137 HydrophobicContact CG2-CE2 4.31Å; L132-F137 HydrophobicContact CD2-CB 4.33Å; L132-F137 PolarHBondContact O-N 3.35Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 HydrophobicContact CB-CD2 3.46Å; L135-F137 VanDerWaalsContact CB-CD2 3.46Å; L135-F137 HydrophobicContact CB-CE2 3.79Å; L135-F137 HydrophobicContact CD1-CD2 4.05Å; L135-F137 HydrophobicContact CD1-CE2 4.08Å; L135-F137 HydrophobicContact CG-CD2 4.39Å; L135-F137 HydrophobicContact CG-CE2 4.48Å; L135-F137 PolarHBondContact O-N 2.95Å
138	S	93.6	Very high	97.4	Very high	92 Å²	92	31.3 Å²	31.3	64%	0.643	17%	0.165	S	C	*	.	S	Bend	trans	-83.8	-33	175.3	53.7	0	0	0	0	112.7
139	T	97.3	Very high	97.4	Very high	25 Å²	25	31.2 Å²	31.2	15%	0.153	16%	0.164	C	C	.	.			trans	-144.5	151.8	-171	53.1	0	0	0	0	112.2	P63 A64 T162 E164	P63-T139 WeakPolarHBondContact CA-O 3.45Å; P63-T139 WeakPolarHBondContact CB-O 3.34Å; A64-T139 PolarHBondContact N-O 2.89Å; T139-T162 CarbonylContact C-O 3.57Å; T139-T162 VanDerWaalsContact CA-O 3.27Å; T139-T162 WeakPolarHBondContact CA-O 3.43Å; T139-E164 WeakPolarHBondContact CB-OE1 3.22Å; T139-E164 HydrophobicContact CG2-CG 4.16Å; T139-E164 PolarHBondContact OG1-OE1 2.84Å
140	V	98.2	Very high	97.5	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.3	177.9	-63.2	0	0	0	0	113.2	A64 L66 L132 Y155 T162 V163 E164	A64-V140 HydrophobicContact CB-CG1 4.31Å; A64-V140 CarbonylContact O-C 3.54Å; A64-V140 VanDerWaalsContact O-CA 3.23Å; A64-V140 WeakPolarHBondContact O-CA 3.28Å; A64-V140 WeakPolarHBondContact O-CB 3.46Å; L66-V140 HydrophobicContact CB-CB 4.11Å; L66-V140 HydrophobicContact CB-CG1 4.08Å; L66-V140 HydrophobicContact CD1-CG1 4.3Å; L132-V140 HydrophobicContact CD1-CG1 3.92Å; L132-V140 HydrophobicContact CD2-CG1 3.45Å; L132-V140 VanDerWaalsContact CD2-CG1 3.45Å; L132-V140 HydrophobicContact CG-CG1 4.35Å; V140-Y155 HydrophobicContact CG2-CE1 4.26Å; V140-T162 PolarHBondContact N-O 3.21Å; V140-V163 HydrophobicContact CG2-CG2 4.39Å; V140-E164 PolarHBondContact O-N 3.45Å
141	I	98.6	Very high	97.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.6	159	-62.6	167.4	0	0	0	106.3	P63 A64 I65 L66 F95 E164 G165 F307 F310 L311 M314 Y316	P63-I141 HydrophobicContact CB-CG1 4.22Å; P63-I141 HydrophobicContact CG-CD1 3.62Å; P63-I141 HydrophobicContact CG-CG1 3.8Å; A64-I141 PolarHBondContact O-N 2.8Å; I65-I141 CarbonylContact C-O 3.53Å; I65-I141 WeakPolarHBondContact CA-O 3.39Å; L66-I141 PolarHBondContact N-O 2.93Å; F95-I141 HydrophobicContact CE1-CD1 4.22Å; I141-E164 HydrophobicContact CG1-CB 4.3Å; I141-G165 CarbonylContact C-O 3.53Å; I141-G165 WeakPolarHBondContact CA-O 3.24Å; I141-F307 HydrophobicContact CG2-CE2 4.44Å; I141-F310 HydrophobicContact CG2-CE1 4.42Å; I141-L311 HydrophobicContact CD1-CD2 3.51Å; I141-L311 HydrophobicContact CG2-CD2 4.49Å; I141-M314 HydrophobicContact CD1-CE 3.75Å; I141-M314 HydrophobicContact CG1-CE 4.19Å; I141-M314 HydrophobicContact CG2-CE 4.38Å; I141-Y316 HydrophobicContact CD1-CD2 3.97Å; I141-Y316 HydrophobicContact CD1-CE2 3.88Å
142	G	98.8	Very high	97.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.1	-177	0	0	0	0	0	112.4	L66 G165 L166 V167	L66-G142 CarbonylContact O-C 3.53Å; L66-G142 WeakPolarHBondContact O-CA 3.32Å; G142-G165 PolarHBondContact N-O 3.22Å; G142-L166 CarbonylContact O-C 3.57Å; G142-L166 WeakPolarHBondContact O-CA 3.31Å; G142-V167 PolarHBondContact O-N 3.15Å
143	V	98.9	Very high	97.6	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.03	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	112.2	170.6	-174.1	0	0	0	0	108.9	I65 L66 T67 Y68 F79 L152 V167 F307	I65-V143 HydrophobicContact CG2-CG2 4.07Å; L66-V143 PolarHBondContact O-N 3.31Å; T67-V143 CarbonylContact C-O 3.58Å; T67-V143 WeakPolarHBondContact CA-O 3.47Å; T67-V143 HydrophobicContact CG2-CB 4.27Å; Y68-V143 PolarHBondContact N-O 2.82Å; F79-V143 HydrophobicContact CE1-CG1 3.77Å; F79-V143 HydrophobicContact CZ-CG1 4.28Å; F79-V143 WeakPolarHBondContact CZ-O 3.26Å; V143-L152 VanDerWaalsContact C-CD1 3.45Å; V143-V167 WeakPolarHBondContact CA-O 3.46Å; V143-V167 HydrophobicContact CB-CB 4.4Å; V143-V167 HydrophobicContact CG1-CB 4.12Å; V143-V167 HydrophobicContact CG1-CG1 4.31Å; V143-V167 HydrophobicContact CG2-CB 4.14Å; V143-V167 HydrophobicContact CG2-CG2 4.24Å; V143-F307 HydrophobicContact CG2-CE2 4.13Å; V143-F307 HydrophobicContact CG2-CZ 4.33Å
144	G	98.9	Very high	97.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	148.6	-175	0	0	0	0	0	112.7	Y68 V167 I169	Y68-G144 WeakPolarHBondContact O-CA 3.39Å; G144-V167 PolarHBondContact N-O 3.34Å; G144-I169 WeakPolarHBondContact O-CB 3.49Å; G144-I169 PolarHBondContact O-N 3.05Å
145	V	98.9	Very high	97.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.2	169	-170.3	0	0	0	0	109.7	Y68 D70 F79 A147 G148 I169	Y68-V145 PolarHBondContact O-N 3.01Å; D70-V145 WeakPolarHBondContact CA-O 3.43Å; D70-V145 HydrophobicContact CB-CB 4.06Å; D70-V145 HydrophobicContact CB-CG1 3.98Å; D70-V145 WeakPolarHBondContact CB-O 3.47Å; D70-V145 PolarHBondContact N-O 2.61Å; F79-V145 HydrophobicContact CE1-CG2 3.73Å; F79-V145 HydrophobicContact CZ-CG2 3.61Å; V145-A147 PolarHBondContact O-N 3.44Å; V145-A147 VanDerWaalsContact O-N 3.09Å; V145-G148 WeakPolarHBondContact O-CA 3.33Å; V145-G148 PolarHBondContact O-N 3.31Å; V145-I169 CarbonylContact C-O 3.51Å; V145-I169 WeakPolarHBondContact CA-O 3.28Å; V145-I169 HydrophobicContact CB-CB 4.42Å; V145-I169 HydrophobicContact CG1-CB 4.31Å; V145-I169 HydrophobicContact CG1-CG2 4.32Å; V145-I169 HydrophobicContact CG2-CB 4.06Å; V145-I169 HydrophobicContact CG2-CD1 4.08Å; V145-I169 HydrophobicContact CG2-CG1 4.4Å
146	G	98.6	Very high	98	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	-112.2	175.4	0	0	0	0	0	112.8	G148 A149 Y150 I169	G146-G148 VanDerWaalsContact C-N 3.27Å; G146-G148 PolarHBondContact O-N 2.82Å; G146-A149 WeakPolarHBondContact O-CA 3.35Å; G146-A149 WeakPolarHBondContact O-CB 3.36Å; G146-A149 PolarHBondContact O-N 3.12Å; G146-Y150 PolarHBondContact O-N 2.9Å; G146-I169 PolarHBondContact N-O 2.98Å
147	A	98.8	Very high	98.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-55.3	-41.2	175.3	0	0	0	0	0	112.9	D70 V71 V145 A149 Y150 I151 Y233 Y237	D70-A147 PolarHBondContact OD1-N 2.93Å; V71-A147 HydrophobicContact CG2-CB 3.79Å; V145-A147 PolarHBondContact O-N 3.44Å; V145-A147 VanDerWaalsContact O-N 3.09Å; A147-A149 VanDerWaalsContact C-N 3.32Å; A147-A149 PolarHBondContact O-N 2.72Å; A147-Y150 PolarHBondContact O-N 2.89Å; A147-I151 VanDerWaalsContact O-CG1 3.23Å; A147-I151 WeakPolarHBondContact O-CG1 3.5Å; A147-I151 PolarHBondContact O-N 3.5Å; A147-Y233 HydrophobicContact CB-CE1 4.47Å; A147-Y233 HydrophobicContact CB-CE2 4.16Å; A147-Y233 VanDerWaalsContact CB-OH 3.25Å; A147-Y233 WeakPolarHBondContact CB-OH 3.46Å; A147-Y237 HydrophobicContact CB-CD2 3.44Å; A147-Y237 VanDerWaalsContact CB-CD2 3.44Å; A147-Y237 HydrophobicContact CB-CE2 3.94Å; A147-Y237 HydrophobicContact CB-CG 4.09Å
148	G	98.9	Very high	98.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-34.9	174.9	0	0	0	0	0	113.1	Y68 H69 V145 G146 I151 L152	Y68-G148 WeakPolarHBondContact O-CA 3.38Å; H69-G148 PolarHBondContact O-N 3.05Å; V145-G148 WeakPolarHBondContact O-CA 3.33Å; V145-G148 PolarHBondContact O-N 3.31Å; G146-G148 VanDerWaalsContact C-N 3.27Å; G146-G148 PolarHBondContact O-N 2.82Å; G148-I151 PolarHBondContact O-N 2.64Å; G148-L152 WeakPolarHBondContact O-CB 3.49Å; G148-L152 VanDerWaalsContact O-CG 3.25Å; G148-L152 WeakPolarHBondContact O-CG 3.19Å; G148-L152 PolarHBondContact O-N 2.84Å
149	A	98.9	Very high	98.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.5	-41.5	174.5	0	0	0	0	0	111.6	G146 A147 S153 L168 I171	G146-A149 WeakPolarHBondContact O-CA 3.35Å; G146-A149 WeakPolarHBondContact O-CB 3.36Å; G146-A149 PolarHBondContact O-N 3.12Å; A147-A149 VanDerWaalsContact C-N 3.32Å; A147-A149 PolarHBondContact O-N 2.72Å; A149-S153 WeakPolarHBondContact O-CB 3.49Å; A149-S153 PolarHBondContact O-N 3.34Å; A149-S153 PolarHBondContact O-OG 3.24Å; A149-L168 HydrophobicContact CB-CB 4.15Å; A149-L168 HydrophobicContact CB-CD2 4.02Å; A149-L168 WeakPolarHBondContact O-CD2 3.47Å; A149-I171 HydrophobicContact CB-CB 3.84Å; A149-I171 HydrophobicContact CB-CD1 4.48Å; A149-I171 HydrophobicContact CB-CG1 4.29Å
150	Y	98.9	Very high	98.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61.3	-49.3	172.7	178.9	-74.8	0	0	0	111.3	L121 D122 G146 A147 L152 S153 R154 R240 R241 L243	L121-Y150 HydrophobicContact CB-CD1 3.75Å; L121-Y150 HydrophobicContact CB-CE1 3.6Å; L121-Y150 HydrophobicContact CD1-CD1 3.33Å; L121-Y150 HydrophobicContact CD1-CE1 3.73Å; L121-Y150 HydrophobicContact CD1-CG 3.8Å; L121-Y150 HydrophobicContact CG-CD1 4.22Å; L121-Y150 HydrophobicContact CG-CE1 4.34Å; D122-Y150 PolarHBondContact OD1-OH 3.14Å; G146-Y150 PolarHBondContact O-N 2.9Å; A147-Y150 PolarHBondContact O-N 2.89Å; Y150-L152 PolarHBondContact O-N 3.12Å; Y150-S153 WeakPolarHBondContact O-CB 3.33Å; Y150-S153 PolarHBondContact O-N 2.91Å; Y150-S153 VanDerWaalsContact O-N 3.13Å; Y150-R154 HydrophobicContact CE1-CB 4.35Å; Y150-R154 PolarHBondContact O-N 3.19Å; Y150-R154 PolarHBondContact OH-NH2 3.03Å; Y150-R240 HydrophobicContact CE1-CB 4.49Å; Y150-R240 HydrophobicContact CE2-CB 4.1Å; Y150-R240 HydrophobicContact CE2-CG 4.23Å; Y150-R241 VanDerWaalsContact CE2-O 3.26Å; Y150-R241 WeakPolarHBondContact CE2-O 3.45Å; Y150-R241 PolarHBondContact OH-O 3.26Å; Y150-L243 HydrophobicContact CD1-CD2 4.48Å; Y150-L243 HydrophobicContact CD2-CD1 3.9Å; Y150-L243 HydrophobicContact CD2-CD2 4.09Å; Y150-L243 HydrophobicContact CD2-CG 3.83Å; Y150-L243 HydrophobicContact CE1-CD2 3.99Å; Y150-L243 HydrophobicContact CE2-CD1 4.09Å; Y150-L243 HydrophobicContact CE2-CD2 3.57Å; Y150-L243 HydrophobicContact CE2-CG 3.47Å; Y150-L243 VanDerWaalsContact CE2-CG 3.47Å; Y150-L243 HydrophobicContact CG-CD1 4.45Å; Y150-L243 VanDerWaalsContact CZ-CD2 3.49Å
151	I	98.9	Very high	98.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-47.2	-177.9	-70.2	163.9	0	0	0	110.8	Y68 L121 L124 A125 I128 A147 G148 S153 R154 Y155 Y233	Y68-I151 HydrophobicContact CD1-CD1 3.88Å; Y68-I151 HydrophobicContact CD2-CG2 3.94Å; Y68-I151 HydrophobicContact CE1-CD1 3.39Å; Y68-I151 HydrophobicContact CE2-CD1 4.47Å; Y68-I151 HydrophobicContact CE2-CG2 3.77Å; Y68-I151 HydrophobicContact CG-CG2 4.39Å; L121-I151 HydrophobicContact CB-CG1 4.16Å; L121-I151 HydrophobicContact CD2-CD1 4.12Å; L121-I151 HydrophobicContact CD2-CG1 4.19Å; L124-I151 HydrophobicContact CB-CD1 3.93Å; L124-I151 HydrophobicContact CB-CG1 4.21Å; L124-I151 HydrophobicContact CB-CG2 4.35Å; L124-I151 HydrophobicContact CD1-CD1 3.7Å; L124-I151 HydrophobicContact CG-CD1 4.48Å; A125-I151 HydrophobicContact CB-CG2 4.04Å; A125-I151 WeakPolarHBondContact CB-O 3.43Å; I128-I151 HydrophobicContact CD1-CG2 4.03Å; A147-I151 VanDerWaalsContact O-CG1 3.23Å; A147-I151 WeakPolarHBondContact O-CG1 3.5Å; A147-I151 PolarHBondContact O-N 3.5Å; G148-I151 PolarHBondContact O-N 2.64Å; I151-S153 VanDerWaalsContact C-N 3.28Å; I151-S153 PolarHBondContact O-N 3.37Å; I151-R154 PolarHBondContact O-N 3.3Å; I151-Y155 WeakPolarHBondContact O-CB 3.47Å; I151-Y155 PolarHBondContact O-N 3Å; I151-Y233 HydrophobicContact CD1-CE2 4.17Å; I151-Y233 WeakPolarHBondContact CD1-OH 3.25Å
152	L	98.9	Very high	98.6	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-64.9	-33.7	177.7	-68.1	178.4	0	0	0	112.5	L66 I128 V143 G148 Y150 Y155 A156 L166	L66-L152 HydrophobicContact CD2-CD2 3.53Å; I128-L152 HydrophobicContact CD1-CD2 3.81Å; V143-L152 VanDerWaalsContact C-CD1 3.45Å; G148-L152 WeakPolarHBondContact O-CB 3.49Å; G148-L152 VanDerWaalsContact O-CG 3.25Å; G148-L152 WeakPolarHBondContact O-CG 3.19Å; G148-L152 PolarHBondContact O-N 2.84Å; Y150-L152 PolarHBondContact O-N 3.12Å; L152-Y155 PolarHBondContact O-N 3.33Å; L152-A156 WeakPolarHBondContact O-CB 3.42Å; L152-A156 PolarHBondContact O-N 3.49Å; L152-L166 HydrophobicContact CB-CD2 3.96Å
153	S	98.8	Very high	98.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.5	-44.9	175.2	-61.3	0	0	0	0	112	A149 Y150 I151 Y155 A156 L157 L168 I171	A149-S153 WeakPolarHBondContact O-CB 3.49Å; A149-S153 PolarHBondContact O-N 3.34Å; A149-S153 PolarHBondContact O-OG 3.24Å; Y150-S153 WeakPolarHBondContact O-CB 3.33Å; Y150-S153 PolarHBondContact O-N 2.91Å; Y150-S153 VanDerWaalsContact O-N 3.13Å; I151-S153 VanDerWaalsContact C-N 3.28Å; I151-S153 PolarHBondContact O-N 3.37Å; S153-Y155 VanDerWaalsContact C-N 3.32Å; S153-Y155 PolarHBondContact O-N 3.23Å; S153-A156 PolarHBondContact O-N 3.44Å; S153-L157 WeakPolarHBondContact O-CG 3.2Å; S153-L157 PolarHBondContact O-N 3.22Å; S153-L168 WeakPolarHBondContact OG-CD1 3.42Å; S153-I171 VanDerWaalsContact OG-CD1 3.23Å; S153-I171 WeakPolarHBondContact OG-CD1 3.4Å
154	R	98.8	Very high	98.6	Very high	36 Å²	36	23.8 Å²	23.8	14%	0.136	12%	0.124	C	C	.	.	H	α-helix	trans	-59.6	-44.3	173.1	173.8	60.2	73	-149.6	-2.5	111.1	D122 A125 Y150 I151 A156 L157 N158 D242 L243	D122-R154 IonicContact OD1-CZ 2.72Å; D122-R154 IonicContact OD1-NE 3.7Å; D122-R154 PolarHBondContact OD1-NE 3.2Å; D122-R154 IonicContact OD1-NH2 3.68Å; A125-R154 HydrophobicContact CB-CB 4Å; A125-R154 HydrophobicContact CB-CG 3.73Å; Y150-R154 HydrophobicContact CE1-CB 4.35Å; Y150-R154 PolarHBondContact O-N 3.19Å; Y150-R154 PolarHBondContact OH-NH2 3.03Å; I151-R154 PolarHBondContact O-N 3.3Å; R154-A156 VanDerWaalsContact C-N 3.34Å; R154-A156 PolarHBondContact O-N 3.14Å; R154-L157 PolarHBondContact O-N 2.88Å; R154-N158 PolarHBondContact O-N 2.83Å; R154-N158 VanDerWaalsContact O-N 3.1Å; R154-N158 PolarHBondContact O-OD1 3.23Å; R154-D242 PolarHBondContact NH2-O 3.37Å; R154-L243 HydrophobicContact CB-CD2 4.02Å
155	Y	98.8	Very high	98.6	Very high	5 Å²	5	23.8 Å²	23.8	2%	0.02	12%	0.124	C	C	.	.	H	α-helix	trans	-58	-46	175.6	172.2	-110	0	0	0	111.9	I128 P129 L132 V140 I151 L152 S153 L157 N158 H159 T162 V163	I128-Y155 HydrophobicContact CB-CD2 3.76Å; I128-Y155 HydrophobicContact CB-CE2 3.86Å; I128-Y155 HydrophobicContact CB-CG 4.14Å; I128-Y155 HydrophobicContact CD1-CD1 4.21Å; I128-Y155 HydrophobicContact CD1-CD2 4.24Å; I128-Y155 HydrophobicContact CD1-CG 3.82Å; I128-Y155 HydrophobicContact CG2-CD1 4.02Å; I128-Y155 HydrophobicContact CG2-CD2 3.94Å; I128-Y155 HydrophobicContact CG2-CE1 3.74Å; I128-Y155 HydrophobicContact CG2-CE2 3.68Å; I128-Y155 HydrophobicContact CG2-CG 4.11Å; P129-Y155 HydrophobicContact CG-CD2 4.49Å; P129-Y155 HydrophobicContact CG-CE2 3.88Å; L132-Y155 WeakPolarHBondContact CD1-OH 3.34Å; V140-Y155 HydrophobicContact CG2-CE1 4.26Å; I151-Y155 WeakPolarHBondContact O-CB 3.47Å; I151-Y155 PolarHBondContact O-N 3Å; L152-Y155 PolarHBondContact O-N 3.33Å; S153-Y155 VanDerWaalsContact C-N 3.32Å; S153-Y155 PolarHBondContact O-N 3.23Å; Y155-L157 VanDerWaalsContact C-N 3.32Å; Y155-L157 PolarHBondContact O-N 3.46Å; Y155-N158 PolarHBondContact O-N 3.45Å; Y155-N158 VanDerWaalsContact O-N 3.12Å; Y155-H159 HydrophobicContact CD2-CB 4.45Å; Y155-H159 AromaticContact CD2-CD2 3.58Å; Y155-H159 HydrophobicContact CE2-CB 3.9Å; Y155-H159 AromaticContact CE2-CD2 3.4Å; Y155-H159 VanDerWaalsContact CE2-CD2 3.4Å; Y155-H159 WeakPolarHBondContact CE2-CD2 3.39Å; Y155-H159 AromaticContact CE2-CG 3.85Å; Y155-H159 PolarHBondContact O-N 3.15Å; Y155-T162 PolarHBondContact OH-OG1 3.47Å; Y155-V163 HydrophobicContact CD1-CG2 3.7Å; Y155-V163 HydrophobicContact CE1-CG2 3.45Å; Y155-V163 VanDerWaalsContact CE1-CG2 3.45Å
156	A	98.8	Very high	98.6	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-66.1	-31	178.3	0	0	0	0	0	113.6	L152 S153 R154 H159 P160 V163 L166 L253	L152-A156 WeakPolarHBondContact O-CB 3.42Å; L152-A156 PolarHBondContact O-N 3.49Å; S153-A156 PolarHBondContact O-N 3.44Å; R154-A156 VanDerWaalsContact C-N 3.34Å; R154-A156 PolarHBondContact O-N 3.14Å; A156-H159 CarbonylContact O-C 3.58Å; A156-P160 VanDerWaalsContact O-CA 3.23Å; A156-P160 WeakPolarHBondContact O-CA 3.38Å; A156-V163 HydrophobicContact CB-CB 4.11Å; A156-V163 HydrophobicContact CB-CG1 4.05Å; A156-V163 HydrophobicContact CB-CG2 3.89Å; A156-L166 HydrophobicContact CB-CD1 3.71Å; A156-L253 HydrophobicContact CB-CD2 3.71Å
157	L	98.3	Very high	98.6	Very high	38 Å²	38	24 Å²	24	20%	0.199	13%	0.125	C	C	.	.	H	α-helix	trans	-66.9	-38.2	171.1	-69.4	170	0	0	0	111.8	S153 R154 Y155 L243 F245 I251 T252 L253	S153-L157 WeakPolarHBondContact O-CG 3.2Å; S153-L157 PolarHBondContact O-N 3.22Å; R154-L157 PolarHBondContact O-N 2.88Å; Y155-L157 VanDerWaalsContact C-N 3.32Å; Y155-L157 PolarHBondContact O-N 3.46Å; L157-L243 HydrophobicContact CD1-CD2 4.32Å; L157-F245 HydrophobicContact CD1-CE1 3.86Å; L157-F245 HydrophobicContact CD2-CE1 4.06Å; L157-F245 HydrophobicContact CG-CE1 4.2Å; L157-I251 HydrophobicContact CD1-CG2 4.33Å; L157-I251 HydrophobicContact CD2-CG2 4.11Å; L157-T252 WeakPolarHBondContact CD2-O 3.42Å; L157-L253 HydrophobicContact CD2-CD2 4.3Å; L157-L253 HydrophobicContact CG-CD2 4.24Å
158	N	98.3	Very high	98.6	Very high	72 Å²	72	24 Å²	24	39%	0.385	13%	0.125	S	C	.	.	H	α-helix	trans	-78	-33.7	-179.3	-65.8	-4.4	0	0	0	112.4	R154 Y155	R154-N158 PolarHBondContact O-N 2.83Å; R154-N158 VanDerWaalsContact O-N 3.1Å; R154-N158 PolarHBondContact O-OD1 3.23Å; Y155-N158 PolarHBondContact O-N 3.45Å; Y155-N158 VanDerWaalsContact O-N 3.12Å
159	H	98.4	Very high	98.6	Very high	68 Å²	68	24 Å²	24	32%	0.315	13%	0.125	S	C	.	.			trans	-134.6	64.2	-174	-56.2	-75.7	0	0	0	111.6	Y155 A156 D161 T162	Y155-H159 HydrophobicContact CD2-CB 4.45Å; Y155-H159 AromaticContact CD2-CD2 3.58Å; Y155-H159 HydrophobicContact CE2-CB 3.9Å; Y155-H159 AromaticContact CE2-CD2 3.4Å; Y155-H159 VanDerWaalsContact CE2-CD2 3.4Å; Y155-H159 WeakPolarHBondContact CE2-CD2 3.39Å; Y155-H159 AromaticContact CE2-CG 3.85Å; Y155-H159 PolarHBondContact O-N 3.15Å; A156-H159 CarbonylContact O-C 3.58Å; H159-D161 PolarHBondContact O-N 3.11Å; H159-T162 WeakPolarHBondContact CB-OG1 3.29Å; H159-T162 PolarHBondContact O-N 3.17Å; H159-T162 PolarHBondContact O-OG1 3.07Å
160	P	97.7	Very high	98.6	Very high	32 Å²	32	24 Å²	24	21%	0.208	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-62.6	-30.7	-174.2	24.1	-34.5	0	0	0	113.4	A156 T162 V163 K254	A156-P160 VanDerWaalsContact O-CA 3.23Å; A156-P160 WeakPolarHBondContact O-CA 3.38Å; P160-T162 PolarHBondContact O-N 3.25Å; P160-V163 PolarHBondContact O-N 3.04Å; P160-K254 HydrophobicContact CB-CB 4.37Å; P160-K254 HydrophobicContact CB-CD 3.95Å; P160-K254 HydrophobicContact CB-CG 4.39Å; P160-K254 HydrophobicContact CG-CD 4.37Å
161	D	97.8	Very high	98.6	Very high	147 Å²	147	24 Å²	24	79%	0.786	13%	0.125	S	C	*	.	G	3₁₀ helix	trans	-74.5	-13.6	-176.9	-56.4	-44.1	0	0	0	113.3	H159	H159-D161 PolarHBondContact O-N 3.11Å
162	T	98.2	Very high	98.5	Very high	36 Å²	36	25.2 Å²	25.2	22%	0.221	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-100.3	-0.1	178.6	63.4	0	0	0	0	112.6	T139 V140 Y155 H159 P160	T139-T162 CarbonylContact C-O 3.57Å; T139-T162 VanDerWaalsContact CA-O 3.27Å; T139-T162 WeakPolarHBondContact CA-O 3.43Å; V140-T162 PolarHBondContact N-O 3.21Å; Y155-T162 PolarHBondContact OH-OG1 3.47Å; H159-T162 WeakPolarHBondContact CB-OG1 3.29Å; H159-T162 PolarHBondContact O-N 3.17Å; H159-T162 PolarHBondContact O-OG1 3.07Å; P160-T162 PolarHBondContact O-N 3.25Å
163	V	98.6	Very high	98.4	Very high	8 Å²	8	25.2 Å²	25.2	5%	0.048	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	112.7	-178.3	-175.5	0	0	0	0	110	V140 Y155 A156 P160 L166 C255	V140-V163 HydrophobicContact CG2-CG2 4.39Å; Y155-V163 HydrophobicContact CD1-CG2 3.7Å; Y155-V163 HydrophobicContact CE1-CG2 3.45Å; Y155-V163 VanDerWaalsContact CE1-CG2 3.45Å; A156-V163 HydrophobicContact CB-CB 4.11Å; A156-V163 HydrophobicContact CB-CG1 4.05Å; A156-V163 HydrophobicContact CB-CG2 3.89Å; P160-V163 PolarHBondContact O-N 3.04Å; V163-L166 HydrophobicContact CG1-CD1 4.41Å; V163-L166 HydrophobicContact CG1-CD2 3.87Å; V163-L166 HydrophobicContact CG1-CG 3.82Å; V163-C255 WeakPolarHBondContact O-CB 3.38Å
164	E	98.4	Very high	98.1	Very high	53 Å²	53	26.4 Å²	26.4	25%	0.248	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-21.5	-179.4	-68.6	-176.6	-149.3	0	0	113.2	P63 T139 V140 I141 P256 M314 Y316	P63-E164 WeakPolarHBondContact CG-OE2 3.29Å; T139-E164 WeakPolarHBondContact CB-OE1 3.22Å; T139-E164 HydrophobicContact CG2-CG 4.16Å; T139-E164 PolarHBondContact OG1-OE1 2.84Å; V140-E164 PolarHBondContact O-N 3.45Å; I141-E164 HydrophobicContact CG1-CB 4.3Å; E164-P256 WeakPolarHBondContact O-CD 3.38Å; E164-M314 VanDerWaalsContact O-SD 3.39Å; E164-Y316 WeakPolarHBondContact OE2-CE2 3.19Å; E164-Y316 VanDerWaalsContact OE2-CZ 3.26Å; E164-Y316 PolarHBondContact OE2-OH 3.18Å
165	G	98.7	Very high	97.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	157	175.8	0	0	0	0	0	112.4	I141 G142 P256	I141-G165 CarbonylContact C-O 3.53Å; I141-G165 WeakPolarHBondContact CA-O 3.24Å; G142-G165 PolarHBondContact N-O 3.22Å; G165-P256 CarbonylContact C-O 3.59Å; G165-P256 VanDerWaalsContact CA-O 3.25Å; G165-P256 WeakPolarHBondContact CA-O 3.1Å
166	L	98.9	Very high	97	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.2	-179.3	-71	173.5	0	0	0	112	G142 L152 A156 V163 L168 L253 P256 V257 M258	G142-L166 CarbonylContact O-C 3.57Å; G142-L166 WeakPolarHBondContact O-CA 3.31Å; L152-L166 HydrophobicContact CB-CD2 3.96Å; A156-L166 HydrophobicContact CB-CD1 3.71Å; V163-L166 HydrophobicContact CG1-CD1 4.41Å; V163-L166 HydrophobicContact CG1-CD2 3.87Å; V163-L166 HydrophobicContact CG1-CG 3.82Å; L166-L168 HydrophobicContact CB-CD1 4.38Å; L166-L168 HydrophobicContact CB-CD2 3.98Å; L166-L168 HydrophobicContact CB-CG 4Å; L166-L168 HydrophobicContact CD1-CD1 4.47Å; L166-L168 HydrophobicContact CD1-CD2 4.35Å; L166-L168 HydrophobicContact CD2-CD2 4.41Å; L166-L168 HydrophobicContact CG-CD2 4.49Å; L166-L253 HydrophobicContact CD1-CD1 3.95Å; L166-L253 HydrophobicContact CD1-CD2 3.96Å; L166-P256 PolarHBondContact N-O 3.5Å; L166-V257 HydrophobicContact CB-CG2 4.47Å; L166-V257 CarbonylContact O-C 3.6Å; L166-V257 WeakPolarHBondContact O-CA 3.28Å; L166-M258 PolarHBondContact O-N 2.84Å
167	V	98.9	Very high	95.8	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	112.1	165.4	-176.3	0	0	0	0	107.8	G142 V143 G144 I169 M258 V260 F307 F310	G142-V167 PolarHBondContact O-N 3.15Å; V143-V167 WeakPolarHBondContact CA-O 3.46Å; V143-V167 HydrophobicContact CB-CB 4.4Å; V143-V167 HydrophobicContact CG1-CB 4.12Å; V143-V167 HydrophobicContact CG1-CG1 4.31Å; V143-V167 HydrophobicContact CG2-CB 4.14Å; V143-V167 HydrophobicContact CG2-CG2 4.24Å; G144-V167 PolarHBondContact N-O 3.34Å; V167-I169 HydrophobicContact CG1-CG1 4.32Å; V167-M258 WeakPolarHBondContact CA-O 3.26Å; V167-M258 HydrophobicContact CB-CE 4.26Å; V167-M258 HydrophobicContact CG1-CE 3.46Å; V167-M258 VanDerWaalsContact CG1-CE 3.46Å; V167-M258 HydrophobicContact CG2-CB 4.41Å; V167-M258 HydrophobicContact CG2-CE 3.8Å; V167-V260 HydrophobicContact CG1-CG2 4.13Å; V167-F307 HydrophobicContact CG2-CD2 3.76Å; V167-F307 HydrophobicContact CG2-CE2 3.78Å; V167-F310 HydrophobicContact CG2-CD1 3.92Å; V167-F310 HydrophobicContact CG2-CE1 3.91Å
168	L	98.9	Very high	94.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	99.2	-170.4	-55.7	177.6	0	0	0	109.1	A149 S153 L166 I171 L253 V257 M258 L259 V260	A149-L168 HydrophobicContact CB-CB 4.15Å; A149-L168 HydrophobicContact CB-CD2 4.02Å; A149-L168 WeakPolarHBondContact O-CD2 3.47Å; S153-L168 WeakPolarHBondContact OG-CD1 3.42Å; L166-L168 HydrophobicContact CB-CD1 4.38Å; L166-L168 HydrophobicContact CB-CD2 3.98Å; L166-L168 HydrophobicContact CB-CG 4Å; L166-L168 HydrophobicContact CD1-CD1 4.47Å; L166-L168 HydrophobicContact CD1-CD2 4.35Å; L166-L168 HydrophobicContact CD2-CD2 4.41Å; L166-L168 HydrophobicContact CG-CD2 4.49Å; L168-I171 HydrophobicContact CB-CB 4.21Å; L168-I171 HydrophobicContact CB-CG2 4Å; L168-I171 HydrophobicContact CD1-CD1 3.88Å; L168-L253 HydrophobicContact CD1-CD1 4.16Å; L168-V257 HydrophobicContact CD1-CG1 3.73Å; L168-V257 HydrophobicContact CG-CG1 4.18Å; L168-M258 PolarHBondContact N-O 2.89Å; L168-L259 HydrophobicContact CB-CD2 3.89Å; L168-L259 HydrophobicContact CD1-CD2 3.96Å; L168-L259 HydrophobicContact CG-CD2 4.45Å; L168-V260 PolarHBondContact O-N 2.92Å
169	I	98.9	Very high	92.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.4	-179.9	-46.6	-175.3	0	0	0	108.3	G144 V145 G146 V167 I171 V260 P295 Q296 L303	G144-I169 WeakPolarHBondContact O-CB 3.49Å; G144-I169 PolarHBondContact O-N 3.05Å; V145-I169 CarbonylContact C-O 3.51Å; V145-I169 WeakPolarHBondContact CA-O 3.28Å; V145-I169 HydrophobicContact CB-CB 4.42Å; V145-I169 HydrophobicContact CG1-CB 4.31Å; V145-I169 HydrophobicContact CG1-CG2 4.32Å; V145-I169 HydrophobicContact CG2-CB 4.06Å; V145-I169 HydrophobicContact CG2-CD1 4.08Å; V145-I169 HydrophobicContact CG2-CG1 4.4Å; G146-I169 PolarHBondContact N-O 2.98Å; V167-I169 HydrophobicContact CG1-CG1 4.32Å; I169-I171 VanDerWaalsContact C-N 3.26Å; I169-I171 PolarHBondContact O-N 3.21Å; I169-V260 CarbonylContact C-O 3.47Å; I169-V260 WeakPolarHBondContact CA-O 3.48Å; I169-V260 HydrophobicContact CB-CB 4.43Å; I169-V260 HydrophobicContact CG1-CB 4.1Å; I169-V260 HydrophobicContact CG1-CG2 4.47Å; I169-V260 HydrophobicContact CG2-CB 4.38Å; I169-V260 HydrophobicContact CG2-CG1 4.41Å; I169-P295 HydrophobicContact CG2-CG 4.23Å; I169-Q296 HydrophobicContact CD1-CB 4.16Å; I169-L303 HydrophobicContact CD1-CD2 3.86Å
170	N	98.6	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	55.1	37	176.5	-54.8	-26.8	0	0	0	114.2	D172 V260 H267 G293	N170-D172 PolarHBondContact O-N 2.73Å; N170-V260 PolarHBondContact N-O 3.4Å; N170-H267 HydrophobicContact CB-CB 3.98Å; N170-G293 PolarHBondContact ND2-O 3.35Å
171	I	98.6	Very high	90.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.			trans	-67.8	132.9	177	-175.7	166.4	0	0	0	111.3	A149 S153 L168 I169 L243 L259 V271 C274	A149-I171 HydrophobicContact CB-CB 3.84Å; A149-I171 HydrophobicContact CB-CD1 4.48Å; A149-I171 HydrophobicContact CB-CG1 4.29Å; S153-I171 VanDerWaalsContact OG-CD1 3.23Å; S153-I171 WeakPolarHBondContact OG-CD1 3.4Å; L168-I171 HydrophobicContact CB-CB 4.21Å; L168-I171 HydrophobicContact CB-CG2 4Å; L168-I171 HydrophobicContact CD1-CD1 3.88Å; I169-I171 VanDerWaalsContact C-N 3.26Å; I169-I171 PolarHBondContact O-N 3.21Å; I171-L243 HydrophobicContact CD1-CD1 4.23Å; I171-L259 HydrophobicContact CG2-CD2 3.86Å; I171-V271 HydrophobicContact CG2-CG2 4.21Å; I171-V271 VanDerWaalsContact O-CG2 3.26Å; I171-V271 WeakPolarHBondContact O-CG2 3.36Å; I171-C274 HydrophobicContact CG2-CB 4.32Å
172	D	97.7	Very high	88.3	Confident	26 Å²	26	41 Å²	41	14%	0.139	21%	0.205	C	C	.	.			trans	-114.3	107.8	160.6	-178.6	-3	0	0	0	108.9	N170 N174 R240 A270	N170-D172 PolarHBondContact O-N 2.73Å; D172-N174 VanDerWaalsContact C-N 3.27Å; D172-N174 PolarHBondContact O-N 2.87Å; D172-N174 PolarHBondContact OD1-N 3.02Å; D172-R240 IonicContact OD2-CZ 3.47Å; D172-R240 IonicContact OD2-NH2 3.67Å; D172-R240 PolarHBondContact OD2-NH2 3.1Å; D172-A270 HydrophobicContact CB-CB 3.82Å
173	P	96	Very high	87	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.214	C	C	.	.			trans	-80.3	-7	-175.4	35.3	-37.5	0	0	0	113.3	L243 F245 C274	P173-L243 HydrophobicContact CB-CB 4.2Å; P173-L243 HydrophobicContact CB-CD1 3.94Å; P173-L243 HydrophobicContact CB-CG 4.33Å; P173-L243 PolarHBondContact O-N 3.47Å; P173-F245 HydrophobicContact CB-CD2 3.77Å; P173-F245 HydrophobicContact CB-CE2 3.82Å; P173-F245 HydrophobicContact CG-CD2 4.48Å; P173-C274 HydrophobicContact CG-CB 3.86Å
174	N	94.1	Very high	85.9	Confident	25 Å²	25	43 Å²	43	13%	0.134	22%	0.22	C	C	.	.	S	Bend	trans	-103.3	154.8	-172.4	-58	-43.7	0	0	0	111.2	D172 R240 D242 E273 K277	D172-N174 VanDerWaalsContact C-N 3.27Å; D172-N174 PolarHBondContact O-N 2.87Å; D172-N174 PolarHBondContact OD1-N 3.02Å; N174-R240 PolarHBondContact O-NE 3.45Å; N174-D242 WeakPolarHBondContact CA-OD1 3.46Å; N174-E273 PolarHBondContact ND2-OE1 2.85Å; N174-E273 PolarHBondContact ND2-OE2 3.19Å; N174-E273 VanDerWaalsContact ND2-OE2 3.12Å; N174-K277 PolarHBondContact OD1-NZ 3.43Å
175	A	90.4	Very high	84.6	Confident	34 Å²	34	45.9 Å²	45.9	28%	0.281	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-63	149.7	164.9	0	0	0	0	0	109.7	G177 R240 D242	A175-G177 PolarHBondContact O-N 3.44Å; A175-G177 VanDerWaalsContact O-N 3.1Å; A175-R240 WeakPolarHBondContact CB-O 3.29Å; A175-D242 PolarHBondContact N-OD1 2.94Å
176	K	83.1	Confident	83.2	Confident	54 Å²	54	51.4 Å²	51.4	24%	0.235	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-59.6	121.2	173.9	-76.4	-164.2	166.3	-171.7	0	109.6	D180 N238	K176-D180 HydrophobicContact CB-CB 4.34Å; K176-N238 HydrophobicContact CD-CB 4.45Å; K176-N238 WeakPolarHBondContact CE-OD1 3.34Å; K176-N238 PolarHBondContact NZ-OD1 2.98Å
177	G	73.5	Confident	82	Confident	30 Å²	30	54.3 Å²	54.3	31%	0.309	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-60.5	159.5	176	0	0	0	0	0	110.9	A175 M179 D180 W181	A175-G177 PolarHBondContact O-N 3.44Å; A175-G177 VanDerWaalsContact O-N 3.1Å; G177-M179 PolarHBondContact O-N 2.67Å; G177-D180 PolarHBondContact N-OD2 3.44Å; G177-D180 PolarHBondContact O-N 2.9Å; G177-D180 VanDerWaalsContact O-N 3.08Å; G177-W181 WeakPolarHBondContact O-CB 3.38Å; G177-W181 PolarHBondContact O-N 3.12Å
178	W	66.2	Low	80.7	Confident	192 Å²	192	55.9 Å²	55.9	73%	0.727	30%	0.295	S	S	*	.	H	α-helix	trans	-58.9	-30.8	178.5	69.4	-90.7	0	0	0	112.6	A182	W178-A182 WeakPolarHBondContact O-CB 3.34Å; W178-A182 PolarHBondContact O-N 3.27Å
179	M	63.6	Low	79.2	Confident	123 Å²	123	62.8 Å²	62.8	61%	0.606	33%	0.331	S	S	*	.	H	α-helix	trans	-68.4	-47	174.1	-70	-170.3	175.7	0	0	111.2	G177 W181 A182 A183	G177-M179 PolarHBondContact O-N 2.67Å; M179-W181 VanDerWaalsContact C-N 3.29Å; M179-W181 PolarHBondContact O-N 3.49Å; M179-A182 PolarHBondContact O-N 3.32Å; M179-A183 WeakPolarHBondContact O-CB 3.47Å; M179-A183 PolarHBondContact O-N 3.01Å
180	D	74.7	Confident	78.1	Confident	93 Å²	93	68.7 Å²	68.7	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-65.4	-36	177.3	-55.7	-38.9	0	0	0	111.5	K176 G177 H184	K176-D180 HydrophobicContact CB-CB 4.34Å; G177-D180 PolarHBondContact N-OD2 3.44Å; G177-D180 PolarHBondContact O-N 2.9Å; G177-D180 VanDerWaalsContact O-N 3.08Å; D180-H184 WeakPolarHBondContact O-CB 3.46Å; D180-H184 PolarHBondContact O-N 3.02Å
181	W	75.9	Confident	77.4	Confident	149 Å²	149	70.9 Å²	70.9	56%	0.564	38%	0.383	S	S	*	.	H	α-helix	trans	-63	-46.1	172.4	177.4	91.2	0	0	0	111.4	G177 M179 H184 K185	G177-W181 WeakPolarHBondContact O-CB 3.38Å; G177-W181 PolarHBondContact O-N 3.12Å; M179-W181 VanDerWaalsContact C-N 3.29Å; M179-W181 PolarHBondContact O-N 3.49Å; W181-H184 PolarHBondContact O-N 2.9Å; W181-K185 HydrophobicContact CD2-CG 4.11Å; W181-K185 HydrophobicContact CE3-CG 4.41Å; W181-K185 HydrophobicContact CH2-CG 4.17Å; W181-K185 HydrophobicContact CZ2-CD 4.34Å; W181-K185 HydrophobicContact CZ2-CG 3.86Å; W181-K185 HydrophobicContact CZ3-CG 4.43Å; W181-K185 WeakPolarHBondContact O-CG 2.98Å; W181-K185 PolarHBondContact O-N 3.03Å
182	A	52	Low	77.1	Confident	33 Å²	33	74 Å²	74	27%	0.273	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-44.8	178.3	0	0	0	0	0	111.4	W178 M179 H184 K185 L186	W178-A182 WeakPolarHBondContact O-CB 3.34Å; W178-A182 PolarHBondContact O-N 3.27Å; M179-A182 PolarHBondContact O-N 3.32Å; A182-H184 VanDerWaalsContact C-N 3.35Å; A182-H184 PolarHBondContact O-N 3.24Å; A182-K185 PolarHBondContact O-N 3.23Å; A182-L186 WeakPolarHBondContact O-CG 3.38Å; A182-L186 PolarHBondContact O-N 2.91Å
183	A	71.3	Confident	76.9	Confident	50 Å²	50	74.6 Å²	74.6	41%	0.413	41%	0.408	S	S	.	.	H	α-helix	trans	-58.9	-47	174.2	0	0	0	0	0	110.9	M179 K185 L186 T187	M179-A183 WeakPolarHBondContact O-CB 3.47Å; M179-A183 PolarHBondContact O-N 3.01Å; A183-K185 PolarHBondContact O-N 2.79Å; A183-L186 PolarHBondContact O-N 2.82Å; A183-T187 PolarHBondContact O-N 3.44Å; A183-T187 PolarHBondContact O-OG1 3.01Å
184	H	74.8	Confident	76.8	Confident	37 Å²	37	75 Å²	75	17%	0.171	41%	0.41	C	S	.	.	H	α-helix	trans	-59.5	-42.7	176.7	-180	-96.4	0	0	0	112.6	D180 W181 A182 T187 G188 W234	D180-H184 WeakPolarHBondContact O-CB 3.46Å; D180-H184 PolarHBondContact O-N 3.02Å; W181-H184 PolarHBondContact O-N 2.9Å; A182-H184 VanDerWaalsContact C-N 3.35Å; A182-H184 PolarHBondContact O-N 3.24Å; H184-T187 PolarHBondContact O-N 2.91Å; H184-G188 PolarHBondContact O-N 2.86Å; H184-W234 AromaticContact CD2-CZ2 3.89Å; H184-W234 AromaticContact NE2-CE2 3.69Å; H184-W234 AromaticContact NE2-CZ2 3.38Å; H184-W234 WeakPolarHBondContact NE2-CZ2 3.41Å; H184-W234 AromaticContact NE2-NE1 3.53Å
185	K	72.6	Confident	76.9	Confident	113 Å²	113	76.9 Å²	76.9	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-40.9	175.3	-72.4	-66.6	-180	-171.7	0	112.3	W181 A182 A183 G188 L189	W181-K185 HydrophobicContact CD2-CG 4.11Å; W181-K185 HydrophobicContact CE3-CG 4.41Å; W181-K185 HydrophobicContact CH2-CG 4.17Å; W181-K185 HydrophobicContact CZ2-CD 4.34Å; W181-K185 HydrophobicContact CZ2-CG 3.86Å; W181-K185 HydrophobicContact CZ3-CG 4.43Å; W181-K185 WeakPolarHBondContact O-CG 2.98Å; W181-K185 PolarHBondContact O-N 3.03Å; A182-K185 PolarHBondContact O-N 3.23Å; A183-K185 PolarHBondContact O-N 2.79Å; K185-G188 PolarHBondContact O-N 2.87Å; K185-L189 PolarHBondContact O-N 2.97Å
186	L	68.6	Low	77.1	Confident	117 Å²	117	76.4 Å²	76.4	61%	0.613	41%	0.41	S	S	*	.	H	α-helix	trans	-65.1	-46.6	176	-71.3	174.1	0	0	0	111.4	A182 A183 G188 L189	A182-L186 WeakPolarHBondContact O-CG 3.38Å; A182-L186 PolarHBondContact O-N 2.91Å; A183-L186 PolarHBondContact O-N 2.82Å; L186-G188 VanDerWaalsContact C-N 3.27Å; L186-G188 PolarHBondContact O-N 3.12Å; L186-L189 HydrophobicContact CD2-CD1 4.45Å; L186-L189 WeakPolarHBondContact O-CB 3.47Å; L186-L189 PolarHBondContact O-N 2.72Å; L186-L189 VanDerWaalsContact O-N 3.08Å
187	T	73.5	Confident	77.7	Confident	62 Å²	62	73.9 Å²	73.9	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-59.8	-39.7	174.4	-55.9	0	0	0	0	111.2	A183 H184 L189 T190 S191 M196	A183-T187 PolarHBondContact O-N 3.44Å; A183-T187 PolarHBondContact O-OG1 3.01Å; H184-T187 PolarHBondContact O-N 2.91Å; T187-L189 PolarHBondContact O-N 2.97Å; T187-T190 CarbonylContact O-C 3.6Å; T187-T190 PolarHBondContact O-N 2.91Å; T187-T190 PolarHBondContact O-OG1 3.15Å; T187-S191 WeakPolarHBondContact O-CB 3.25Å; T187-S191 PolarHBondContact O-N 3.29Å; T187-S191 PolarHBondContact O-OG 3.19Å; T187-M196 HydrophobicContact CG2-CG 4.17Å
188	G	72.5	Confident	78.8	Confident	35 Å²	35	72.4 Å²	72.4	36%	0.361	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-16.8	176.1	0	0	0	0	0	114.9	H184 K185 L186	H184-G188 PolarHBondContact O-N 2.86Å; K185-G188 PolarHBondContact O-N 2.87Å; L186-G188 VanDerWaalsContact C-N 3.27Å; L186-G188 PolarHBondContact O-N 3.12Å
189	L	67	Low	80.2	Confident	145 Å²	145	64.3 Å²	64.3	76%	0.759	36%	0.361	S	S	*	.	H	α-helix	trans	-79.9	-23.2	171.6	-65.2	173	0	0	0	112.6	K185 L186 T187	K185-L189 PolarHBondContact O-N 2.97Å; L186-L189 HydrophobicContact CD2-CD1 4.45Å; L186-L189 WeakPolarHBondContact O-CB 3.47Å; L186-L189 PolarHBondContact O-N 2.72Å; L186-L189 VanDerWaalsContact O-N 3.08Å; T187-L189 PolarHBondContact O-N 2.97Å
190	T	76.2	Confident	81.8	Confident	123 Å²	123	59.1 Å²	59.1	76%	0.755	34%	0.335	S	S	*	.	H	α-helix	trans	-116.5	-13	-171.6	56.3	0	0	0	0	114	T187	T187-T190 CarbonylContact O-C 3.6Å; T187-T190 PolarHBondContact O-N 2.91Å; T187-T190 PolarHBondContact O-OG1 3.15Å
191	S	83.9	Confident	82.9	Confident	46 Å²	46	54.8 Å²	54.8	32%	0.322	31%	0.312	S	S	.	.	S	Bend	trans	-127.5	143	-173.3	-58.4	0	0	0	0	111.4	T187	T187-S191 WeakPolarHBondContact O-CB 3.25Å; T187-S191 PolarHBondContact O-N 3.29Å; T187-S191 PolarHBondContact O-OG 3.19Å
192	S	92	Very high	83.9	Confident	66 Å²	66	47.7 Å²	47.7	46%	0.462	29%	0.285	S	S	.	.			trans	-70.9	160.3	171.8	67	0	0	0	0	110.9	E195 M196	S192-E195 PolarHBondContact O-N 2.97Å; S192-E195 VanDerWaalsContact O-N 3.16Å; S192-M196 PolarHBondContact O-N 2.94Å
193	I	92.2	Very high	85.9	Confident	39 Å²	39	46.9 Å²	46.9	20%	0.2	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-45.2	177.7	-62.9	175.2	0	0	0	112.4	E195 M196 I197 E231	I193-E195 VanDerWaalsContact C-N 3.32Å; I193-E195 PolarHBondContact O-N 3.23Å; I193-M196 HydrophobicContact CB-CE 4.28Å; I193-M196 HydrophobicContact CG1-CE 3.72Å; I193-M196 PolarHBondContact O-N 3.5Å; I193-M196 VanDerWaalsContact O-N 3.15Å; I193-I197 HydrophobicContact CG2-CD1 3.82Å; I193-I197 HydrophobicContact CG2-CG1 4.34Å; I193-I197 WeakPolarHBondContact O-CG1 3.17Å; I193-I197 PolarHBondContact O-N 3.44Å; I193-E231 HydrophobicContact CD1-CB 4.27Å; I193-E231 HydrophobicContact CD1-CG 3.74Å; I193-E231 VanDerWaalsContact CD1-OE1 3.28Å; I193-E231 WeakPolarHBondContact CD1-OE1 3.36Å; I193-E231 WeakPolarHBondContact CD1-OE2 3.23Å; I193-E231 HydrophobicContact CG2-CB 4.45Å
194	P	95.6	Very high	87	Confident	10 Å²	10	50.7 Å²	50.7	7%	0.065	29%	0.286	C	S	.	.	H	α-helix	trans	-54	-44.1	173.2	-30.2	37.2	0	0	0	113.8	I197 L198 I221 T222 L227	P194-I197 PolarHBondContact O-N 3.3Å; P194-L198 WeakPolarHBondContact O-CB 3.34Å; P194-L198 VanDerWaalsContact O-CG 3.28Å; P194-L198 WeakPolarHBondContact O-CG 3.43Å; P194-L198 PolarHBondContact O-N 2.87Å; P194-I221 HydrophobicContact CB-CG2 3.89Å; P194-T222 WeakPolarHBondContact CB-OG1 3.49Å; P194-L227 HydrophobicContact CG-CD1 4.14Å; P194-L227 HydrophobicContact CG-CD2 3.98Å
195	E	94.4	Very high	87.9	Confident	64 Å²	64	56.2 Å²	56.2	30%	0.299	31%	0.312	S	S	.	.	H	α-helix	trans	-70.4	-32.5	179	-68	-60.7	137.3	0	0	112.3	S192 I193 L198 G199 R218	S192-E195 PolarHBondContact O-N 2.97Å; S192-E195 VanDerWaalsContact O-N 3.16Å; I193-E195 VanDerWaalsContact C-N 3.32Å; I193-E195 PolarHBondContact O-N 3.23Å; E195-L198 PolarHBondContact O-N 3.27Å; E195-L198 WeakPolarHBondContact OE1-CD1 3.31Å; E195-G199 PolarHBondContact O-N 3.37Å; E195-R218 IonicContact OE1-CZ 3.13Å; E195-R218 IonicContact OE1-NE 2.63Å; E195-R218 PolarHBondContact OE1-NE 2.64Å; E195-R218 IonicContact OE2-NE 3.92Å; E195-R218 IonicContact OE2-NH2 3.66Å; E195-R218 PolarHBondContact OE2-NH2 2.81Å
196	M	94.6	Very high	89	Confident	24 Å²	24	52.6 Å²	52.6	12%	0.118	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-42.2	171.2	-72.2	-169.2	-74	0	0	112.2	T187 S192 I193 G199 H200 W234	T187-M196 HydrophobicContact CG2-CG 4.17Å; S192-M196 PolarHBondContact O-N 2.94Å; I193-M196 HydrophobicContact CB-CE 4.28Å; I193-M196 HydrophobicContact CG1-CE 3.72Å; I193-M196 PolarHBondContact O-N 3.5Å; I193-M196 VanDerWaalsContact O-N 3.15Å; M196-G199 PolarHBondContact O-N 3.4Å; M196-H200 PolarHBondContact O-N 2.9Å; M196-W234 HydrophobicContact CB-CZ2 4.3Å
197	I	96.5	Very high	90.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-40.4	176.3	-66.2	170.7	0	0	0	110.1	V71 I193 P194 G199 H200 L201 I221 I230 W234	V71-I197 HydrophobicContact CG1-CD1 4.35Å; V71-I197 HydrophobicContact CG1-CG1 4.45Å; I193-I197 HydrophobicContact CG2-CD1 3.82Å; I193-I197 HydrophobicContact CG2-CG1 4.34Å; I193-I197 WeakPolarHBondContact O-CG1 3.17Å; I193-I197 PolarHBondContact O-N 3.44Å; P194-I197 PolarHBondContact O-N 3.3Å; I197-G199 VanDerWaalsContact C-N 3.32Å; I197-G199 PolarHBondContact O-N 2.88Å; I197-H200 WeakPolarHBondContact O-CA 3.48Å; I197-H200 WeakPolarHBondContact O-CB 3.49Å; I197-H200 PolarHBondContact O-N 2.88Å; I197-L201 HydrophobicContact CG2-CD1 3.93Å; I197-L201 HydrophobicContact CG2-CG 4.31Å; I197-L201 WeakPolarHBondContact O-CG 3.48Å; I197-L201 PolarHBondContact O-N 3.34Å; I197-I221 HydrophobicContact CB-CG2 4.39Å; I197-I221 HydrophobicContact CD1-CG2 4.43Å; I197-I221 HydrophobicContact CG2-CD1 4.02Å; I197-I221 HydrophobicContact CG2-CG2 4.32Å; I197-I230 HydrophobicContact CD1-CG2 3.46Å; I197-I230 VanDerWaalsContact CD1-CG2 3.46Å; I197-W234 HydrophobicContact CD1-CB 4.49Å; I197-W234 HydrophobicContact CG1-CD2 4.12Å; I197-W234 HydrophobicContact CG1-CE3 4.35Å; I197-W234 HydrophobicContact CG1-CG 4.29Å
198	L	97.3	Very high	91.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-40.5	174.2	-75.8	164.9	0	0	0	112.2	P194 E195 H200 L201 F202 L207 R218 I221	P194-L198 WeakPolarHBondContact O-CB 3.34Å; P194-L198 VanDerWaalsContact O-CG 3.28Å; P194-L198 WeakPolarHBondContact O-CG 3.43Å; P194-L198 PolarHBondContact O-N 2.87Å; E195-L198 PolarHBondContact O-N 3.27Å; E195-L198 WeakPolarHBondContact OE1-CD1 3.31Å; L198-H200 PolarHBondContact O-N 3.47Å; L198-L201 PolarHBondContact O-N 3.04Å; L198-F202 HydrophobicContact CD2-CD2 3.98Å; L198-F202 HydrophobicContact CD2-CE2 3.99Å; L198-F202 PolarHBondContact O-N 3.49Å; L198-L207 HydrophobicContact CB-CD2 3.93Å; L198-R218 HydrophobicContact CD1-CB 3.72Å; L198-R218 HydrophobicContact CD1-CG 3.67Å; L198-R218 HydrophobicContact CD2-CB 4.23Å; L198-I221 HydrophobicContact CD2-CD1 3.84Å; L198-I221 HydrophobicContact CG-CD1 4.15Å
199	G	95.6	Very high	92.4	Very high	22 Å²	22	50.8 Å²	50.8	23%	0.227	30%	0.3	C	S	.	.	H	α-helix	trans	-66.9	-22.4	172.8	0	0	0	0	0	114.4	E195 M196 I197	E195-G199 PolarHBondContact O-N 3.37Å; M196-G199 PolarHBondContact O-N 3.4Å; I197-G199 VanDerWaalsContact C-N 3.32Å; I197-G199 PolarHBondContact O-N 2.88Å
200	H	96.2	Very high	93.7	Very high	14 Å²	14	46.8 Å²	46.8	7%	0.065	28%	0.279	C	S	.	.	H	α-helix	trans	-77.8	-38.6	169.2	166.8	82.2	0	0	0	111.8	D70 M196 I197 L198 W234 Y237 H267	D70-H200 VanDerWaalsContact CG-NE2 3.32Å; D70-H200 IonicContact OD1-NE2 3.8Å; D70-H200 PolarHBondContact OD1-NE2 3.41Å; D70-H200 VanDerWaalsContact OD1-NE2 3.13Å; D70-H200 IonicContact OD2-CD2 2.97Å; D70-H200 IonicContact OD2-CE1 3.79Å; D70-H200 IonicContact OD2-NE2 2.67Å; D70-H200 PolarHBondContact OD2-NE2 3.02Å; M196-H200 PolarHBondContact O-N 2.9Å; I197-H200 WeakPolarHBondContact O-CA 3.48Å; I197-H200 WeakPolarHBondContact O-CB 3.49Å; I197-H200 PolarHBondContact O-N 2.88Å; L198-H200 PolarHBondContact O-N 3.47Å; H200-W234 HydrophobicContact CB-CH2 3.72Å; H200-W234 HydrophobicContact CB-CZ3 3.73Å; H200-W234 AromaticContact CG-CZ3 3.66Å; H200-W234 AromaticContact ND1-CZ3 3.91Å; H200-Y237 AromaticContact CE1-CE1 3.36Å; H200-Y237 WeakPolarHBondContact CE1-CE1 3.38Å; H200-Y237 AromaticContact CE1-CZ 3.65Å; H200-Y237 AromaticContact ND1-CE1 3.67Å; H200-H267 AromaticContact CE1-CE1 3.32Å; H200-H267 PolarHBondContact CE1-CE1 2.93Å; H200-H267 AromaticContact CE1-NE2 3.42Å; H200-H267 PolarHBondContact CE1-NE2 3.35Å; H200-H267 AromaticContact ND1-CE1 3.25Å; H200-H267 PolarHBondContact ND1-CE1 2.95Å; H200-H267 VanDerWaalsContact ND1-CE1 3.25Å; H200-H267 AromaticContact ND1-NE2 3.5Å; H200-H267 PolarHBondContact ND1-NE2 3.07Å; H200-H267 PolarHBondContact O-NE2 2.95Å
201	L	97.5	Very high	94.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-82.6	-29.7	-175.8	-66.3	174.3	0	0	0	113.7	D70 L73 I197 L198 I221 G293 Q294	D70-L201 HydrophobicContact CB-CD2 4.1Å; L73-L201 HydrophobicContact CD1-CD2 4.2Å; L73-L201 HydrophobicContact CD2-CD1 4.03Å; L73-L201 HydrophobicContact CG-CD1 4.2Å; L73-L201 HydrophobicContact CG-CD2 4.38Å; I197-L201 HydrophobicContact CG2-CD1 3.93Å; I197-L201 HydrophobicContact CG2-CG 4.31Å; I197-L201 WeakPolarHBondContact O-CG 3.48Å; I197-L201 PolarHBondContact O-N 3.34Å; L198-L201 PolarHBondContact O-N 3.04Å; L201-I221 HydrophobicContact CD1-CD1 3.61Å; L201-G293 CarbonylContact O-C 3.29Å; L201-G293 VanDerWaalsContact O-C 3.29Å; L201-G293 VanDerWaalsContact O-CA 3.27Å; L201-G293 WeakPolarHBondContact O-CA 3.34Å; L201-Q294 VanDerWaalsContact CD2-NE2 3.33Å; L201-Q294 PolarHBondContact O-NE2 3.18Å
202	F	97.4	Very high	95.3	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	29%	0.286	C	S	.	.	S	Bend	trans	-134.8	150.2	-171.8	-58	-75.2	0	0	0	111.7	L198 E206 L207 L213 I214 Y217 P266 Q294	L198-F202 HydrophobicContact CD2-CD2 3.98Å; L198-F202 HydrophobicContact CD2-CE2 3.99Å; L198-F202 PolarHBondContact O-N 3.49Å; F202-E206 HydrophobicContact CB-CB 4.21Å; F202-L207 HydrophobicContact CB-CD2 3.96Å; F202-L207 HydrophobicContact CB-CG 4.09Å; F202-L207 HydrophobicContact CD2-CD2 4.36Å; F202-L213 HydrophobicContact CE1-CD2 4.49Å; F202-I214 HydrophobicContact CB-CD1 3.97Å; F202-I214 HydrophobicContact CD1-CD1 3.28Å; F202-I214 HydrophobicContact CD2-CD1 3.78Å; F202-I214 HydrophobicContact CE1-CD1 3.58Å; F202-I214 HydrophobicContact CE2-CD1 4.04Å; F202-I214 HydrophobicContact CG-CD1 3.39Å; F202-I214 HydrophobicContact CZ-CD1 3.95Å; F202-Y217 HydrophobicContact CE2-CG 4.25Å; F202-Y217 HydrophobicContact CZ-CD1 4.3Å; F202-Y217 HydrophobicContact CZ-CD2 4.34Å; F202-Y217 AromaticContact CZ-CG 3.93Å; F202-Y217 HydrophobicContact CZ-CG 3.93Å; F202-P266 WeakPolarHBondContact O-CG 3.47Å; F202-Q294 HydrophobicContact CD1-CG 4.02Å; F202-Q294 HydrophobicContact CE1-CB 4.07Å; F202-Q294 HydrophobicContact CE1-CG 3.45Å; F202-Q294 VanDerWaalsContact CE1-CG 3.45Å; F202-Q294 HydrophobicContact CZ-CG 3.86Å
203	S	95	Very high	95.5	Very high	15 Å²	15	48.9 Å²	48.9	11%	0.105	28%	0.276	C	S	.	.			trans	-67.6	158.4	174.1	65.6	0	0	0	0	111.8	E205 E206 L207 Q264	S203-E205 PolarHBondContact O-N 3.2Å; S203-E206 WeakPolarHBondContact CB-OE2 3.49Å; S203-E206 PolarHBondContact N-OE2 3.38Å; S203-E206 PolarHBondContact O-N 3.37Å; S203-E206 WeakPolarHBondContact OG-CB 3.38Å; S203-E206 VanDerWaalsContact OG-CG 3.22Å; S203-E206 WeakPolarHBondContact OG-CG 3.44Å; S203-E206 PolarHBondContact OG-N 3.18Å; S203-E206 PolarHBondContact OG-OE2 2.94Å; S203-L207 WeakPolarHBondContact O-CG 3.35Å; S203-L207 PolarHBondContact O-N 3.15Å; S203-Q264 WeakPolarHBondContact CB-O 3.44Å
204	Q	92.7	Very high	95.8	Very high	131 Å²	131	47.1 Å²	47.1	61%	0.612	27%	0.267	S	S	*	.	H	α-helix	trans	-62.2	-31.9	176.4	-66.6	-60.1	-25.7	0	0	112.6	S208	Q204-S208 WeakPolarHBondContact O-CB 3.45Å; Q204-S208 PolarHBondContact O-N 3.26Å; Q204-S208 PolarHBondContact O-OG 2.67Å
205	E	93.8	Very high	95.9	Very high	152 Å²	152	51.5 Å²	51.5	71%	0.71	29%	0.286	S	S	*	.	H	α-helix	trans	-65.1	-45.7	174.7	-174.6	174.9	179.2	0	0	111.2	S203 S208 G209	S203-E205 PolarHBondContact O-N 3.2Å; E205-S208 PolarHBondContact O-N 2.94Å; E205-G209 PolarHBondContact O-N 3.14Å
206	E	95.6	Very high	96.1	Very high	37 Å²	37	54 Å²	54	17%	0.173	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-45.6	175.2	-74.1	170	105.6	0	0	111.8	F202 S203 S208 G209 N210 I214 G292 G293	F202-E206 HydrophobicContact CB-CB 4.21Å; S203-E206 WeakPolarHBondContact CB-OE2 3.49Å; S203-E206 PolarHBondContact N-OE2 3.38Å; S203-E206 PolarHBondContact O-N 3.37Å; S203-E206 WeakPolarHBondContact OG-CB 3.38Å; S203-E206 VanDerWaalsContact OG-CG 3.22Å; S203-E206 WeakPolarHBondContact OG-CG 3.44Å; S203-E206 PolarHBondContact OG-N 3.18Å; S203-E206 PolarHBondContact OG-OE2 2.94Å; E206-S208 VanDerWaalsContact C-N 3.29Å; E206-S208 PolarHBondContact O-N 3.4Å; E206-G209 PolarHBondContact O-N 3.13Å; E206-N210 PolarHBondContact O-N 3.32Å; E206-I214 HydrophobicContact CB-CD1 4.06Å; E206-I214 HydrophobicContact CB-CG1 4.38Å; E206-G292 WeakPolarHBondContact OE2-CA 3.41Å; E206-G293 PolarHBondContact OE1-N 3.17Å; E206-G293 PolarHBondContact OE2-N 3.01Å
207	L	95.8	Very high	96.2	Very high	17 Å²	17	53 Å²	53	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-38.8	179.5	-67.9	175.9	0	0	0	112.3	L198 F202 S203 I214	L198-L207 HydrophobicContact CB-CD2 3.93Å; F202-L207 HydrophobicContact CB-CD2 3.96Å; F202-L207 HydrophobicContact CB-CG 4.09Å; F202-L207 HydrophobicContact CD2-CD2 4.36Å; S203-L207 WeakPolarHBondContact O-CG 3.35Å; S203-L207 PolarHBondContact O-N 3.15Å; L207-I214 HydrophobicContact CD2-CG2 4.03Å
208	S	95.4	Very high	96.3	Very high	98 Å²	98	55.7 Å²	55.7	69%	0.685	30%	0.301	S	S	*	.	H	α-helix	trans	-72.2	-39.3	176.2	-56.9	0	0	0	0	112	Q204 E205 E206 N210	Q204-S208 WeakPolarHBondContact O-CB 3.45Å; Q204-S208 PolarHBondContact O-N 3.26Å; Q204-S208 PolarHBondContact O-OG 2.67Å; E205-S208 PolarHBondContact O-N 2.94Å; E206-S208 VanDerWaalsContact C-N 3.29Å; E206-S208 PolarHBondContact O-N 3.4Å; S208-N210 PolarHBondContact O-N 3.43Å
209	G	95.2	Very high	96.3	Very high	62 Å²	62	60.1 Å²	60.1	64%	0.639	33%	0.325	S	S	*	.	H	α-helix	trans	-65.8	-27.5	176	0	0	0	0	0	113.2	E205 E206 S211	E205-G209 PolarHBondContact O-N 3.14Å; E206-G209 PolarHBondContact O-N 3.13Å; G209-S211 VanDerWaalsContact C-N 3.31Å; G209-S211 PolarHBondContact O-N 2.67Å
210	N	95.5	Very high	96.3	Very high	60 Å²	60	62.1 Å²	62.1	32%	0.321	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	45.8	169.3	-167.9	44.6	0	0	0	113.8	E206 S208 Q215 R218	E206-N210 PolarHBondContact O-N 3.32Å; S208-N210 PolarHBondContact O-N 3.43Å; N210-Q215 PolarHBondContact ND2-NE2 2.87Å; N210-Q215 PolarHBondContact O-NE2 3.44Å; N210-Q215 VanDerWaalsContact OD1-CG 3.3Å; N210-Q215 WeakPolarHBondContact OD1-CG 3.43Å; N210-R218 PolarHBondContact OD1-NH1 3.17Å
211	S	96.6	Very high	96.3	Very high	61 Å²	61	61.5 Å²	61.5	43%	0.427	33%	0.327	S	S	.	.			trans	-59.4	168	176.8	73.1	0	0	0	0	112.3	G209 L213 I214 Q215	G209-S211 VanDerWaalsContact C-N 3.31Å; G209-S211 PolarHBondContact O-N 2.67Å; S211-L213 PolarHBondContact O-N 3.37Å; S211-I214 PolarHBondContact O-N 2.96Å; S211-I214 PolarHBondContact OG-N 3.18Å; S211-Q215 WeakPolarHBondContact O-CG 3.42Å; S211-Q215 PolarHBondContact O-N 3.45Å
212	E	97.4	Very high	96.3	Very high	171 Å²	171	64 Å²	64	80%	0.799	34%	0.342	S	S	*	.	H	α-helix	trans	-55.3	-35.9	176.1	-65.9	-177.9	-179.9	0	0	112.5	K216	E212-K216 VanDerWaalsContact O-CB 3.29Å; E212-K216 WeakPolarHBondContact O-CB 3.23Å; E212-K216 PolarHBondContact O-N 2.85Å
213	L	96.2	Very high	96.2	Very high	48 Å²	48	70.4 Å²	70.4	25%	0.251	37%	0.372	S	S	.	.	H	α-helix	trans	-61.4	-51	174.3	-174.2	71.2	0	0	0	110.4	F202 S211 Q215 K216 Y217 L297 T298	F202-L213 HydrophobicContact CE1-CD2 4.49Å; S211-L213 PolarHBondContact O-N 3.37Å; L213-Q215 VanDerWaalsContact C-N 3.35Å; L213-Q215 PolarHBondContact O-N 2.89Å; L213-K216 WeakPolarHBondContact O-CB 3.25Å; L213-K216 PolarHBondContact O-N 2.87Å; L213-Y217 HydrophobicContact CD1-CD2 3.85Å; L213-Y217 HydrophobicContact CD1-CE2 3.48Å; L213-Y217 VanDerWaalsContact CD1-CE2 3.48Å; L213-Y217 HydrophobicContact CG-CD2 4.13Å; L213-Y217 HydrophobicContact CG-CE2 4.22Å; L213-Y217 VanDerWaalsContact O-CD2 3.31Å; L213-Y217 WeakPolarHBondContact O-CD2 3.25Å; L213-Y217 PolarHBondContact O-N 3.39Å; L213-L297 HydrophobicContact CD2-CB 4.39Å; L213-T298 HydrophobicContact CD2-CG2 3.77Å
214	I	97.3	Very high	96.2	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-42.9	-179.5	-60.7	-57.6	0	0	0	111.3	F202 E206 L207 S211 K216 Y217 R218	F202-I214 HydrophobicContact CB-CD1 3.97Å; F202-I214 HydrophobicContact CD1-CD1 3.28Å; F202-I214 HydrophobicContact CD2-CD1 3.78Å; F202-I214 HydrophobicContact CE1-CD1 3.58Å; F202-I214 HydrophobicContact CE2-CD1 4.04Å; F202-I214 HydrophobicContact CG-CD1 3.39Å; F202-I214 HydrophobicContact CZ-CD1 3.95Å; E206-I214 HydrophobicContact CB-CD1 4.06Å; E206-I214 HydrophobicContact CB-CG1 4.38Å; L207-I214 HydrophobicContact CD2-CG2 4.03Å; S211-I214 PolarHBondContact O-N 2.96Å; S211-I214 PolarHBondContact OG-N 3.18Å; I214-K216 VanDerWaalsContact C-N 3.32Å; I214-K216 PolarHBondContact O-N 3.32Å; I214-Y217 PolarHBondContact O-N 3.36Å; I214-R218 VanDerWaalsContact O-CB 3.22Å; I214-R218 WeakPolarHBondContact O-CB 3.38Å; I214-R218 PolarHBondContact O-N 3.31Å
215	Q	97.9	Very high	96.3	Very high	102 Å²	102	69.9 Å²	69.9	48%	0.477	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-42.5	175.8	-68	177.3	18.4	0	0	111.7	N210 S211 L213 N219	N210-Q215 PolarHBondContact ND2-NE2 2.87Å; N210-Q215 PolarHBondContact O-NE2 3.44Å; N210-Q215 VanDerWaalsContact OD1-CG 3.3Å; N210-Q215 WeakPolarHBondContact OD1-CG 3.43Å; S211-Q215 WeakPolarHBondContact O-CG 3.42Å; S211-Q215 PolarHBondContact O-N 3.45Å; L213-Q215 VanDerWaalsContact C-N 3.35Å; L213-Q215 PolarHBondContact O-N 2.89Å; Q215-N219 VanDerWaalsContact O-CB 3.31Å; Q215-N219 WeakPolarHBondContact O-CB 3.34Å; Q215-N219 PolarHBondContact O-N 3.08Å
216	K	97.9	Very high	96.3	Very high	117 Å²	117	63.5 Å²	63.5	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-60.6	-51.2	176	178.4	-175.9	176.1	-175.3	0	111.5	E212 L213 I214 N219 I220	E212-K216 VanDerWaalsContact O-CB 3.29Å; E212-K216 WeakPolarHBondContact O-CB 3.23Å; E212-K216 PolarHBondContact O-N 2.85Å; L213-K216 WeakPolarHBondContact O-CB 3.25Å; L213-K216 PolarHBondContact O-N 2.87Å; I214-K216 VanDerWaalsContact C-N 3.32Å; I214-K216 PolarHBondContact O-N 3.32Å; K216-N219 WeakPolarHBondContact O-CB 3.47Å; K216-N219 PolarHBondContact O-N 3.35Å; K216-I220 HydrophobicContact CG-CD1 3.96Å; K216-I220 VanDerWaalsContact O-CG1 3.31Å; K216-I220 WeakPolarHBondContact O-CG1 3.36Å; K216-I220 PolarHBondContact O-N 3.33Å
217	Y	97.9	Very high	96.4	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-70.6	-36.2	-177.7	-81.6	-99.7	0	0	0	112.4	L73 S77 F202 L213 I214 N219 I220 I221 L297	L73-Y217 HydrophobicContact CD2-CD1 3.59Å; L73-Y217 HydrophobicContact CD2-CE1 3.55Å; S77-Y217 WeakPolarHBondContact O-CE1 3.37Å; S77-Y217 PolarHBondContact O-OH 2.99Å; F202-Y217 HydrophobicContact CE2-CG 4.25Å; F202-Y217 HydrophobicContact CZ-CD1 4.3Å; F202-Y217 HydrophobicContact CZ-CD2 4.34Å; F202-Y217 AromaticContact CZ-CG 3.93Å; F202-Y217 HydrophobicContact CZ-CG 3.93Å; L213-Y217 HydrophobicContact CD1-CD2 3.85Å; L213-Y217 HydrophobicContact CD1-CE2 3.48Å; L213-Y217 VanDerWaalsContact CD1-CE2 3.48Å; L213-Y217 HydrophobicContact CG-CD2 4.13Å; L213-Y217 HydrophobicContact CG-CE2 4.22Å; L213-Y217 VanDerWaalsContact O-CD2 3.31Å; L213-Y217 WeakPolarHBondContact O-CD2 3.25Å; L213-Y217 PolarHBondContact O-N 3.39Å; I214-Y217 PolarHBondContact O-N 3.36Å; Y217-N219 VanDerWaalsContact C-N 3.3Å; Y217-N219 PolarHBondContact O-N 2.99Å; Y217-I220 PolarHBondContact O-N 3.27Å; Y217-I221 WeakPolarHBondContact O-CG1 3.14Å; Y217-I221 PolarHBondContact O-N 2.8Å; Y217-L297 HydrophobicContact CE1-CD1 3.81Å; Y217-L297 HydrophobicContact CE2-CD1 3.81Å; Y217-L297 WeakPolarHBondContact OH-CD1 3.34Å; Y217-L297 WeakPolarHBondContact OH-CD2 3.22Å
218	R	97.8	Very high	96.4	Very high	56 Å²	56	67.8 Å²	67.8	21%	0.211	38%	0.376	C	S	.	.	H	α-helix	trans	-58.5	-44.2	170.1	178.2	175.3	-72.5	119.6	-3.6	111.3	E195 L198 N210 I214 T222	E195-R218 IonicContact OE1-CZ 3.13Å; E195-R218 IonicContact OE1-NE 2.63Å; E195-R218 PolarHBondContact OE1-NE 2.64Å; E195-R218 IonicContact OE2-NE 3.92Å; E195-R218 IonicContact OE2-NH2 3.66Å; E195-R218 PolarHBondContact OE2-NH2 2.81Å; L198-R218 HydrophobicContact CD1-CB 3.72Å; L198-R218 HydrophobicContact CD1-CG 3.67Å; L198-R218 HydrophobicContact CD2-CB 4.23Å; N210-R218 PolarHBondContact OD1-NH1 3.17Å; I214-R218 VanDerWaalsContact O-CB 3.22Å; I214-R218 WeakPolarHBondContact O-CB 3.38Å; I214-R218 PolarHBondContact O-N 3.31Å; R218-T222 WeakPolarHBondContact O-CB 3.4Å; R218-T222 PolarHBondContact O-N 2.9Å; R218-T222 PolarHBondContact O-OG1 3.09Å
219	N	97.4	Very high	96.5	Very high	92 Å²	92	63.1 Å²	63.1	49%	0.492	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-45	176.9	-172.3	24.3	0	0	0	112.1	Q215 K216 Y217 I221 H223	Q215-N219 VanDerWaalsContact O-CB 3.31Å; Q215-N219 WeakPolarHBondContact O-CB 3.34Å; Q215-N219 PolarHBondContact O-N 3.08Å; K216-N219 WeakPolarHBondContact O-CB 3.47Å; K216-N219 PolarHBondContact O-N 3.35Å; Y217-N219 VanDerWaalsContact C-N 3.3Å; Y217-N219 PolarHBondContact O-N 2.99Å; N219-I221 PolarHBondContact O-N 3.27Å; N219-H223 WeakPolarHBondContact O-CB 3.47Å; N219-H223 PolarHBondContact O-N 3.27Å; N219-H223 VanDerWaalsContact O-N 3.12Å; N219-H223 PolarHBondContact O-ND1 3.22Å; N219-H223 PolarHBondContact OD1-CE1 3.36Å; N219-H223 PolarHBondContact OD1-ND1 2.86Å
220	I	96	Very high	96.7	Very high	65 Å²	65	60.6 Å²	60.6	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-57.2	-49.1	178.1	-71.6	165.8	0	0	0	111	K216 Y217 A224	K216-I220 HydrophobicContact CG-CD1 3.96Å; K216-I220 VanDerWaalsContact O-CG1 3.31Å; K216-I220 WeakPolarHBondContact O-CG1 3.36Å; K216-I220 PolarHBondContact O-N 3.33Å; Y217-I220 PolarHBondContact O-N 3.27Å; I220-A224 WeakPolarHBondContact O-CB 3.36Å; I220-A224 PolarHBondContact O-N 3.35Å
221	I	96.8	Very high	96.7	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-75.3	-45.3	-173.8	-62.5	165.5	0	0	0	110.8	P194 I197 L198 L201 Y217 N219 H223 A224	P194-I221 HydrophobicContact CB-CG2 3.89Å; I197-I221 HydrophobicContact CB-CG2 4.39Å; I197-I221 HydrophobicContact CD1-CG2 4.43Å; I197-I221 HydrophobicContact CG2-CD1 4.02Å; I197-I221 HydrophobicContact CG2-CG2 4.32Å; L198-I221 HydrophobicContact CD2-CD1 3.84Å; L198-I221 HydrophobicContact CG-CD1 4.15Å; L201-I221 HydrophobicContact CD1-CD1 3.61Å; Y217-I221 WeakPolarHBondContact O-CG1 3.14Å; Y217-I221 PolarHBondContact O-N 2.8Å; N219-I221 PolarHBondContact O-N 3.27Å; I221-H223 VanDerWaalsContact C-N 3.32Å; I221-H223 PolarHBondContact O-N 3.29Å; I221-A224 WeakPolarHBondContact O-CB 3.35Å; I221-A224 PolarHBondContact O-N 2.95Å
222	T	96.3	Very high	96.8	Very high	54 Å²	54	60.2 Å²	60.2	33%	0.331	31%	0.306	S	S	.	.	H	α-helix	trans	-66.6	-33.5	-176.7	-62.9	0	0	0	0	112.9	P194 R218	P194-T222 WeakPolarHBondContact CB-OG1 3.49Å; R218-T222 WeakPolarHBondContact O-CB 3.4Å; R218-T222 PolarHBondContact O-N 2.9Å; R218-T222 PolarHBondContact O-OG1 3.09Å
223	H	95.7	Very high	96.9	Very high	135 Å²	135	52 Å²	52	63%	0.625	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	20.2	-179.3	-54.9	100.6	0	0	0	112.9	N219 I221	N219-H223 WeakPolarHBondContact O-CB 3.47Å; N219-H223 PolarHBondContact O-N 3.27Å; N219-H223 VanDerWaalsContact O-N 3.12Å; N219-H223 PolarHBondContact O-ND1 3.22Å; N219-H223 PolarHBondContact OD1-CE1 3.36Å; N219-H223 PolarHBondContact OD1-ND1 2.86Å; I221-H223 VanDerWaalsContact C-N 3.32Å; I221-H223 PolarHBondContact O-N 3.29Å
224	A	95.6	Very high	96.9	Very high	16 Å²	16	50.1 Å²	50.1	13%	0.132	26%	0.257	C	S	.	.			trans	-61.9	125.2	176	0	0	0	0	0	110	I220 I221 N226 L227 I230	I220-A224 WeakPolarHBondContact O-CB 3.36Å; I220-A224 PolarHBondContact O-N 3.35Å; I221-A224 WeakPolarHBondContact O-CB 3.35Å; I221-A224 PolarHBondContact O-N 2.95Å; A224-N226 PolarHBondContact O-N 2.84Å; A224-L227 HydrophobicContact CB-CB 4.39Å; A224-L227 PolarHBondContact O-N 2.83Å; A224-I230 HydrophobicContact CB-CD1 3.64Å
225	P	93.9	Very high	96.9	Very high	119 Å²	119	53 Å²	53	77%	0.773	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.1	179.5	28	-35	0	0	0	112.6
226	N	94.7	Very high	96.9	Very high	19 Å²	19	48.7 Å²	48.7	10%	0.102	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	31.3	178.6	64.6	-28.6	0	0	0	112.3	G104 A224 D228 N229 I230	G104-N226 PolarHBondContact O-ND2 2.8Å; A224-N226 PolarHBondContact O-N 2.84Å; N226-D228 PolarHBondContact O-N 3.17Å; N226-D228 VanDerWaalsContact O-N 3.17Å; N226-N229 HydrophobicContact CB-CB 4.25Å; N226-N229 WeakPolarHBondContact O-CA 3.38Å; N226-N229 WeakPolarHBondContact O-CB 3.49Å; N226-N229 PolarHBondContact O-N 3.5Å; N226-I230 PolarHBondContact O-N 3.25Å; N226-I230 VanDerWaalsContact O-N 3.12Å
227	L	96.4	Very high	96.9	Very high	43 Å²	43	43.2 Å²	43.2	23%	0.225	23%	0.23	C	C	.	.	H	α-helix	trans	-54	-35.8	-179.2	-177.8	59.9	0	0	0	113	P194 A224 N229 I230 E231	P194-L227 HydrophobicContact CG-CD1 4.14Å; P194-L227 HydrophobicContact CG-CD2 3.98Å; A224-L227 HydrophobicContact CB-CB 4.39Å; A224-L227 PolarHBondContact O-N 2.83Å; L227-N229 VanDerWaalsContact C-N 3.31Å; L227-N229 PolarHBondContact O-N 2.8Å; L227-I230 HydrophobicContact CD1-CB 4.47Å; L227-I230 WeakPolarHBondContact O-CB 3.43Å; L227-I230 PolarHBondContact O-N 2.87Å; L227-E231 PolarHBondContact O-N 3.13Å
228	D	96.5	Very high	96.8	Very high	100 Å²	100	43.9 Å²	43.9	54%	0.535	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-37.1	175.9	-61.4	-27.1	0	0	0	112	V111 N226 E231 L232	V111-D228 HydrophobicContact CG1-CB 3.89Å; N226-D228 PolarHBondContact O-N 3.17Å; N226-D228 VanDerWaalsContact O-N 3.17Å; D228-E231 PolarHBondContact O-N 3.42Å; D228-L232 WeakPolarHBondContact O-CG 3.3Å; D228-L232 PolarHBondContact O-N 2.88Å; D228-L232 VanDerWaalsContact O-N 3.16Å
229	N	98.3	Very high	96.6	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-45.4	173.9	-64.5	-1.9	0	0	0	110.2	G104 M105 P110 V111 F112 N226 L227 E231 L232 Y233	G104-N229 PolarHBondContact O-ND2 3.12Å; G104-N229 VanDerWaalsContact O-ND2 3.08Å; M105-N229 HydrophobicContact CE-CB 4.06Å; M105-N229 VanDerWaalsContact CE-O 3.23Å; M105-N229 WeakPolarHBondContact CE-O 3.41Å; P110-N229 PolarHBondContact O-ND2 3.24Å; V111-N229 WeakPolarHBondContact CA-OD1 3.27Å; F112-N229 HydrophobicContact CD2-CB 4.17Å; F112-N229 VanDerWaalsContact CD2-CG 3.49Å; F112-N229 VanDerWaalsContact CD2-OD1 3.27Å; F112-N229 WeakPolarHBondContact CD2-OD1 3.5Å; F112-N229 HydrophobicContact CE2-CB 4.46Å; F112-N229 PolarHBondContact N-OD1 3.32Å; N226-N229 HydrophobicContact CB-CB 4.25Å; N226-N229 WeakPolarHBondContact O-CA 3.38Å; N226-N229 WeakPolarHBondContact O-CB 3.49Å; N226-N229 PolarHBondContact O-N 3.5Å; L227-N229 VanDerWaalsContact C-N 3.31Å; L227-N229 PolarHBondContact O-N 2.8Å; N229-E231 PolarHBondContact O-N 3.43Å; N229-L232 WeakPolarHBondContact O-CB 3.35Å; N229-L232 PolarHBondContact O-N 2.86Å; N229-Y233 PolarHBondContact O-N 2.57Å; N229-Y233 VanDerWaalsContact O-N 3.08Å
230	I	98.1	Very high	96.6	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-41	177.6	-66.9	172.4	0	0	0	110.6	V71 M105 I197 A224 N226 L227 L232 Y233 W234	V71-I230 HydrophobicContact CG1-CG2 4.48Å; M105-I230 HydrophobicContact SD-CB 4.46Å; M105-I230 HydrophobicContact SD-CG1 3.77Å; I197-I230 HydrophobicContact CD1-CG2 3.46Å; I197-I230 VanDerWaalsContact CD1-CG2 3.46Å; A224-I230 HydrophobicContact CB-CD1 3.64Å; N226-I230 PolarHBondContact O-N 3.25Å; N226-I230 VanDerWaalsContact O-N 3.12Å; L227-I230 HydrophobicContact CD1-CB 4.47Å; L227-I230 WeakPolarHBondContact O-CB 3.43Å; L227-I230 PolarHBondContact O-N 2.87Å; I230-L232 PolarHBondContact O-N 3.5Å; I230-Y233 PolarHBondContact O-N 3.1Å; I230-W234 WeakPolarHBondContact O-CB 3.3Å; I230-W234 PolarHBondContact O-N 3.04Å
231	E	96.9	Very high	96.6	Very high	68 Å²	68	48.8 Å²	48.8	32%	0.318	25%	0.251	S	S	.	.	H	α-helix	trans	-61.3	-41.2	174.6	176.3	174.7	-175.7	0	0	112.1	I193 L227 D228 N229 Y233 W234 N235	I193-E231 HydrophobicContact CD1-CB 4.27Å; I193-E231 HydrophobicContact CD1-CG 3.74Å; I193-E231 VanDerWaalsContact CD1-OE1 3.28Å; I193-E231 WeakPolarHBondContact CD1-OE1 3.36Å; I193-E231 WeakPolarHBondContact CD1-OE2 3.23Å; I193-E231 HydrophobicContact CG2-CB 4.45Å; L227-E231 PolarHBondContact O-N 3.13Å; D228-E231 PolarHBondContact O-N 3.42Å; N229-E231 PolarHBondContact O-N 3.43Å; E231-Y233 VanDerWaalsContact C-N 3.33Å; E231-Y233 PolarHBondContact O-N 2.8Å; E231-W234 WeakPolarHBondContact O-CB 3.21Å; E231-W234 PolarHBondContact O-N 3.09Å; E231-N235 WeakPolarHBondContact O-CB 3.47Å; E231-N235 VanDerWaalsContact O-CG 3.24Å; E231-N235 PolarHBondContact O-N 3Å; E231-N235 PolarHBondContact O-ND2 2.76Å; E231-N235 VanDerWaalsContact O-ND2 3.15Å
232	L	98.1	Very high	96.6	Very high	45 Å²	45	51.7 Å²	51.7	24%	0.236	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-42.8	175.2	-69.2	170.9	0	0	0	111.8	F112 Y116 Y118 D228 N229 I230 N235 S236	F112-L232 HydrophobicContact CB-CD1 4.1Å; F112-L232 HydrophobicContact CD2-CD1 4.04Å; F112-L232 HydrophobicContact CG-CD1 4.48Å; Y116-L232 HydrophobicContact CD1-CD1 4.27Å; Y118-L232 HydrophobicContact CD1-CB 4.39Å; Y118-L232 HydrophobicContact CD2-CB 3.75Å; Y118-L232 HydrophobicContact CD2-CD1 4.2Å; Y118-L232 HydrophobicContact CE2-CB 4.49Å; Y118-L232 HydrophobicContact CG-CB 3.69Å; D228-L232 WeakPolarHBondContact O-CG 3.3Å; D228-L232 PolarHBondContact O-N 2.88Å; D228-L232 VanDerWaalsContact O-N 3.16Å; N229-L232 WeakPolarHBondContact O-CB 3.35Å; N229-L232 PolarHBondContact O-N 2.86Å; I230-L232 PolarHBondContact O-N 3.5Å; L232-N235 PolarHBondContact O-N 2.88Å; L232-S236 PolarHBondContact O-N 2.89Å
233	Y	98.6	Very high	96.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-68.8	-39.1	176.3	-176.2	-148.2	0	0	0	112.5	H69 V71 A102 M105 Y118 L121 L124 A147 I151 N229 I230 E231 N235 S236 Y237	H69-Y233 PolarHBondContact O-OH 3.43Å; V71-Y233 HydrophobicContact CB-CD1 4.31Å; V71-Y233 HydrophobicContact CB-CE1 4.43Å; V71-Y233 HydrophobicContact CG1-CD1 4.4Å; V71-Y233 HydrophobicContact CG2-CD1 3.95Å; V71-Y233 HydrophobicContact CG2-CE1 3.93Å; V71-Y233 HydrophobicContact CG2-CG 4.26Å; A102-Y233 HydrophobicContact CB-CD1 4.24Å; A102-Y233 HydrophobicContact CB-CE1 3.91Å; A102-Y233 HydrophobicContact CB-CE2 4.43Å; M105-Y233 VanDerWaalsContact CE-CB 3.44Å; M105-Y233 HydrophobicContact CE-CD1 4.23Å; M105-Y233 HydrophobicContact CE-CG 4.15Å; M105-Y233 HydrophobicContact CG-CD1 4.34Å; M105-Y233 HydrophobicContact SD-CD1 4.41Å; Y118-Y233 AromaticContact CE1-CD2 3.9Å; Y118-Y233 HydrophobicContact CE1-CD2 3.9Å; Y118-Y233 HydrophobicContact CE1-CG 4.23Å; L121-Y233 HydrophobicContact CD2-CD2 4.49Å; L121-Y233 HydrophobicContact CD2-CE2 3.93Å; L124-Y233 HydrophobicContact CD1-CD2 3.96Å; L124-Y233 HydrophobicContact CD1-CE2 3.56Å; A147-Y233 HydrophobicContact CB-CE1 4.47Å; A147-Y233 HydrophobicContact CB-CE2 4.16Å; A147-Y233 VanDerWaalsContact CB-OH 3.25Å; A147-Y233 WeakPolarHBondContact CB-OH 3.46Å; I151-Y233 HydrophobicContact CD1-CE2 4.17Å; I151-Y233 WeakPolarHBondContact CD1-OH 3.25Å; N229-Y233 PolarHBondContact O-N 2.57Å; N229-Y233 VanDerWaalsContact O-N 3.08Å; I230-Y233 PolarHBondContact O-N 3.1Å; E231-Y233 VanDerWaalsContact C-N 3.33Å; E231-Y233 PolarHBondContact O-N 2.8Å; Y233-N235 VanDerWaalsContact C-N 3.33Å; Y233-N235 PolarHBondContact O-N 3.43Å; Y233-S236 WeakPolarHBondContact O-CB 3.22Å; Y233-S236 PolarHBondContact O-N 3.22Å; Y233-Y237 PolarHBondContact O-N 2.98Å
234	W	97.8	Very high	96.7	Very high	8 Å²	8	47.1 Å²	47.1	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-45	171.5	175.8	-121.2	0	0	0	112.1	V71 H184 M196 I197 H200 I230 E231 Y237 N238	V71-W234 HydrophobicContact CB-CE3 4.27Å; V71-W234 HydrophobicContact CG1-CB 3.71Å; V71-W234 HydrophobicContact CG1-CD2 4.43Å; V71-W234 HydrophobicContact CG1-CE3 3.87Å; V71-W234 HydrophobicContact CG1-CG 4.45Å; V71-W234 HydrophobicContact CG2-CE3 4.4Å; H184-W234 AromaticContact CD2-CZ2 3.89Å; H184-W234 AromaticContact NE2-CE2 3.69Å; H184-W234 AromaticContact NE2-CZ2 3.38Å; H184-W234 WeakPolarHBondContact NE2-CZ2 3.41Å; H184-W234 AromaticContact NE2-NE1 3.53Å; M196-W234 HydrophobicContact CB-CZ2 4.3Å; I197-W234 HydrophobicContact CD1-CB 4.49Å; I197-W234 HydrophobicContact CG1-CD2 4.12Å; I197-W234 HydrophobicContact CG1-CE3 4.35Å; I197-W234 HydrophobicContact CG1-CG 4.29Å; H200-W234 HydrophobicContact CB-CH2 3.72Å; H200-W234 HydrophobicContact CB-CZ3 3.73Å; H200-W234 AromaticContact CG-CZ3 3.66Å; H200-W234 AromaticContact ND1-CZ3 3.91Å; I230-W234 WeakPolarHBondContact O-CB 3.3Å; I230-W234 PolarHBondContact O-N 3.04Å; E231-W234 WeakPolarHBondContact O-CB 3.21Å; E231-W234 PolarHBondContact O-N 3.09Å; W234-Y237 HydrophobicContact CE3-CD1 4.2Å; W234-Y237 AromaticContact CZ3-CD1 3.98Å; W234-Y237 HydrophobicContact CZ3-CD1 3.98Å; W234-Y237 HydrophobicContact CZ3-CE1 4.39Å; W234-Y237 PolarHBondContact O-N 3.16Å; W234-N238 VanDerWaalsContact CD2-ND2 3.26Å; W234-N238 PolarHBondContact NE1-ND2 3.44Å; W234-N238 VanDerWaalsContact NE1-ND2 3.15Å; W234-N238 VanDerWaalsContact O-CG 3.3Å; W234-N238 PolarHBondContact O-N 2.76Å; W234-N238 PolarHBondContact O-ND2 3.2Å
235	N	96	Very high	96.7	Very high	60 Å²	60	46.9 Å²	46.9	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-64	-41.4	176	-73.1	-32.8	0	0	0	111.3	E231 L232 Y233 Y237 N238 N239	E231-N235 WeakPolarHBondContact O-CB 3.47Å; E231-N235 VanDerWaalsContact O-CG 3.24Å; E231-N235 PolarHBondContact O-N 3Å; E231-N235 PolarHBondContact O-ND2 2.76Å; E231-N235 VanDerWaalsContact O-ND2 3.15Å; L232-N235 PolarHBondContact O-N 2.88Å; Y233-N235 VanDerWaalsContact C-N 3.33Å; Y233-N235 PolarHBondContact O-N 3.43Å; N235-Y237 PolarHBondContact O-N 3.37Å; N235-N238 PolarHBondContact O-N 2.69Å; N235-N239 PolarHBondContact O-N 2.71Å; N235-N239 VanDerWaalsContact O-N 3.14Å; N235-N239 PolarHBondContact O-ND2 2.95Å
236	S	97.8	Very high	96.7	Very high	13 Å²	13	47 Å²	47	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-46.3	173.4	-173.5	0	0	0	0	111.7	P119 S120 L121 L232 Y233 N238 N239 R240	P119-S236 WeakPolarHBondContact O-CB 3.49Å; P119-S236 PolarHBondContact O-OG 3Å; S120-S236 VanDerWaalsContact CA-OG 3.28Å; S120-S236 WeakPolarHBondContact CA-OG 3.31Å; L121-S236 PolarHBondContact N-OG 2.93Å; L232-S236 PolarHBondContact O-N 2.89Å; Y233-S236 WeakPolarHBondContact O-CB 3.22Å; Y233-S236 PolarHBondContact O-N 3.22Å; S236-N238 PolarHBondContact O-N 2.97Å; S236-N239 PolarHBondContact O-N 2.98Å; S236-R240 PolarHBondContact O-N 3.19Å
237	Y	97.8	Very high	96.6	Very high	2 Å²	2	52 Å²	52	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-61.5	-44	177.2	178.6	-109.3	0	0	0	113	V71 L121 A147 H200 Y233 W234 N235 N239 R240	V71-Y237 HydrophobicContact CG2-CD1 4.44Å; V71-Y237 HydrophobicContact CG2-CG 4.09Å; L121-Y237 HydrophobicContact CD1-CD2 3.84Å; A147-Y237 HydrophobicContact CB-CD2 3.44Å; A147-Y237 VanDerWaalsContact CB-CD2 3.44Å; A147-Y237 HydrophobicContact CB-CE2 3.94Å; A147-Y237 HydrophobicContact CB-CG 4.09Å; H200-Y237 AromaticContact CE1-CE1 3.36Å; H200-Y237 WeakPolarHBondContact CE1-CE1 3.38Å; H200-Y237 AromaticContact CE1-CZ 3.65Å; H200-Y237 AromaticContact ND1-CE1 3.67Å; Y233-Y237 PolarHBondContact O-N 2.98Å; W234-Y237 HydrophobicContact CE3-CD1 4.2Å; W234-Y237 AromaticContact CZ3-CD1 3.98Å; W234-Y237 HydrophobicContact CZ3-CD1 3.98Å; W234-Y237 HydrophobicContact CZ3-CE1 4.39Å; W234-Y237 PolarHBondContact O-N 3.16Å; N235-Y237 PolarHBondContact O-N 3.37Å; Y237-N239 PolarHBondContact O-N 3.23Å; Y237-R240 WeakPolarHBondContact O-CB 3.15Å; Y237-R240 VanDerWaalsContact O-CG 3.25Å; Y237-R240 WeakPolarHBondContact O-CG 3.28Å; Y237-R240 PolarHBondContact O-N 3.14Å; Y237-R240 PolarHBondContact O-NH1 2.98Å
238	N	95.4	Very high	96.1	Very high	18 Å²	18	53.9 Å²	53.9	10%	0.096	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-24.4	179.7	-72.8	-43.3	0	0	0	113.7	K176 W234 N235 S236	K176-N238 HydrophobicContact CD-CB 4.45Å; K176-N238 WeakPolarHBondContact CE-OD1 3.34Å; K176-N238 PolarHBondContact NZ-OD1 2.98Å; W234-N238 VanDerWaalsContact CD2-ND2 3.26Å; W234-N238 PolarHBondContact NE1-ND2 3.44Å; W234-N238 VanDerWaalsContact NE1-ND2 3.15Å; W234-N238 VanDerWaalsContact O-CG 3.3Å; W234-N238 PolarHBondContact O-N 2.76Å; W234-N238 PolarHBondContact O-ND2 3.2Å; N235-N238 PolarHBondContact O-N 2.69Å; S236-N238 PolarHBondContact O-N 2.97Å
239	N	95.1	Very high	95.8	Very high	127 Å²	127	50.2 Å²	50.2	68%	0.679	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	14	178.1	-68.1	-63.5	0	0	0	112.9	N235 S236 Y237	N235-N239 PolarHBondContact O-N 2.71Å; N235-N239 VanDerWaalsContact O-N 3.14Å; N235-N239 PolarHBondContact O-ND2 2.95Å; S236-N239 PolarHBondContact O-N 2.98Å; Y237-N239 PolarHBondContact O-N 3.23Å
240	R	97.3	Very high	95.4	Very high	14 Å²	14	58.2 Å²	58.2	5%	0.053	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-58.7	154.3	175.2	73.2	-175.6	171.1	-87.1	5.6	111.4	L121 Y150 D172 N174 A175 S236 Y237	L121-R240 HydrophobicContact CD1-CB 3.6Å; L121-R240 HydrophobicContact CG-CB 4.25Å; Y150-R240 HydrophobicContact CE1-CB 4.49Å; Y150-R240 HydrophobicContact CE2-CB 4.1Å; Y150-R240 HydrophobicContact CE2-CG 4.23Å; D172-R240 IonicContact OD2-CZ 3.47Å; D172-R240 IonicContact OD2-NH2 3.67Å; D172-R240 PolarHBondContact OD2-NH2 3.1Å; N174-R240 PolarHBondContact O-NE 3.45Å; A175-R240 WeakPolarHBondContact CB-O 3.29Å; S236-R240 PolarHBondContact O-N 3.19Å; Y237-R240 WeakPolarHBondContact O-CB 3.15Å; Y237-R240 VanDerWaalsContact O-CG 3.25Å; Y237-R240 WeakPolarHBondContact O-CG 3.28Å; Y237-R240 PolarHBondContact O-N 3.14Å; Y237-R240 PolarHBondContact O-NH1 2.98Å
241	R	95.9	Very high	95.2	Very high	175 Å²	175	61.6 Å²	61.6	66%	0.66	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-100	170.4	175.9	-61.8	178.1	-175.3	161.6	1	109.6	Y150	Y150-R241 VanDerWaalsContact CE2-O 3.26Å; Y150-R241 WeakPolarHBondContact CE2-O 3.45Å; Y150-R241 PolarHBondContact OH-O 3.26Å
242	D	96.9	Very high	95	Very high	60 Å²	60	59.9 Å²	59.9	32%	0.321	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-64.5	136.6	172.1	-61.3	-47.8	0	0	0	111	R154 N174 A175 N244	R154-D242 PolarHBondContact NH2-O 3.37Å; N174-D242 WeakPolarHBondContact CA-OD1 3.46Å; A175-D242 PolarHBondContact N-OD1 2.94Å; D242-N244 WeakPolarHBondContact CB-OD1 3.32Å; D242-N244 PolarHBondContact O-N 2.88Å; D242-N244 PolarHBondContact O-ND2 3.19Å; D242-N244 VanDerWaalsContact O-ND2 3.13Å
243	L	97.2	Very high	95	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.308	C	S	.	.			trans	-70	-20.1	164.7	-67.1	-179.6	0	0	0	111.4	Y150 R154 L157 I171 P173 F245 I251	Y150-L243 HydrophobicContact CD1-CD2 4.48Å; Y150-L243 HydrophobicContact CD2-CD1 3.9Å; Y150-L243 HydrophobicContact CD2-CD2 4.09Å; Y150-L243 HydrophobicContact CD2-CG 3.83Å; Y150-L243 HydrophobicContact CE1-CD2 3.99Å; Y150-L243 HydrophobicContact CE2-CD1 4.09Å; Y150-L243 HydrophobicContact CE2-CD2 3.57Å; Y150-L243 HydrophobicContact CE2-CG 3.47Å; Y150-L243 VanDerWaalsContact CE2-CG 3.47Å; Y150-L243 HydrophobicContact CG-CD1 4.45Å; Y150-L243 VanDerWaalsContact CZ-CD2 3.49Å; R154-L243 HydrophobicContact CB-CD2 4.02Å; L157-L243 HydrophobicContact CD1-CD2 4.32Å; I171-L243 HydrophobicContact CD1-CD1 4.23Å; P173-L243 HydrophobicContact CB-CB 4.2Å; P173-L243 HydrophobicContact CB-CD1 3.94Å; P173-L243 HydrophobicContact CB-CG 4.33Å; P173-L243 PolarHBondContact O-N 3.47Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 HydrophobicContact CB-CD1 4.44Å; L243-F245 HydrophobicContact CB-CD2 4.24Å; L243-F245 HydrophobicContact CB-CE1 4.24Å; L243-F245 HydrophobicContact CB-CE2 4.02Å; L243-F245 HydrophobicContact CB-CG 4.45Å; L243-F245 HydrophobicContact CB-CZ 4.03Å; L243-F245 HydrophobicContact CD1-CD2 4.5Å; L243-F245 HydrophobicContact CD1-CE1 4.45Å; L243-F245 HydrophobicContact CD1-CE2 3.56Å; L243-F245 HydrophobicContact CD1-CZ 3.55Å; L243-F245 HydrophobicContact CG-CE2 4.44Å; L243-F245 HydrophobicContact CG-CZ 4.39Å; L243-F245 PolarHBondContact O-N 3.49Å; L243-I251 WeakPolarHBondContact O-CG2 3.4Å
244	N	96	Very high	94.9	Very high	93 Å²	93	65.3 Å²	65.3	50%	0.497	34%	0.34	S	S	.	.			trans	56.4	40.9	178.7	-62.5	-63.1	0	0	0	113.4	D242 E246 I251	D242-N244 WeakPolarHBondContact CB-OD1 3.32Å; D242-N244 PolarHBondContact O-N 2.88Å; D242-N244 PolarHBondContact O-ND2 3.19Å; D242-N244 VanDerWaalsContact O-ND2 3.13Å; N244-E246 PolarHBondContact O-N 3.3Å; N244-I251 HydrophobicContact CB-CD1 4.26Å; N244-I251 WeakPolarHBondContact O-CB 3.41Å; N244-I251 WeakPolarHBondContact O-CG2 3.4Å
245	F	97	Very high	94.9	Very high	11 Å²	11	65.4 Å²	65.4	5%	0.048	34%	0.341	C	S	.	.			trans	-59.9	130.8	173.2	-65.2	-44	0	0	0	110.9	L157 P173 L243 I251 L253 K277 L278	L157-F245 HydrophobicContact CD1-CE1 3.86Å; L157-F245 HydrophobicContact CD2-CE1 4.06Å; L157-F245 HydrophobicContact CG-CE1 4.2Å; P173-F245 HydrophobicContact CB-CD2 3.77Å; P173-F245 HydrophobicContact CB-CE2 3.82Å; P173-F245 HydrophobicContact CG-CD2 4.48Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 HydrophobicContact CB-CD1 4.44Å; L243-F245 HydrophobicContact CB-CD2 4.24Å; L243-F245 HydrophobicContact CB-CE1 4.24Å; L243-F245 HydrophobicContact CB-CE2 4.02Å; L243-F245 HydrophobicContact CB-CG 4.45Å; L243-F245 HydrophobicContact CB-CZ 4.03Å; L243-F245 HydrophobicContact CD1-CD2 4.5Å; L243-F245 HydrophobicContact CD1-CE1 4.45Å; L243-F245 HydrophobicContact CD1-CE2 3.56Å; L243-F245 HydrophobicContact CD1-CZ 3.55Å; L243-F245 HydrophobicContact CG-CE2 4.44Å; L243-F245 HydrophobicContact CG-CZ 4.39Å; L243-F245 PolarHBondContact O-N 3.49Å; F245-I251 WeakPolarHBondContact CA-O 3.37Å; F245-L253 HydrophobicContact CE1-CD1 4.24Å; F245-L253 HydrophobicContact CE1-CD2 4.19Å; F245-L253 HydrophobicContact CE1-CG 3.82Å; F245-L253 HydrophobicContact CZ-CD1 3.94Å; F245-L253 HydrophobicContact CZ-CD2 4.39Å; F245-L253 HydrophobicContact CZ-CG 4.02Å; F245-K277 HydrophobicContact CB-CB 3.68Å; F245-K277 HydrophobicContact CB-CD 4.34Å; F245-K277 WeakPolarHBondContact O-CB 3.33Å; F245-K277 WeakPolarHBondContact O-CD 3.44Å; F245-L278 HydrophobicContact CB-CD2 4.46Å; F245-L278 HydrophobicContact CD1-CD2 4.08Å; F245-L278 HydrophobicContact CD2-CD2 4.13Å; F245-L278 HydrophobicContact CE1-CD2 4.29Å; F245-L278 HydrophobicContact CE2-CD2 4.33Å; F245-L278 HydrophobicContact CG-CD2 4Å; F245-L278 HydrophobicContact CZ-CD2 4.39Å
246	E	93.9	Very high	95	Very high	122 Å²	122	64.6 Å²	64.6	57%	0.57	34%	0.339	S	S	*	.			trans	-131.3	123.6	175.3	-174.2	176.9	-164.5	0	0	109.8	N244 G248 G249 I251 K277	N244-E246 PolarHBondContact O-N 3.3Å; E246-G248 PolarHBondContact O-N 3.03Å; E246-G249 PolarHBondContact O-N 2.92Å; E246-G249 VanDerWaalsContact O-N 3.07Å; E246-I251 PolarHBondContact N-O 2.82Å; E246-K277 CarbonylContact C-O 3.33Å
247	R	92.5	Very high	95.1	Very high	124 Å²	124	64 Å²	64	47%	0.468	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	117.6	-179.4	-179.2	-178.6	-72.5	172.5	-1.5	109.4	G249 N275 S276 K277 L278	R247-G249 PolarHBondContact O-N 3.37Å; R247-N275 PolarHBondContact NH2-O 2.71Å; R247-S276 PolarHBondContact NE-O 2.98Å; R247-S276 VanDerWaalsContact NE-O 3.13Å; R247-S276 PolarHBondContact NH2-O 2.98Å; R247-K277 VanDerWaalsContact CA-O 3.24Å; R247-K277 WeakPolarHBondContact CA-O 3.39Å; R247-K277 PolarHBondContact N-O 2.94Å; R247-L278 PolarHBondContact NE-O 3.44Å
248	G	86	Confident	95.1	Very high	82 Å²	82	64.2 Å²	64.2	85%	0.845	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	9.1	-176.5	0	0	0	0	0	114	E246	E246-G248 PolarHBondContact O-N 3.03Å
249	G	90.2	Very high	95.3	Very high	23 Å²	23	63.3 Å²	63.3	24%	0.237	33%	0.332	C	S	.	.	S	Bend	trans	-92.3	-176.5	170.8	0	0	0	0	0	112.4	E246 R247	E246-G249 PolarHBondContact O-N 2.92Å; E246-G249 VanDerWaalsContact O-N 3.07Å; R247-G249 PolarHBondContact O-N 3.37Å
250	D	88.6	Confident	95.4	Very high	169 Å²	169	57.3 Å²	57.3	90%	0.904	30%	0.299	S	S	*	.	S	Bend	trans	-74.5	-26.8	-177.2	-68.4	-34.3	0	0	0	113.1
251	I	93.5	Very high	95.5	Very high	78 Å²	78	56.6 Å²	56.6	40%	0.4	30%	0.297	S	S	.	.	S	Bend	trans	-101.4	91.1	-177.2	-53.2	177.3	0	0	0	109.2	L157 L243 N244 F245 E246	L157-I251 HydrophobicContact CD1-CG2 4.33Å; L157-I251 HydrophobicContact CD2-CG2 4.11Å; L243-I251 WeakPolarHBondContact O-CG2 3.4Å; N244-I251 HydrophobicContact CB-CD1 4.26Å; N244-I251 WeakPolarHBondContact O-CB 3.41Å; N244-I251 WeakPolarHBondContact O-CG2 3.4Å; F245-I251 WeakPolarHBondContact CA-O 3.37Å; E246-I251 PolarHBondContact N-O 2.82Å
252	T	94.3	Very high	95.5	Very high	32 Å²	32	48.3 Å²	48.3	20%	0.196	27%	0.265	C	S	.	.	S	Bend	trans	-151.5	165.3	174.9	-160.3	0	0	0	0	111.7	L157	L157-T252 WeakPolarHBondContact CD2-O 3.42Å
253	L	97.1	Very high	95.2	Very high	9 Å²	9	48.2 Å²	48.2	5%	0.047	27%	0.265	C	S	.	.			trans	-78.4	127.7	176.3	-63.7	171.6	0	0	0	109.5	A156 L157 L166 L168 F245 V257 L278	A156-L253 HydrophobicContact CB-CD2 3.71Å; L157-L253 HydrophobicContact CD2-CD2 4.3Å; L157-L253 HydrophobicContact CG-CD2 4.24Å; L166-L253 HydrophobicContact CD1-CD1 3.95Å; L166-L253 HydrophobicContact CD1-CD2 3.96Å; L168-L253 HydrophobicContact CD1-CD1 4.16Å; F245-L253 HydrophobicContact CE1-CD1 4.24Å; F245-L253 HydrophobicContact CE1-CD2 4.19Å; F245-L253 HydrophobicContact CE1-CG 3.82Å; F245-L253 HydrophobicContact CZ-CD1 3.94Å; F245-L253 HydrophobicContact CZ-CD2 4.39Å; F245-L253 HydrophobicContact CZ-CG 4.02Å; L253-V257 HydrophobicContact CB-CG2 4.04Å; L253-V257 HydrophobicContact CD1-CG2 3.66Å; L253-L278 HydrophobicContact CB-CD2 4.33Å; L253-L278 HydrophobicContact CD1-CD1 4.35Å; L253-L278 HydrophobicContact CD1-CD2 3.96Å; L253-L278 HydrophobicContact CG-CD2 4.13Å
254	K	96.3	Very high	94.5	Very high	151 Å²	151	54 Å²	54	66%	0.657	29%	0.292	S	S	*	.			trans	-89.6	-7.6	-178.3	-61.3	-174.3	-176.9	174.3	0	114	P160 Q282	P160-K254 HydrophobicContact CB-CB 4.37Å; P160-K254 HydrophobicContact CB-CD 3.95Å; P160-K254 HydrophobicContact CB-CG 4.39Å; P160-K254 HydrophobicContact CG-CD 4.37Å; K254-Q282 PolarHBondContact O-OE1 2.9Å
255	C	97.9	Very high	94.3	Very high	9 Å²	9	50 Å²	50	6%	0.061	27%	0.271	C	S	.	.	S	Bend	trans	-102.1	158.6	179.8	66.6	0	0	0	0	110.7	V163 V257	V163-C255 WeakPolarHBondContact O-CB 3.38Å; C255-V257 WeakPolarHBondContact O-CG2 3.41Å
256	P	98.6	Very high	94.2	Very high	43 Å²	43	52.3 Å²	52.3	28%	0.279	29%	0.287	S	S	.	.			trans	-51	138.5	165.8	-28	35.2	0	0	0	113.1	E164 G165 L166 Q282 F310 M314	E164-P256 WeakPolarHBondContact O-CD 3.38Å; G165-P256 CarbonylContact C-O 3.59Å; G165-P256 VanDerWaalsContact CA-O 3.25Å; G165-P256 WeakPolarHBondContact CA-O 3.1Å; L166-P256 PolarHBondContact N-O 3.5Å; P256-Q282 CarbonylContact C-O 3.59Å; P256-Q282 WeakPolarHBondContact CA-O 3.31Å; P256-F310 HydrophobicContact CB-CE2 3.83Å; P256-F310 HydrophobicContact CB-CZ 4.05Å; P256-F310 WeakPolarHBondContact O-CZ 3.02Å; P256-M314 HydrophobicContact CB-CG 4.34Å; P256-M314 HydrophobicContact CB-SD 4.29Å; P256-M314 HydrophobicContact CG-CG 4.17Å; P256-M314 HydrophobicContact CG-SD 4.35Å
257	V	98.8	Very high	94.3	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137	-180	-176	0	0	0	0	110.4	L166 L168 L253 C255 L259 L278 Q282 T283 S284	L166-V257 HydrophobicContact CB-CG2 4.47Å; L166-V257 CarbonylContact O-C 3.6Å; L166-V257 WeakPolarHBondContact O-CA 3.28Å; L168-V257 HydrophobicContact CD1-CG1 3.73Å; L168-V257 HydrophobicContact CG-CG1 4.18Å; L253-V257 HydrophobicContact CB-CG2 4.04Å; L253-V257 HydrophobicContact CD1-CG2 3.66Å; C255-V257 WeakPolarHBondContact O-CG2 3.41Å; V257-L259 HydrophobicContact CG1-CD2 3.81Å; V257-L259 HydrophobicContact CG1-CG 4.13Å; V257-L278 HydrophobicContact CG1-CD1 4.18Å; V257-Q282 PolarHBondContact N-O 3.01Å; V257-T283 HydrophobicContact CB-CG2 4.21Å; V257-T283 HydrophobicContact CG1-CG2 4.39Å; V257-T283 CarbonylContact O-C 3.57Å; V257-T283 WeakPolarHBondContact O-CA 3.35Å; V257-S284 PolarHBondContact O-N 3.23Å; V257-S284 PolarHBondContact O-OG 3.38Å
258	M	98.8	Very high	94.4	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	104.7	165.7	-174.9	172.5	70.9	0	0	109	L166 V167 L168 V260 S284 L303 A306 F307 F310	L166-M258 PolarHBondContact O-N 2.84Å; V167-M258 WeakPolarHBondContact CA-O 3.26Å; V167-M258 HydrophobicContact CB-CE 4.26Å; V167-M258 HydrophobicContact CG1-CE 3.46Å; V167-M258 VanDerWaalsContact CG1-CE 3.46Å; V167-M258 HydrophobicContact CG2-CB 4.41Å; V167-M258 HydrophobicContact CG2-CE 3.8Å; L168-M258 PolarHBondContact N-O 2.89Å; M258-V260 HydrophobicContact CE-CG2 4.12Å; M258-V260 HydrophobicContact CG-CG2 4.05Å; M258-S284 WeakPolarHBondContact CA-O 3.42Å; M258-S284 WeakPolarHBondContact CA-OG 3.23Å; M258-L303 HydrophobicContact CE-CD1 4.4Å; M258-A306 HydrophobicContact CE-CB 4.42Å; M258-A306 HydrophobicContact SD-CB 3.97Å; M258-F307 HydrophobicContact CE-CB 4.45Å; M258-F307 HydrophobicContact CE-CD2 4.48Å; M258-F310 HydrophobicContact CB-CD2 3.79Å; M258-F310 HydrophobicContact CB-CE2 4Å; M258-F310 HydrophobicContact CB-CG 4.15Å; M258-F310 HydrophobicContact CE-CB 4.44Å; M258-F310 HydrophobicContact SD-CB 4.02Å; M258-F310 HydrophobicContact SD-CG 4.44Å
259	L	98.9	Very high	94.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.3	171.8	-63.7	-177	0	0	0	109.4	L168 I171 V257 V271 C274 N275 L278 T283 S284 F285 L286	L168-L259 HydrophobicContact CB-CD2 3.89Å; L168-L259 HydrophobicContact CD1-CD2 3.96Å; L168-L259 HydrophobicContact CG-CD2 4.45Å; I171-L259 HydrophobicContact CG2-CD2 3.86Å; V257-L259 HydrophobicContact CG1-CD2 3.81Å; V257-L259 HydrophobicContact CG1-CG 4.13Å; L259-V271 HydrophobicContact CB-CG1 3.98Å; L259-V271 HydrophobicContact CD1-CG1 4.39Å; L259-C274 HydrophobicContact CD1-CB 4.47Å; L259-N275 VanDerWaalsContact CD1-CA 3.49Å; L259-N275 HydrophobicContact CD1-CB 3.53Å; L259-L278 HydrophobicContact CD1-CD1 4.17Å; L259-L278 HydrophobicContact CD2-CD1 4.18Å; L259-L278 HydrophobicContact CG-CD1 4.4Å; L259-T283 HydrophobicContact CD1-CG2 3.96Å; L259-T283 HydrophobicContact CG-CG2 3.96Å; L259-S284 PolarHBondContact N-O 3.15Å; L259-F285 HydrophobicContact CB-CD2 3.86Å; L259-L286 PolarHBondContact O-N 2.85Å
260	V	98.8	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.1	-179.7	-174.7	0	0	0	0	109.8	V167 L168 I169 N170 M258 L286 M288 P295 L303	V167-V260 HydrophobicContact CG1-CG2 4.13Å; L168-V260 PolarHBondContact O-N 2.92Å; I169-V260 CarbonylContact C-O 3.47Å; I169-V260 WeakPolarHBondContact CA-O 3.48Å; I169-V260 HydrophobicContact CB-CB 4.43Å; I169-V260 HydrophobicContact CG1-CB 4.1Å; I169-V260 HydrophobicContact CG1-CG2 4.47Å; I169-V260 HydrophobicContact CG2-CB 4.38Å; I169-V260 HydrophobicContact CG2-CG1 4.41Å; N170-V260 PolarHBondContact N-O 3.4Å; M258-V260 HydrophobicContact CE-CG2 4.12Å; M258-V260 HydrophobicContact CG-CG2 4.05Å; V260-L286 WeakPolarHBondContact CA-O 3.34Å; V260-L286 HydrophobicContact CG1-CD2 4.33Å; V260-L286 HydrophobicContact CG2-CB 4.38Å; V260-L286 HydrophobicContact CG2-CD2 4.36Å; V260-M288 HydrophobicContact CG1-CG 4.26Å; V260-M288 HydrophobicContact CG1-SD 3.7Å; V260-P295 HydrophobicContact CG1-CB 4.38Å; V260-L303 HydrophobicContact CG1-CD1 4.13Å; V260-L303 HydrophobicContact CG2-CD1 4.07Å
261	V	98.6	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	149.1	172.3	71.7	0	0	0	0	110.3	A265 E268 V271 F285 L286 K287 M288	V261-A265 HydrophobicContact CG2-CB 3.98Å; V261-E268 HydrophobicContact CG2-CB 4.36Å; V261-V271 HydrophobicContact CB-CB 4.04Å; V261-V271 HydrophobicContact CB-CG1 4.1Å; V261-V271 HydrophobicContact CB-CG2 4Å; V261-V271 HydrophobicContact CG1-CB 4.26Å; V261-V271 HydrophobicContact CG1-CG1 4.22Å; V261-V271 HydrophobicContact CG2-CB 4.33Å; V261-V271 HydrophobicContact CG2-CG2 4.05Å; V261-F285 HydrophobicContact CG1-CE2 3.71Å; V261-F285 HydrophobicContact CG1-CZ 3.93Å; V261-L286 PolarHBondContact N-O 3.5Å; V261-L286 VanDerWaalsContact N-O 3.12Å; V261-K287 HydrophobicContact CG1-CG 4.3Å; V261-K287 CarbonylContact O-C 3.55Å; V261-K287 WeakPolarHBondContact O-CA 3.34Å; V261-M288 PolarHBondContact O-N 3.43Å
262	G	96.4	Very high	95.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	150.8	170.3	0	0	0	0	0	112.5	Q264 A265 M288 S291 G292	G262-Q264 PolarHBondContact O-N 2.67Å; G262-A265 VanDerWaalsContact O-CB 3.24Å; G262-A265 WeakPolarHBondContact O-CB 3.35Å; G262-A265 PolarHBondContact O-N 3.15Å; G262-M288 WeakPolarHBondContact CA-O 3.25Å; G262-S291 WeakPolarHBondContact CA-OG 3.47Å; G262-G292 WeakPolarHBondContact CA-O 3.45Å
263	D	89	Confident	95.9	Very high	58 Å²	58	38.6 Å²	38.6	31%	0.31	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	134	167.5	-167.1	25	0	0	0	110.3	A265 K287 M288	D263-A265 PolarHBondContact O-N 2.98Å; D263-K287 WeakPolarHBondContact OD1-CE 3.4Å; D263-K287 IonicContact OD1-NZ 3.31Å; D263-K287 PolarHBondContact OD1-NZ 3.16Å; D263-M288 PolarHBondContact N-O 3.31Å
264	Q	82.3	Confident	95.9	Very high	124 Å²	124	38.1 Å²	38.1	58%	0.579	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	17.9	-176.1	-49.1	-55.2	-57.4	0	0	114.5	S203 G262 E268	S203-Q264 WeakPolarHBondContact CB-O 3.44Å; G262-Q264 PolarHBondContact O-N 2.67Å; Q264-E268 PolarHBondContact N-OE2 3.02Å
265	A	93.6	Very high	96	Very high	7 Å²	7	33 Å²	33	6%	0.058	18%	0.18	C	C	.	.			trans	-69.5	151.5	172.4	0	0	0	0	0	110.8	V261 G262 D263 H267 E268	V261-A265 HydrophobicContact CG2-CB 3.98Å; G262-A265 VanDerWaalsContact O-CB 3.24Å; G262-A265 WeakPolarHBondContact O-CB 3.35Å; G262-A265 PolarHBondContact O-N 3.15Å; D263-A265 PolarHBondContact O-N 2.98Å; A265-H267 PolarHBondContact O-N 2.85Å; A265-E268 PolarHBondContact O-N 3.34Å; A265-E268 VanDerWaalsContact O-N 3.12Å
266	P	93.9	Very high	96	Very high	60 Å²	60	35.5 Å²	35.5	39%	0.39	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-22.6	179.1	-26.3	34.3	0	0	0	115	F202	F202-P266 WeakPolarHBondContact O-CG 3.47Å
267	H	95.7	Very high	95.9	Very high	15 Å²	15	35.7 Å²	35.7	7%	0.069	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	10.5	-174.2	-53.5	-68.9	0	0	0	113.4	N170 H200 A265 D269 A270 V271	N170-H267 HydrophobicContact CB-CB 3.98Å; H200-H267 AromaticContact CE1-CE1 3.32Å; H200-H267 PolarHBondContact CE1-CE1 2.93Å; H200-H267 AromaticContact CE1-NE2 3.42Å; H200-H267 PolarHBondContact CE1-NE2 3.35Å; H200-H267 AromaticContact ND1-CE1 3.25Å; H200-H267 PolarHBondContact ND1-CE1 2.95Å; H200-H267 VanDerWaalsContact ND1-CE1 3.25Å; H200-H267 AromaticContact ND1-NE2 3.5Å; H200-H267 PolarHBondContact ND1-NE2 3.07Å; H200-H267 PolarHBondContact O-NE2 2.95Å; A265-H267 PolarHBondContact O-N 2.85Å; H267-D269 PolarHBondContact O-N 3.12Å; H267-A270 PolarHBondContact O-N 3.32Å; H267-V271 WeakPolarHBondContact O-CG2 3.33Å; H267-V271 PolarHBondContact O-N 2.84Å
268	E	95.6	Very high	95.9	Very high	33 Å²	33	35.7 Å²	35.7	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-53.6	-54.9	-176.8	-174.2	-179.2	152.2	0	0	112.1	V261 Q264 A265 A270 V271 V272 K287	V261-E268 HydrophobicContact CG2-CB 4.36Å; Q264-E268 PolarHBondContact N-OE2 3.02Å; A265-E268 PolarHBondContact O-N 3.34Å; A265-E268 VanDerWaalsContact O-N 3.12Å; E268-A270 VanDerWaalsContact C-N 3.3Å; E268-A270 PolarHBondContact O-N 3.38Å; E268-V271 PolarHBondContact O-N 3.32Å; E268-V272 HydrophobicContact CG-CG2 4.5Å; E268-V272 WeakPolarHBondContact O-CG2 3.12Å; E268-V272 PolarHBondContact O-N 3.19Å; E268-K287 VanDerWaalsContact OE1-CE 3.29Å; E268-K287 WeakPolarHBondContact OE1-CE 3.21Å; E268-K287 IonicContact OE1-NZ 3.98Å; E268-K287 PolarHBondContact OE1-NZ 3.26Å; E268-K287 IonicContact OE2-NZ 2.61Å; E268-K287 PolarHBondContact OE2-NZ 3.03Å
269	D	95.3	Very high	95.8	Very high	136 Å²	136	38.1 Å²	38.1	73%	0.727	21%	0.207	S	C	*	.	H	α-helix	trans	-60.6	-40.8	-178.1	-69	-24	0	0	0	111.9	H267 V272 E273	H267-D269 PolarHBondContact O-N 3.12Å; D269-V272 PolarHBondContact O-N 2.98Å; D269-E273 WeakPolarHBondContact O-CB 3.31Å; D269-E273 PolarHBondContact O-N 2.98Å
270	A	96.6	Very high	95.6	Very high	15 Å²	15	41.8 Å²	41.8	12%	0.124	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-40.4	179.6	0	0	0	0	0	112.3	D172 H267 E268 E273 C274	D172-A270 HydrophobicContact CB-CB 3.82Å; H267-A270 PolarHBondContact O-N 3.32Å; E268-A270 VanDerWaalsContact C-N 3.3Å; E268-A270 PolarHBondContact O-N 3.38Å; A270-E273 PolarHBondContact O-N 3.27Å; A270-C274 WeakPolarHBondContact O-CB 3.4Å; A270-C274 PolarHBondContact O-N 2.91Å
271	V	98.2	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.3	-38.2	176.6	179.8	0	0	0	0	111	I171 L259 V261 H267 E268 C274 N275 F285	I171-V271 HydrophobicContact CG2-CG2 4.21Å; I171-V271 VanDerWaalsContact O-CG2 3.26Å; I171-V271 WeakPolarHBondContact O-CG2 3.36Å; L259-V271 HydrophobicContact CB-CG1 3.98Å; L259-V271 HydrophobicContact CD1-CG1 4.39Å; V261-V271 HydrophobicContact CB-CB 4.04Å; V261-V271 HydrophobicContact CB-CG1 4.1Å; V261-V271 HydrophobicContact CB-CG2 4Å; V261-V271 HydrophobicContact CG1-CB 4.26Å; V261-V271 HydrophobicContact CG1-CG1 4.22Å; V261-V271 HydrophobicContact CG2-CB 4.33Å; V261-V271 HydrophobicContact CG2-CG2 4.05Å; H267-V271 WeakPolarHBondContact O-CG2 3.33Å; H267-V271 PolarHBondContact O-N 2.84Å; E268-V271 PolarHBondContact O-N 3.32Å; V271-C274 WeakPolarHBondContact O-CB 3.42Å; V271-C274 PolarHBondContact O-N 3.4Å; V271-N275 PolarHBondContact O-N 3.05Å; V271-F285 HydrophobicContact CG1-CD2 4.2Å; V271-F285 HydrophobicContact CG1-CE2 3.65Å
272	V	97.2	Very high	95.3	Very high	65 Å²	65	51.2 Å²	51.2	39%	0.394	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-43.7	174.2	171.2	0	0	0	0	110.8	E268 D269 N275 S276 F285	E268-V272 HydrophobicContact CG-CG2 4.5Å; E268-V272 WeakPolarHBondContact O-CG2 3.12Å; E268-V272 PolarHBondContact O-N 3.19Å; D269-V272 PolarHBondContact O-N 2.98Å; V272-N275 WeakPolarHBondContact O-CB 3.35Å; V272-N275 PolarHBondContact O-N 2.93Å; V272-S276 PolarHBondContact O-N 2.63Å; V272-S276 VanDerWaalsContact O-N 3.17Å; V272-F285 HydrophobicContact CG2-CE1 4.13Å; V272-F285 HydrophobicContact CG2-CZ 3.78Å
273	E	96.4	Very high	95.4	Very high	78 Å²	78	52.1 Å²	52.1	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-44.4	174.6	-169.4	-170.8	152.6	0	0	111.1	N174 D269 A270 N275 S276 K277	N174-E273 PolarHBondContact ND2-OE1 2.85Å; N174-E273 PolarHBondContact ND2-OE2 3.19Å; N174-E273 VanDerWaalsContact ND2-OE2 3.12Å; D269-E273 WeakPolarHBondContact O-CB 3.31Å; D269-E273 PolarHBondContact O-N 2.98Å; A270-E273 PolarHBondContact O-N 3.27Å; E273-N275 VanDerWaalsContact C-N 3.33Å; E273-N275 PolarHBondContact O-N 3.12Å; E273-S276 WeakPolarHBondContact O-CB 3.43Å; E273-S276 PolarHBondContact O-N 3.3Å; E273-S276 PolarHBondContact O-OG 3.19Å; E273-K277 PolarHBondContact O-N 2.96Å; E273-K277 WeakPolarHBondContact OE1-CE 3.34Å; E273-K277 IonicContact OE1-NZ 2.65Å; E273-K277 PolarHBondContact OE1-NZ 3.35Å
274	C	97.9	Very high	95.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56	-46.6	175.5	-170.2	0	0	0	0	111.6	I171 P173 L259 A270 V271 S276 K277 L278	I171-C274 HydrophobicContact CG2-CB 4.32Å; P173-C274 HydrophobicContact CG-CB 3.86Å; L259-C274 HydrophobicContact CD1-CB 4.47Å; A270-C274 WeakPolarHBondContact O-CB 3.4Å; A270-C274 PolarHBondContact O-N 2.91Å; V271-C274 WeakPolarHBondContact O-CB 3.42Å; V271-C274 PolarHBondContact O-N 3.4Å; C274-S276 PolarHBondContact O-N 2.76Å; C274-K277 PolarHBondContact O-N 3.19Å; C274-L278 PolarHBondContact O-N 3.4Å
275	N	98.2	Very high	96.6	Very high	42 Å²	42	49.4 Å²	49.4	23%	0.225	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-35.7	176.2	-171.7	40.5	0	0	0	112.7	R247 L259 V271 V272 E273 K277	R247-N275 PolarHBondContact NH2-O 2.71Å; L259-N275 VanDerWaalsContact CD1-CA 3.49Å; L259-N275 HydrophobicContact CD1-CB 3.53Å; V271-N275 PolarHBondContact O-N 3.05Å; V272-N275 WeakPolarHBondContact O-CB 3.35Å; V272-N275 PolarHBondContact O-N 2.93Å; E273-N275 VanDerWaalsContact C-N 3.33Å; E273-N275 PolarHBondContact O-N 3.12Å; N275-K277 PolarHBondContact O-N 3.43Å
276	S	97.1	Very high	96.8	Very high	62 Å²	62	51.6 Å²	51.6	43%	0.434	29%	0.289	S	S	.	.	H	α-helix	trans	-66.7	-23	177.4	83.3	0	0	0	0	113.3	R247 V272 E273 C274	R247-S276 PolarHBondContact NE-O 2.98Å; R247-S276 VanDerWaalsContact NE-O 3.13Å; R247-S276 PolarHBondContact NH2-O 2.98Å; V272-S276 PolarHBondContact O-N 2.63Å; V272-S276 VanDerWaalsContact O-N 3.17Å; E273-S276 WeakPolarHBondContact O-CB 3.43Å; E273-S276 PolarHBondContact O-N 3.3Å; E273-S276 PolarHBondContact O-OG 3.19Å; C274-S276 PolarHBondContact O-N 2.76Å
277	K	97.5	Very high	97	Very high	48 Å²	48	52.9 Å²	52.9	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-98.7	-15.3	-177.4	-64.7	176.4	-178	177.9	0	114	N174 F245 E246 R247 E273 C274 N275	N174-K277 PolarHBondContact OD1-NZ 3.43Å; F245-K277 HydrophobicContact CB-CB 3.68Å; F245-K277 HydrophobicContact CB-CD 4.34Å; F245-K277 WeakPolarHBondContact O-CB 3.33Å; F245-K277 WeakPolarHBondContact O-CD 3.44Å; E246-K277 CarbonylContact C-O 3.33Å; R247-K277 VanDerWaalsContact CA-O 3.24Å; R247-K277 WeakPolarHBondContact CA-O 3.39Å; R247-K277 PolarHBondContact N-O 2.94Å; E273-K277 PolarHBondContact O-N 2.96Å; E273-K277 WeakPolarHBondContact OE1-CE 3.34Å; E273-K277 IonicContact OE1-NZ 2.65Å; E273-K277 PolarHBondContact OE1-NZ 3.35Å; C274-K277 PolarHBondContact O-N 3.19Å; N275-K277 PolarHBondContact O-N 3.43Å
278	L	97.6	Very high	97	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	29%	0.286	C	S	.	.	S	Bend	trans	-89.3	164.2	177.9	-66.8	176.7	0	0	0	112.8	F245 R247 L253 V257 L259 C274 P280 T283	F245-L278 HydrophobicContact CB-CD2 4.46Å; F245-L278 HydrophobicContact CD1-CD2 4.08Å; F245-L278 HydrophobicContact CD2-CD2 4.13Å; F245-L278 HydrophobicContact CE1-CD2 4.29Å; F245-L278 HydrophobicContact CE2-CD2 4.33Å; F245-L278 HydrophobicContact CG-CD2 4Å; F245-L278 HydrophobicContact CZ-CD2 4.39Å; R247-L278 PolarHBondContact NE-O 3.44Å; L253-L278 HydrophobicContact CB-CD2 4.33Å; L253-L278 HydrophobicContact CD1-CD1 4.35Å; L253-L278 HydrophobicContact CD1-CD2 3.96Å; L253-L278 HydrophobicContact CG-CD2 4.13Å; V257-L278 HydrophobicContact CG1-CD1 4.18Å; L259-L278 HydrophobicContact CD1-CD1 4.17Å; L259-L278 HydrophobicContact CD2-CD1 4.18Å; L259-L278 HydrophobicContact CG-CD1 4.4Å; C274-L278 PolarHBondContact O-N 3.4Å; L278-P280 WeakPolarHBondContact O-CD 3.27Å; L278-T283 HydrophobicContact CB-CG2 4.21Å; L278-T283 WeakPolarHBondContact CB-OG1 3.19Å; L278-T283 HydrophobicContact CD1-CG2 4.02Å
279	D	96.1	Very high	96.8	Very high	56 Å²	56	53.1 Å²	53.1	30%	0.299	30%	0.298	S	S	.	.			trans	-68.9	116.1	174.8	-175.7	-18.3	0	0	0	110.3	T281 Q282 T283	D279-T281 VanDerWaalsContact CG-OG1 3.22Å; D279-T281 PolarHBondContact O-N 2.93Å; D279-T281 WeakPolarHBondContact OD1-CB 3.36Å; D279-T281 PolarHBondContact OD1-N 3.41Å; D279-T281 PolarHBondContact OD1-OG1 3.25Å; D279-T281 PolarHBondContact OD2-OG1 2.83Å; D279-Q282 PolarHBondContact O-N 3.45Å; D279-T283 WeakPolarHBondContact O-CB 3.41Å; D279-T283 PolarHBondContact O-N 3.19Å; D279-T283 PolarHBondContact O-OG1 3.22Å
280	P	96.7	Very high	96.6	Very high	78 Å²	78	53.1 Å²	53.1	51%	0.506	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-14.6	-178.1	30	-36.6	0	0	0	113.9	L278 Q282	L278-P280 WeakPolarHBondContact O-CD 3.27Å; P280-Q282 VanDerWaalsContact C-N 3.34Å
281	T	95.7	Very high	96.3	Very high	116 Å²	116	52.5 Å²	52.5	71%	0.712	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-22.2	178.7	67.9	0	0	0	0	112.8	D279	D279-T281 VanDerWaalsContact CG-OG1 3.22Å; D279-T281 PolarHBondContact O-N 2.93Å; D279-T281 WeakPolarHBondContact OD1-CB 3.36Å; D279-T281 PolarHBondContact OD1-N 3.41Å; D279-T281 PolarHBondContact OD1-OG1 3.25Å; D279-T281 PolarHBondContact OD2-OG1 2.83Å
282	Q	94.9	Very high	96	Very high	81 Å²	81	53 Å²	53	38%	0.379	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-6	-179.2	-62.6	-168.3	-13.4	0	0	113	K254 P256 V257 D279 P280	K254-Q282 PolarHBondContact O-OE1 2.9Å; P256-Q282 CarbonylContact C-O 3.59Å; P256-Q282 WeakPolarHBondContact CA-O 3.31Å; V257-Q282 PolarHBondContact N-O 3.01Å; D279-Q282 PolarHBondContact O-N 3.45Å; P280-Q282 VanDerWaalsContact C-N 3.34Å
283	T	98.1	Very high	95.9	Very high	20 Å²	20	49.9 Å²	49.9	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.1	-179.8	-53.2	0	0	0	0	111.1	V257 L259 L278 D279	V257-T283 HydrophobicContact CB-CG2 4.21Å; V257-T283 HydrophobicContact CG1-CG2 4.39Å; V257-T283 CarbonylContact O-C 3.57Å; V257-T283 WeakPolarHBondContact O-CA 3.35Å; L259-T283 HydrophobicContact CD1-CG2 3.96Å; L259-T283 HydrophobicContact CG-CG2 3.96Å; L278-T283 HydrophobicContact CB-CG2 4.21Å; L278-T283 WeakPolarHBondContact CB-OG1 3.19Å; L278-T283 HydrophobicContact CD1-CG2 4.02Å; D279-T283 WeakPolarHBondContact O-CB 3.41Å; D279-T283 PolarHBondContact O-N 3.19Å; D279-T283 PolarHBondContact O-OG1 3.22Å
284	S	98	Very high	95.9	Very high	51 Å²	51	46.2 Å²	46.2	36%	0.357	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	144.4	168.3	57.2	0	0	0	0	109.8	V257 M258 L259	V257-S284 PolarHBondContact O-N 3.23Å; V257-S284 PolarHBondContact O-OG 3.38Å; M258-S284 WeakPolarHBondContact CA-O 3.42Å; M258-S284 WeakPolarHBondContact CA-OG 3.23Å; L259-S284 PolarHBondContact N-O 3.15Å
285	F	98.1	Very high	95.9	Very high	74 Å²	74	46.2 Å²	46.2	33%	0.325	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.9	-179.8	177.3	-134.6	0	0	0	110.7	L259 V261 V271 V272 K287	L259-F285 HydrophobicContact CB-CD2 3.86Å; V261-F285 HydrophobicContact CG1-CE2 3.71Å; V261-F285 HydrophobicContact CG1-CZ 3.93Å; V271-F285 HydrophobicContact CG1-CD2 4.2Å; V271-F285 HydrophobicContact CG1-CE2 3.65Å; V272-F285 HydrophobicContact CG2-CE1 4.13Å; V272-F285 HydrophobicContact CG2-CZ 3.78Å; F285-K287 HydrophobicContact CE1-CB 4.39Å; F285-K287 HydrophobicContact CZ-CB 4.13Å
286	L	98.1	Very high	95.9	Very high	52 Å²	52	44.2 Å²	44.2	27%	0.272	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	98.4	179.9	179.7	67.4	0	0	0	110	L259 V260 V261 M288 A306	L259-L286 PolarHBondContact O-N 2.85Å; V260-L286 WeakPolarHBondContact CA-O 3.34Å; V260-L286 HydrophobicContact CG1-CD2 4.33Å; V260-L286 HydrophobicContact CG2-CB 4.38Å; V260-L286 HydrophobicContact CG2-CD2 4.36Å; V261-L286 PolarHBondContact N-O 3.5Å; V261-L286 VanDerWaalsContact N-O 3.12Å; L286-M288 HydrophobicContact CD1-CG 4.41Å; L286-M288 HydrophobicContact CD2-CG 3.92Å; L286-M288 HydrophobicContact CD2-SD 3.99Å; L286-M288 HydrophobicContact CG-CG 3.75Å; L286-M288 HydrophobicContact CG-SD 4.47Å; L286-A306 HydrophobicContact CD2-CB 3.5Å; L286-A306 VanDerWaalsContact CD2-CB 3.5Å
287	K	97.4	Very high	95.9	Very high	87 Å²	87	42.3 Å²	42.3	38%	0.378	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	116.3	166.1	-171	176.3	177.3	-173.5	0	109.5	V261 D263 E268 F285	V261-K287 HydrophobicContact CG1-CG 4.3Å; V261-K287 CarbonylContact O-C 3.55Å; V261-K287 WeakPolarHBondContact O-CA 3.34Å; D263-K287 WeakPolarHBondContact OD1-CE 3.4Å; D263-K287 IonicContact OD1-NZ 3.31Å; D263-K287 PolarHBondContact OD1-NZ 3.16Å; E268-K287 VanDerWaalsContact OE1-CE 3.29Å; E268-K287 WeakPolarHBondContact OE1-CE 3.21Å; E268-K287 IonicContact OE1-NZ 3.98Å; E268-K287 PolarHBondContact OE1-NZ 3.26Å; E268-K287 IonicContact OE2-NZ 2.61Å; E268-K287 PolarHBondContact OE2-NZ 3.03Å; F285-K287 HydrophobicContact CE1-CB 4.39Å; F285-K287 HydrophobicContact CZ-CB 4.13Å
288	M	95.4	Very high	95.8	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.025	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.4	-174.7	-64.2	-175	70.9	0	0	110.7	V260 V261 G262 D263 L286 S291 P295 Q299 K302 L303	V260-M288 HydrophobicContact CG1-CG 4.26Å; V260-M288 HydrophobicContact CG1-SD 3.7Å; V261-M288 PolarHBondContact O-N 3.43Å; G262-M288 WeakPolarHBondContact CA-O 3.25Å; D263-M288 PolarHBondContact N-O 3.31Å; L286-M288 HydrophobicContact CD1-CG 4.41Å; L286-M288 HydrophobicContact CD2-CG 3.92Å; L286-M288 HydrophobicContact CD2-SD 3.99Å; L286-M288 HydrophobicContact CG-CG 3.75Å; L286-M288 HydrophobicContact CG-SD 4.47Å; M288-S291 VanDerWaalsContact CB-OG 3.3Å; M288-S291 WeakPolarHBondContact CB-OG 3.4Å; M288-S291 PolarHBondContact O-OG 3.45Å; M288-S291 VanDerWaalsContact O-OG 3.12Å; M288-P295 HydrophobicContact CE-CB 4.47Å; M288-P295 HydrophobicContact SD-CB 3.61Å; M288-Q299 HydrophobicContact CE-CB 3.47Å; M288-Q299 VanDerWaalsContact CE-CB 3.47Å; M288-Q299 HydrophobicContact CE-CG 4.38Å; M288-K302 HydrophobicContact CE-CB 3.51Å; M288-K302 HydrophobicContact CE-CD 4.33Å; M288-L303 HydrophobicContact CE-CB 4.19Å; M288-L303 HydrophobicContact SD-CB 4.4Å
289	A	92.6	Very high	95.7	Very high	49 Å²	49	44.5 Å²	44.5	41%	0.405	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	141.8	171.9	0	0	0	0	0	111.1	S291	A289-S291 VanDerWaalsContact C-N 3.28Å; A289-S291 PolarHBondContact O-N 3.08Å
290	D	89.8	Confident	95.7	Very high	135 Å²	135	43 Å²	43	72%	0.722	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	39.1	176.5	-46.1	-55	0	0	0	113.5	Q299	D290-Q299 PolarHBondContact O-NE2 3.33Å
291	S	91.1	Very high	95.7	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.014	23%	0.231	C	C	.	.			trans	-116.2	-14.9	-179.9	77.3	0	0	0	0	114.6	G262 M288 A289 T298	G262-S291 WeakPolarHBondContact CA-OG 3.47Å; M288-S291 VanDerWaalsContact CB-OG 3.3Å; M288-S291 WeakPolarHBondContact CB-OG 3.4Å; M288-S291 PolarHBondContact O-OG 3.45Å; M288-S291 VanDerWaalsContact O-OG 3.12Å; A289-S291 VanDerWaalsContact C-N 3.28Å; A289-S291 PolarHBondContact O-N 3.08Å; S291-T298 WeakPolarHBondContact CA-OG1 3.48Å; S291-T298 PolarHBondContact O-OG1 2.85Å
292	G	92.6	Very high	95.8	Very high	11 Å²	11	39.5 Å²	39.5	11%	0.113	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	-151.9	178	0	0	0	0	0	113.5	E206 G262 Q294	E206-G292 WeakPolarHBondContact OE2-CA 3.41Å; G262-G292 WeakPolarHBondContact CA-O 3.45Å; G292-Q294 VanDerWaalsContact C-N 3.35Å; G292-Q294 PolarHBondContact O-N 3.28Å
293	G	94.3	Very high	95.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.4	-172.2	0	0	0	0	0	115.7	N170 L201 E206	N170-G293 PolarHBondContact ND2-O 3.35Å; L201-G293 CarbonylContact O-C 3.29Å; L201-G293 VanDerWaalsContact O-C 3.29Å; L201-G293 VanDerWaalsContact O-CA 3.27Å; L201-G293 WeakPolarHBondContact O-CA 3.34Å; E206-G293 PolarHBondContact OE1-N 3.17Å; E206-G293 PolarHBondContact OE2-N 3.01Å
294	Q	97.3	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.195	C	C	.	.			trans	-130.2	75.5	-177.7	-59.6	-63.3	-43.4	0	0	112.2	L201 F202 G292 Q296 L297 T298	L201-Q294 VanDerWaalsContact CD2-NE2 3.33Å; L201-Q294 PolarHBondContact O-NE2 3.18Å; F202-Q294 HydrophobicContact CD1-CG 4.02Å; F202-Q294 HydrophobicContact CE1-CB 4.07Å; F202-Q294 HydrophobicContact CE1-CG 3.45Å; F202-Q294 VanDerWaalsContact CE1-CG 3.45Å; F202-Q294 HydrophobicContact CZ-CG 3.86Å; G292-Q294 VanDerWaalsContact C-N 3.35Å; G292-Q294 PolarHBondContact O-N 3.28Å; Q294-Q296 VanDerWaalsContact C-OE1 3.28Å; Q294-Q296 PolarHBondContact O-N 3.41Å; Q294-Q296 VanDerWaalsContact O-N 3.15Å; Q294-L297 HydrophobicContact CB-CB 4.13Å; Q294-L297 HydrophobicContact CB-CD1 3.66Å; Q294-L297 HydrophobicContact CB-CG 3.95Å; Q294-L297 HydrophobicContact CG-CD1 4.05Å; Q294-L297 PolarHBondContact O-N 3.3Å; Q294-T298 PolarHBondContact O-N 2.84Å; Q294-T298 VanDerWaalsContact O-N 3.14Å; Q294-T298 PolarHBondContact O-OG1 3.46Å
295	P	97.3	Very high	95.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-30.6	-172.7	-22.4	32.1	0	0	0	114.6	I169 V260 M288 L297 Q299	I169-P295 HydrophobicContact CG2-CG 4.23Å; V260-P295 HydrophobicContact CG1-CB 4.38Å; M288-P295 HydrophobicContact CE-CB 4.47Å; M288-P295 HydrophobicContact SD-CB 3.61Å; P295-L297 PolarHBondContact O-N 3.03Å; P295-Q299 CarbonylContact O-C 3.56Å; P295-Q299 WeakPolarHBondContact O-CA 3.43Å; P295-Q299 PolarHBondContact O-N 2.95Å
296	Q	97.5	Very high	95.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.9	-20.6	176.8	78.2	-71.1	1.4	0	0	113.7	C78 L82 I169 Q294 L303	C78-Q296 VanDerWaalsContact O-CG 3.31Å; C78-Q296 WeakPolarHBondContact O-CG 3.28Å; L82-Q296 HydrophobicContact CB-CB 4.39Å; L82-Q296 HydrophobicContact CD2-CB 4.15Å; I169-Q296 HydrophobicContact CD1-CB 4.16Å; Q294-Q296 VanDerWaalsContact C-OE1 3.28Å; Q294-Q296 PolarHBondContact O-N 3.41Å; Q294-Q296 VanDerWaalsContact O-N 3.15Å; Q296-L303 HydrophobicContact CB-CD2 3.51Å
297	L	97.1	Very high	95.8	Very high	22 Å²	22	30.2 Å²	30.2	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-95.4	-40	177.9	-57.6	179.9	0	0	0	111.8	P81 L213 Y217 Q294 P295	P81-L297 HydrophobicContact CB-CD2 4.05Å; P81-L297 HydrophobicContact CG-CD2 3.79Å; L213-L297 HydrophobicContact CD2-CB 4.39Å; Y217-L297 HydrophobicContact CE1-CD1 3.81Å; Y217-L297 HydrophobicContact CE2-CD1 3.81Å; Y217-L297 WeakPolarHBondContact OH-CD1 3.34Å; Y217-L297 WeakPolarHBondContact OH-CD2 3.22Å; Q294-L297 HydrophobicContact CB-CB 4.13Å; Q294-L297 HydrophobicContact CB-CD1 3.66Å; Q294-L297 HydrophobicContact CB-CG 3.95Å; Q294-L297 HydrophobicContact CG-CD1 4.05Å; Q294-L297 PolarHBondContact O-N 3.3Å; P295-L297 PolarHBondContact O-N 3.03Å
298	T	96	Very high	95.7	Very high	45 Å²	45	26.7 Å²	26.7	28%	0.276	15%	0.154	S	C	.	.	H	α-helix	trans	-87	-34.4	-173.9	55.6	0	0	0	0	113	L213 S291 Q294 P300	L213-T298 HydrophobicContact CD2-CG2 3.77Å; S291-T298 WeakPolarHBondContact CA-OG1 3.48Å; S291-T298 PolarHBondContact O-OG1 2.85Å; Q294-T298 PolarHBondContact O-N 2.84Å; Q294-T298 VanDerWaalsContact O-N 3.14Å; Q294-T298 PolarHBondContact O-OG1 3.46Å; T298-P300 VanDerWaalsContact C-CD 3.41Å
299	Q	96.1	Very high	95.7	Very high	50 Å²	50	30.3 Å²	30.3	23%	0.234	17%	0.168	C	C	.	.			trans	-131.2	50.5	-175	-63.5	-71.1	-14.4	0	0	112.5	M288 D290 P295 G301 K302 L303	M288-Q299 HydrophobicContact CE-CB 3.47Å; M288-Q299 VanDerWaalsContact CE-CB 3.47Å; M288-Q299 HydrophobicContact CE-CG 4.38Å; D290-Q299 PolarHBondContact O-NE2 3.33Å; P295-Q299 CarbonylContact O-C 3.56Å; P295-Q299 WeakPolarHBondContact O-CA 3.43Å; P295-Q299 PolarHBondContact O-N 2.95Å; Q299-G301 PolarHBondContact O-N 2.89Å; Q299-G301 VanDerWaalsContact O-N 3.15Å; Q299-K302 HydrophobicContact CB-CB 4.48Å; Q299-K302 HydrophobicContact CB-CD 4.49Å; Q299-K302 PolarHBondContact O-N 3.17Å; Q299-L303 PolarHBondContact O-N 2.81Å; Q299-L303 VanDerWaalsContact O-N 3.14Å
300	P	96.6	Very high	95.9	Very high	25 Å²	25	28.9 Å²	28.9	16%	0.162	15%	0.153	C	C	.	.	H	α-helix	trans	-59.2	-32.8	-174.6	24.4	-34.7	0	0	0	113	L82 F85 T298 T304	L82-P300 HydrophobicContact CD1-CB 4.03Å; F85-P300 HydrophobicContact CB-CB 4.32Å; F85-P300 HydrophobicContact CD2-CB 4.14Å; F85-P300 HydrophobicContact CD2-CG 4.01Å; F85-P300 HydrophobicContact CE2-CG 4.25Å; F85-P300 HydrophobicContact CG-CB 4.08Å; F85-P300 HydrophobicContact CG-CG 4.45Å; T298-P300 VanDerWaalsContact C-CD 3.41Å; P300-T304 VanDerWaalsContact O-CB 3.22Å; P300-T304 WeakPolarHBondContact O-CB 3.31Å; P300-T304 PolarHBondContact O-N 3.09Å; P300-T304 PolarHBondContact O-OG1 3.39Å
301	G	96.6	Very high	96.2	Very high	23 Å²	23	22.5 Å²	22.5	24%	0.237	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-47.8	178.2	0	0	0	0	0	113.6	F85 Q299 L303 T304 E305	F85-G301 VanDerWaalsContact CE1-CA 3.44Å; Q299-G301 PolarHBondContact O-N 2.89Å; Q299-G301 VanDerWaalsContact O-N 3.15Å; G301-L303 PolarHBondContact O-N 3.08Å; G301-T304 PolarHBondContact O-N 3.27Å; G301-E305 PolarHBondContact O-N 2.94Å
302	K	96.6	Very high	96.4	Very high	98 Å²	98	24.4 Å²	24.4	43%	0.426	13%	0.127	S	C	.	.	H	α-helix	trans	-64	-42	177	-69.5	-179.9	-174.7	170.9	0	111	M288 Q299 E305 A306	M288-K302 HydrophobicContact CE-CB 3.51Å; M288-K302 HydrophobicContact CE-CD 4.33Å; Q299-K302 HydrophobicContact CB-CB 4.48Å; Q299-K302 HydrophobicContact CB-CD 4.49Å; Q299-K302 PolarHBondContact O-N 3.17Å; K302-E305 PolarHBondContact O-N 3.12Å; K302-A306 PolarHBondContact O-N 3.15Å
303	L	97.6	Very high	96.5	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-39.3	177.6	-178.1	59	0	0	0	111.9	L82 I169 M258 V260 M288 Q296 Q299 G301 A306 F307	L82-L303 HydrophobicContact CD1-CB 4.47Å; L82-L303 HydrophobicContact CD1-CD2 4.07Å; L82-L303 HydrophobicContact CD1-CG 4.36Å; L82-L303 HydrophobicContact CD2-CD2 3.88Å; I169-L303 HydrophobicContact CD1-CD2 3.86Å; M258-L303 HydrophobicContact CE-CD1 4.4Å; V260-L303 HydrophobicContact CG1-CD1 4.13Å; V260-L303 HydrophobicContact CG2-CD1 4.07Å; M288-L303 HydrophobicContact CE-CB 4.19Å; M288-L303 HydrophobicContact SD-CB 4.4Å; Q296-L303 HydrophobicContact CB-CD2 3.51Å; Q299-L303 PolarHBondContact O-N 2.81Å; Q299-L303 VanDerWaalsContact O-N 3.14Å; G301-L303 PolarHBondContact O-N 3.08Å; L303-A306 PolarHBondContact O-N 2.98Å; L303-F307 WeakPolarHBondContact O-CB 3.31Å; L303-F307 PolarHBondContact O-N 2.98Å
304	T	97.8	Very high	96.4	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-43.6	175.9	-61.2	0	0	0	0	111.5	D87 M88 I91 P300 G301 F307 K308	D87-T304 HydrophobicContact CB-CG2 3.81Å; M88-T304 HydrophobicContact CB-CG2 3.96Å; M88-T304 HydrophobicContact CE-CG2 4.06Å; M88-T304 HydrophobicContact SD-CG2 4.33Å; I91-T304 HydrophobicContact CD1-CG2 3.72Å; P300-T304 VanDerWaalsContact O-CB 3.22Å; P300-T304 WeakPolarHBondContact O-CB 3.31Å; P300-T304 PolarHBondContact O-N 3.09Å; P300-T304 PolarHBondContact O-OG1 3.39Å; G301-T304 PolarHBondContact O-N 3.27Å; T304-F307 PolarHBondContact O-N 3.47Å; T304-K308 PolarHBondContact O-N 3.44Å
305	E	96.1	Very high	96.2	Very high	52 Å²	52	31.8 Å²	31.8	24%	0.243	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-45.5	176	-173.4	-179.9	-174.9	0	0	111.2	G301 K302 F307 K308 Y309	G301-E305 PolarHBondContact O-N 2.94Å; K302-E305 PolarHBondContact O-N 3.12Å; E305-F307 PolarHBondContact O-N 3.28Å; E305-K308 WeakPolarHBondContact O-CB 3.29Å; E305-K308 PolarHBondContact O-N 3.47Å; E305-Y309 HydrophobicContact CG-CD2 4.14Å; E305-Y309 HydrophobicContact CG-CE2 3.45Å; E305-Y309 VanDerWaalsContact CG-CE2 3.45Å; E305-Y309 VanDerWaalsContact O-CD2 3.26Å; E305-Y309 WeakPolarHBondContact O-CD2 3.2Å; E305-Y309 PolarHBondContact O-N 2.97Å; E305-Y309 VanDerWaalsContact O-N 3.15Å; E305-Y309 WeakPolarHBondContact OE1-CE2 3.28Å; E305-Y309 PolarHBondContact OE1-OH 3.32Å
306	A	97.4	Very high	95.9	Very high	17 Å²	17	33.4 Å²	33.4	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-43.9	176	0	0	0	0	0	112.3	M258 L286 K302 L303 K308 Y309 F310	M258-A306 HydrophobicContact CE-CB 4.42Å; M258-A306 HydrophobicContact SD-CB 3.97Å; L286-A306 HydrophobicContact CD2-CB 3.5Å; L286-A306 VanDerWaalsContact CD2-CB 3.5Å; K302-A306 PolarHBondContact O-N 3.15Å; L303-A306 PolarHBondContact O-N 2.98Å; A306-K308 VanDerWaalsContact C-N 3.3Å; A306-K308 PolarHBondContact O-N 3.34Å; A306-Y309 PolarHBondContact O-N 3.43Å; A306-F310 PolarHBondContact O-N 2.87Å
307	F	97.6	Very high	95.2	Very high	7 Å²	7	34.3 Å²	34.3	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-39.6	176.9	-173.8	-123.9	0	0	0	112	I65 M88 I91 I141 V143 V167 M258 L303 T304 E305 F310 L311	I65-F307 HydrophobicContact CD1-CE1 4Å; I65-F307 HydrophobicContact CD1-CZ 3.92Å; I65-F307 HydrophobicContact CG1-CZ 4.45Å; M88-F307 HydrophobicContact CE-CB 4.43Å; M88-F307 HydrophobicContact CE-CD1 3.74Å; M88-F307 HydrophobicContact CE-CE1 4.45Å; M88-F307 HydrophobicContact CE-CG 4.4Å; M88-F307 HydrophobicContact SD-CD1 3.79Å; M88-F307 HydrophobicContact SD-CE1 4.14Å; I91-F307 HydrophobicContact CD1-CD1 4.21Å; I91-F307 HydrophobicContact CG2-CD1 4.16Å; I91-F307 HydrophobicContact CG2-CE1 4.02Å; I141-F307 HydrophobicContact CG2-CE2 4.44Å; V143-F307 HydrophobicContact CG2-CE2 4.13Å; V143-F307 HydrophobicContact CG2-CZ 4.33Å; V167-F307 HydrophobicContact CG2-CD2 3.76Å; V167-F307 HydrophobicContact CG2-CE2 3.78Å; M258-F307 HydrophobicContact CE-CB 4.45Å; M258-F307 HydrophobicContact CE-CD2 4.48Å; L303-F307 WeakPolarHBondContact O-CB 3.31Å; L303-F307 PolarHBondContact O-N 2.98Å; T304-F307 PolarHBondContact O-N 3.47Å; E305-F307 PolarHBondContact O-N 3.28Å; F307-F310 HydrophobicContact CD2-CD1 4.41Å; F307-F310 HydrophobicContact CE2-CD1 4.48Å; F307-F310 WeakPolarHBondContact O-CB 3.45Å; F307-F310 PolarHBondContact O-N 2.83Å; F307-L311 HydrophobicContact CD1-CD1 4.07Å; F307-L311 HydrophobicContact CE1-CD1 3.71Å; F307-L311 HydrophobicContact CE1-CG 4.31Å; F307-L311 HydrophobicContact CE2-CD2 4.22Å; F307-L311 HydrophobicContact CE2-CG 4.24Å; F307-L311 HydrophobicContact CZ-CD1 3.95Å; F307-L311 HydrophobicContact CZ-CD2 4.09Å; F307-L311 HydrophobicContact CZ-CG 4.14Å; F307-L311 WeakPolarHBondContact O-CG 3.3Å; F307-L311 PolarHBondContact O-N 3.26Å
308	K	95.8	Very high	93.7	Very high	12 Å²	12	37.6 Å²	37.6	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-48.2	173.3	-176.4	175.7	174.9	171.6	0	111.9	I91 T304 E305 A306 F310 L311 Q312 S320 C321	I91-K308 HydrophobicContact CD1-CB 3.76Å; I91-K308 HydrophobicContact CD1-CG 4.44Å; I91-K308 HydrophobicContact CG1-CB 4.48Å; T304-K308 PolarHBondContact O-N 3.44Å; E305-K308 WeakPolarHBondContact O-CB 3.29Å; E305-K308 PolarHBondContact O-N 3.47Å; A306-K308 VanDerWaalsContact C-N 3.3Å; A306-K308 PolarHBondContact O-N 3.34Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 3.43Å; K308-L311 PolarHBondContact O-N 2.95Å; K308-Q312 VanDerWaalsContact O-CG 3.31Å; K308-Q312 WeakPolarHBondContact O-CG 3.4Å; K308-Q312 PolarHBondContact O-N 3.26Å; K308-S320 WeakPolarHBondContact CE-OG 3.39Å; K308-C321 PolarHBondContact NZ-O 2.86Å
309	Y	95.9	Very high	92.2	Very high	82 Å²	82	41.6 Å²	41.6	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-37.1	178.5	-65.8	-49	0	0	0	112.2	E305 A306 Q312 G313 M322	E305-Y309 HydrophobicContact CG-CD2 4.14Å; E305-Y309 HydrophobicContact CG-CE2 3.45Å; E305-Y309 VanDerWaalsContact CG-CE2 3.45Å; E305-Y309 VanDerWaalsContact O-CD2 3.26Å; E305-Y309 WeakPolarHBondContact O-CD2 3.2Å; E305-Y309 PolarHBondContact O-N 2.97Å; E305-Y309 VanDerWaalsContact O-N 3.15Å; E305-Y309 WeakPolarHBondContact OE1-CE2 3.28Å; E305-Y309 PolarHBondContact OE1-OH 3.32Å; A306-Y309 PolarHBondContact O-N 3.43Å; Y309-Q312 PolarHBondContact O-N 2.93Å; Y309-G313 PolarHBondContact O-N 3.12Å; Y309-M322 HydrophobicContact CE1-CE 4.48Å
310	F	97.3	Very high	90.5	Very high	19 Å²	19	40.5 Å²	40.5	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-48.8	174.3	-179.6	-110.4	0	0	0	111.8	I141 V167 P256 M258 A306 F307 K308 Q312 G313 M314	I141-F310 HydrophobicContact CG2-CE1 4.42Å; V167-F310 HydrophobicContact CG2-CD1 3.92Å; V167-F310 HydrophobicContact CG2-CE1 3.91Å; P256-F310 HydrophobicContact CB-CE2 3.83Å; P256-F310 HydrophobicContact CB-CZ 4.05Å; P256-F310 WeakPolarHBondContact O-CZ 3.02Å; M258-F310 HydrophobicContact CB-CD2 3.79Å; M258-F310 HydrophobicContact CB-CE2 4Å; M258-F310 HydrophobicContact CB-CG 4.15Å; M258-F310 HydrophobicContact CE-CB 4.44Å; M258-F310 HydrophobicContact SD-CB 4.02Å; M258-F310 HydrophobicContact SD-CG 4.44Å; A306-F310 PolarHBondContact O-N 2.87Å; F307-F310 HydrophobicContact CD2-CD1 4.41Å; F307-F310 HydrophobicContact CE2-CD1 4.48Å; F307-F310 WeakPolarHBondContact O-CB 3.45Å; F307-F310 PolarHBondContact O-N 2.83Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 3.43Å; F310-Q312 VanDerWaalsContact C-N 3.32Å; F310-Q312 PolarHBondContact O-N 3.36Å; F310-G313 PolarHBondContact O-N 2.96Å; F310-M314 HydrophobicContact CD1-CE 3.72Å; F310-M314 HydrophobicContact CE1-CE 3.47Å; F310-M314 VanDerWaalsContact CE1-CE 3.47Å; F310-M314 HydrophobicContact CE1-SD 4.04Å; F310-M314 HydrophobicContact CZ-CE 4.08Å; F310-M314 HydrophobicContact CZ-SD 4.05Å; F310-M314 PolarHBondContact O-N 3.07Å
311	L	96	Very high	88.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-40.2	174.5	-67.7	178.3	0	0	0	112.4	I91 F95 I141 F307 K308 G313 M314 G315 Y316	I91-L311 HydrophobicContact CG2-CD1 3.26Å; F95-L311 HydrophobicContact CE2-CD1 4.02Å; F95-L311 HydrophobicContact CZ-CD1 4.22Å; F95-L311 HydrophobicContact CZ-CD2 4.3Å; I141-L311 HydrophobicContact CD1-CD2 3.51Å; I141-L311 HydrophobicContact CG2-CD2 4.49Å; F307-L311 HydrophobicContact CD1-CD1 4.07Å; F307-L311 HydrophobicContact CE1-CD1 3.71Å; F307-L311 HydrophobicContact CE1-CG 4.31Å; F307-L311 HydrophobicContact CE2-CD2 4.22Å; F307-L311 HydrophobicContact CE2-CG 4.24Å; F307-L311 HydrophobicContact CZ-CD1 3.95Å; F307-L311 HydrophobicContact CZ-CD2 4.09Å; F307-L311 HydrophobicContact CZ-CG 4.14Å; F307-L311 WeakPolarHBondContact O-CG 3.3Å; F307-L311 PolarHBondContact O-N 3.26Å; K308-L311 PolarHBondContact O-N 2.95Å; L311-G313 VanDerWaalsContact C-N 3.35Å; L311-M314 HydrophobicContact CD2-CE 3.66Å; L311-M314 PolarHBondContact O-N 3.34Å; L311-G315 PolarHBondContact O-N 2.84Å; L311-Y316 WeakPolarHBondContact O-CA 3.09Å; L311-Y316 WeakPolarHBondContact O-CB 3.48Å; L311-Y316 PolarHBondContact O-N 3.3Å
312	Q	94.1	Very high	86.5	Confident	43 Å²	43	46.2 Å²	46.2	20%	0.201	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-39	175.5	-74	178.1	-11.9	0	0	112.7	K308 Y309 F310 M314 G315 Y316 M317 S320	K308-Q312 VanDerWaalsContact O-CG 3.31Å; K308-Q312 WeakPolarHBondContact O-CG 3.4Å; K308-Q312 PolarHBondContact O-N 3.26Å; Y309-Q312 PolarHBondContact O-N 2.93Å; F310-Q312 VanDerWaalsContact C-N 3.32Å; F310-Q312 PolarHBondContact O-N 3.36Å; Q312-M314 PolarHBondContact O-N 3.43Å; Q312-G315 PolarHBondContact O-N 2.94Å; Q312-Y316 VanDerWaalsContact CA-O 3.27Å; Q312-Y316 WeakPolarHBondContact CA-O 3.44Å; Q312-M317 HydrophobicContact CG-CB 4.33Å; Q312-S320 PolarHBondContact NE2-O 2.98Å; Q312-S320 PolarHBondContact NE2-OG 2.94Å; Q312-S320 VanDerWaalsContact NE2-OG 3.11Å
313	G	94.4	Very high	84.5	Confident	72 Å²	72	43.9 Å²	43.9	74%	0.742	28%	0.283	S	S	*	.	H	α-helix	trans	-59.7	-31.9	174	0	0	0	0	0	113	Y309 F310 L311 G315	Y309-G313 PolarHBondContact O-N 3.12Å; F310-G313 PolarHBondContact O-N 2.96Å; L311-G313 VanDerWaalsContact C-N 3.35Å; G313-G315 VanDerWaalsContact C-N 3.26Å; G313-G315 PolarHBondContact O-N 3.38Å
314	M	94.1	Very high	82.3	Confident	40 Å²	40	52.6 Å²	52.6	20%	0.197	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	3.4	174.3	-60.7	-173.4	-68.1	0	0	113.6	I141 E164 P256 F310 L311 Q312 Y316	I141-M314 HydrophobicContact CD1-CE 3.75Å; I141-M314 HydrophobicContact CG1-CE 4.19Å; I141-M314 HydrophobicContact CG2-CE 4.38Å; E164-M314 VanDerWaalsContact O-SD 3.39Å; P256-M314 HydrophobicContact CB-CG 4.34Å; P256-M314 HydrophobicContact CB-SD 4.29Å; P256-M314 HydrophobicContact CG-CG 4.17Å; P256-M314 HydrophobicContact CG-SD 4.35Å; F310-M314 HydrophobicContact CD1-CE 3.72Å; F310-M314 HydrophobicContact CE1-CE 3.47Å; F310-M314 VanDerWaalsContact CE1-CE 3.47Å; F310-M314 HydrophobicContact CE1-SD 4.04Å; F310-M314 HydrophobicContact CZ-CE 4.08Å; F310-M314 HydrophobicContact CZ-SD 4.05Å; F310-M314 PolarHBondContact O-N 3.07Å; L311-M314 HydrophobicContact CD2-CE 3.66Å; L311-M314 PolarHBondContact O-N 3.34Å; Q312-M314 PolarHBondContact O-N 3.43Å; M314-Y316 VanDerWaalsContact C-N 3.35Å; M314-Y316 HydrophobicContact CB-CD2 4Å; M314-Y316 HydrophobicContact CB-CE2 4.29Å; M314-Y316 HydrophobicContact CE-CD2 4.4Å
315	G	92.8	Very high	79.7	Confident	54 Å²	54	57.4 Å²	57.4	56%	0.557	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	7.8	-179.2	0	0	0	0	0	114.4	L311 Q312 G313	L311-G315 PolarHBondContact O-N 2.84Å; Q312-G315 PolarHBondContact O-N 2.94Å; G313-G315 VanDerWaalsContact C-N 3.26Å; G313-G315 PolarHBondContact O-N 3.38Å
316	Y	91.1	Very high	77.1	Confident	34 Å²	34	57.3 Å²	57.3	13%	0.133	35%	0.346	C	S	.	.			trans	-85.7	157.7	172.7	-61.7	-48.3	0	0	0	111.7	P63 F95 I141 E164 L311 Q312 M314 A318	P63-Y316 VanDerWaalsContact CD-OH 3.23Å; P63-Y316 WeakPolarHBondContact CD-OH 3.32Å; P63-Y316 HydrophobicContact CG-CE2 3.91Å; F95-Y316 HydrophobicContact CE1-CD2 4.43Å; F95-Y316 HydrophobicContact CE1-CG 4.39Å; F95-Y316 HydrophobicContact CZ-CD2 4.43Å; F95-Y316 HydrophobicContact CZ-CG 4.14Å; I141-Y316 HydrophobicContact CD1-CD2 3.97Å; I141-Y316 HydrophobicContact CD1-CE2 3.88Å; E164-Y316 WeakPolarHBondContact OE2-CE2 3.19Å; E164-Y316 VanDerWaalsContact OE2-CZ 3.26Å; E164-Y316 PolarHBondContact OE2-OH 3.18Å; L311-Y316 WeakPolarHBondContact O-CA 3.09Å; L311-Y316 WeakPolarHBondContact O-CB 3.48Å; L311-Y316 PolarHBondContact O-N 3.3Å; Q312-Y316 VanDerWaalsContact CA-O 3.27Å; Q312-Y316 WeakPolarHBondContact CA-O 3.44Å; M314-Y316 VanDerWaalsContact C-N 3.35Å; M314-Y316 HydrophobicContact CB-CD2 4Å; M314-Y316 HydrophobicContact CB-CE2 4.29Å; M314-Y316 HydrophobicContact CE-CD2 4.4Å; Y316-A318 PolarHBondContact O-N 3.08Å; Y316-A318 VanDerWaalsContact O-N 3.08Å
317	M	81.3	Confident	74.8	Confident	19 Å²	19	67 Å²	67	9%	0.094	38%	0.379	C	S	.	.	S	Bend	trans	57.7	27.1	174.5	-59.7	-66.8	-71	0	0	115.8	E90 N94 F95 Q312 S319 S320	E90-M317 WeakPolarHBondContact O-CE 3.44Å; N94-M317 HydrophobicContact CB-SD 3.97Å; N94-M317 PolarHBondContact ND2-SD 3.17Å; F95-M317 HydrophobicContact CE2-CG 4.25Å; F95-M317 HydrophobicContact CE2-SD 4.31Å; Q312-M317 HydrophobicContact CG-CB 4.33Å; M317-S319 PolarHBondContact O-N 3.36Å; M317-S320 WeakPolarHBondContact O-CB 3.48Å; M317-S320 PolarHBondContact O-N 3.41Å; M317-S320 PolarHBondContact O-OG 2.92Å
318	A	67.1	Low	72	Confident	91 Å²	91	71.5 Å²	71.5	75%	0.752	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-24.5	-176.7	0	0	0	0	0	115.1	Y316	Y316-A318 PolarHBondContact O-N 3.08Å; Y316-A318 VanDerWaalsContact O-N 3.08Å
319	S	62.9	Low	69.7	Low	128 Å²	128	81.2 Å²	81.2	90%	0.895	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-2.4	178.3	-46.3	0	0	0	0	114.3	M317 C321	M317-S319 PolarHBondContact O-N 3.36Å; S319-C321 PolarHBondContact O-N 3.17Å
320	S	62.1	Low	67.5	Low	27 Å²	27	83.2 Å²	83.2	19%	0.189	47%	0.468	C	S	.	.	S	Bend	trans	-80.4	119.1	-179.5	63.6	0	0	0	0	110.4	K308 Q312 M317	K308-S320 WeakPolarHBondContact CE-OG 3.39Å; Q312-S320 PolarHBondContact NE2-O 2.98Å; Q312-S320 PolarHBondContact NE2-OG 2.94Å; Q312-S320 VanDerWaalsContact NE2-OG 3.11Å; M317-S320 WeakPolarHBondContact O-CB 3.48Å; M317-S320 PolarHBondContact O-N 3.41Å; M317-S320 PolarHBondContact O-OG 2.92Å
321	C	55.8	Low	65	Low	80 Å²	80	86.8 Å²	86.8	54%	0.541	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-63.7	144.6	-175.3	98.6	0	0	0	0	110.8	K308 S319 T323 S326	K308-C321 PolarHBondContact NZ-O 2.86Å; S319-C321 PolarHBondContact O-N 3.17Å; C321-T323 PolarHBondContact O-N 3Å; C321-S326 WeakPolarHBondContact SG-CB 3.21Å; C321-S326 PolarHBondContact SG-OG 2.83Å
322	M	51.7	Low	62.3	Low	88 Å²	88	92.5 Å²	92.5	43%	0.433	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-64.5	116.3	173.4	-71.3	-171.4	166.8	0	0	109.3	Y309 R324 L325 S326	Y309-M322 HydrophobicContact CE1-CE 4.48Å; M322-R324 PolarHBondContact O-N 3.47Å; M322-L325 HydrophobicContact CB-CB 4.11Å; M322-L325 HydrophobicContact CB-CD1 4.09Å; M322-L325 HydrophobicContact CB-CG 4.43Å; M322-L325 HydrophobicContact CG-CD1 4.4Å; M322-L325 PolarHBondContact O-N 3.16Å; M322-L325 HydrophobicContact SD-CD1 3.63Å; M322-S326 PolarHBondContact O-N 3.22Å; M322-S326 PolarHBondContact O-OG 3.2Å
323	T	55.6	Low	59.5	Low	49 Å²	49	98.8 Å²	98.8	30%	0.301	58%	0.575	S	S	.	*	H	α-helix	trans	-57.2	-31.2	-178.1	30.4	0	0	0	0	112.6	C321 S326 R327	C321-T323 PolarHBondContact O-N 3Å; T323-S326 WeakPolarHBondContact CA-OG 3.48Å; T323-S326 PolarHBondContact O-OG 3.39Å; T323-R327 PolarHBondContact O-N 3.12Å
324	R	51.2	Low	56.8	Low	187 Å²	187	102.1 Å²	102.1	71%	0.706	58%	0.581	S	S	*	*	H	α-helix	trans	-72.3	-38	173.2	-87.2	-171.9	171.5	-131.8	-0.2	114.3	M322 S328	M322-R324 PolarHBondContact O-N 3.47Å; R324-S328 PolarHBondContact O-OG 3.18Å
325	L	43.5	Very low	54.2	Low	105 Å²	105	105.6 Å²	105.6	55%	0.55	61%	0.61	S	S	.	*	H	α-helix	trans	-81.7	-27.5	-178.1	-79.3	164.4	0	0	0	113	M322 S328	M322-L325 HydrophobicContact CB-CB 4.11Å; M322-L325 HydrophobicContact CB-CD1 4.09Å; M322-L325 HydrophobicContact CB-CG 4.43Å; M322-L325 HydrophobicContact CG-CD1 4.4Å; M322-L325 PolarHBondContact O-N 3.16Å; M322-L325 HydrophobicContact SD-CD1 3.63Å; L325-S328 PolarHBondContact O-N 3.4Å
326	S	41.2	Very low	51.6	Low	49 Å²	49	108 Å²	108	34%	0.343	62%	0.624	S	S	.	*	H	α-helix	trans	-75.2	-35.5	177.1	47.8	0	0	0	0	112.8	C321 M322 T323 S328 R329	C321-S326 WeakPolarHBondContact SG-CB 3.21Å; C321-S326 PolarHBondContact SG-OG 2.83Å; M322-S326 PolarHBondContact O-N 3.22Å; M322-S326 PolarHBondContact O-OG 3.2Å; T323-S326 WeakPolarHBondContact CA-OG 3.48Å; T323-S326 PolarHBondContact O-OG 3.39Å; S326-S328 PolarHBondContact O-N 2.96Å; S326-R329 PolarHBondContact O-N 3.27Å; S326-R329 VanDerWaalsContact O-N 3.12Å
327	R	48.4	Very low	48.9	Very low	221 Å²	221	111.1 Å²	111.1	83%	0.834	66%	0.657	S	S	*	*	H	α-helix	trans	-64.8	-22.6	170.9	-92.1	-175.6	170.7	-171.3	-0.2	113.7	T323 R329	T323-R327 PolarHBondContact O-N 3.12Å; R327-R329 VanDerWaalsContact C-N 3.34Å
328	S	40.6	Very low	46.6	Very low	101 Å²	101	115.6 Å²	115.6	71%	0.706	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-4.8	174	-62.6	0	0	0	0	114.2	R324 L325 S326	R324-S328 PolarHBondContact O-OG 3.18Å; L325-S328 PolarHBondContact O-N 3.4Å; S326-S328 PolarHBondContact O-N 2.96Å
329	R	46.8	Very low	45.2	Very low	217 Å²	217	119.2 Å²	119.2	82%	0.819	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	14.9	-175	-77.4	-171.5	177.9	-172.3	0.7	115.8	S326 R327	S326-R329 PolarHBondContact O-N 3.27Å; S326-R329 VanDerWaalsContact O-N 3.12Å; R327-R329 VanDerWaalsContact C-N 3.34Å
330	T	49.5	Very low	43.9	Very low	124 Å²	124	120.9 Å²	120.9	76%	0.761	69%	0.694	S	S	*	*			trans	-118.1	76.1	174.2	47.2	0	0	0	0	112.4
331	A	44.3	Very low	42.4	Very low	94 Å²	94	123.4 Å²	123.4	78%	0.777	73%	0.725	S	S	*	*	S	Bend	trans	-172.6	68.5	148.1	0	0	0	0	0	110.6
332	S	40.5	Very low	41.4	Very low	120 Å²	120	126.7 Å²	126.7	84%	0.839	74%	0.737	S	S	*	*			trans	-166.8	72.1	157.9	-75.5	0	0	0	0	109.2
333	L	34.8	Very low	40.6	Very low	174 Å²	174	132.7 Å²	132.7	91%	0.911	76%	0.755	S	S	*	*			trans	-105.6	92.2	161	-82.7	164.7	0	0	0	107.5	S335	L333-S335 PolarHBondContact O-N 2.75Å
334	T	38.6	Very low	39.5	Very low	142 Å²	142	136.2 Å²	136.2	87%	0.871	78%	0.781	S	S	*	*			trans	-67.8	111.1	156.5	35.9	0	0	0	0	108.4
335	S	37.8	Very low	38.8	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	79%	0.79	S	S	*	*			trans	-91.7	105.3	168	41.8	0	0	0	0	109.9	L333 A337	L333-S335 PolarHBondContact O-N 2.75Å; S335-A337 PolarHBondContact O-N 3.44Å
336	A	38	Very low	38.3	Very low	105 Å²	105	138.2 Å²	138.2	87%	0.868	80%	0.797	S	S	*	*			trans	-77.7	103.3	158.2	0	0	0	0	0	107.9
337	A	35.6	Very low	38	Very low	99 Å²	99	147 Å²	147	82%	0.818	82%	0.822	S	S	*	*			trans	-117.3	108.2	165.5	0	0	0	0	0	108.1	S335	S335-A337 PolarHBondContact O-N 3.44Å
338	S	33.8	Very low	37.3	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	82%	0.817	S	S	*	*			trans	-97.9	121	172	48.3	0	0	0	0	109.7
339	I	36.3	Very low	36.9	Very low	167 Å²	167	145 Å²	145	86%	0.856	82%	0.823	S	S	*	*			trans	-163.8	146.1	138.1	-150.4	91.8	0	0	0	110.1
340	D	36.1	Very low	36.2	Very low	162 Å²	162	138.7 Å²	138.7	87%	0.866	81%	0.813	S	S	*	*			trans	-62.4	152.6	-162.6	-69.9	-61.3	0	0	0	119.2
341	G	31.4	Very low	35.4	Very low	81 Å²	81	140.9 Å²	140.9	84%	0.835	82%	0.815	S	S	*	*			trans	-162.7	107.5	167.7	0	0	0	0	0	112.7
342	N	33.9	Very low	34.7	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	81%	0.812	S	S	*	*			trans	-69.1	155.4	-167.3	-162.6	15.9	0	0	0	116.4
343	R	35.3	Very low	34.6	Very low	214 Å²	214	140.5 Å²	140.5	81%	0.808	81%	0.806	S	S	*	*			trans	82.8	112.3	162.1	-62.7	179.7	170.4	169.4	-2.7	119.7
344	S	32.8	Very low	34.7	Very low	122 Å²	122	140.3 Å²	140.3	85%	0.853	80%	0.801	S	S	*	*				174.9	147.1	94.7	-74.2	0	0	0	0	113.1
345	R	35.8	Very low	34.4	Very low	237 Å²	237	139 Å²	139	89%	0.894	80%	0.798	S	S	*	*			trans	-71.7	149.2	-174.2	-65.3	165.9	154.9	173.2	-6.3	114.1
346	S	33.4	Very low	34.1	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	79%	0.79	S	S	*	*				138.2	127.3	115.7	-63.8	0	0	0	0	115.1
347	R	33.4	Very low	33.9	Very low	234 Å²	234	137.9 Å²	137.9	88%	0.883	79%	0.787	S	S	*	*			trans	55.5	135	134	-62.7	-177.9	170.7	172.8	-3.1	118
348	T	34.3	Very low	33.9	Very low	119 Å²	119	141 Å²	141	73%	0.73	79%	0.79	S	S	*	*			cis	-167.3	147.3	44.2	26.7	0	0	0	0	108.9
349	L	31.6	Very low	33.9	Very low	159 Å²	159	140.7 Å²	140.7	83%	0.832	79%	0.787	S	S	*	*				36.2	135.6	108	-93.9	85.8	0	0	0	114.9
350	S	33.8	Very low	33.8	Very low	86 Å²	86	138.6 Å²	138.6	60%	0.601	79%	0.787	S	S	*	*			cis	174.1	170.3	21.8	45	0	0	0	0	111.3
351	Q	32.4	Very low	33.7	Very low	170 Å²	170	134.4 Å²	134.4	79%	0.794	78%	0.782	S	S	*	*			trans	83.9	113	154.9	-72.6	169.2	21.5	0	0	118.5
352	S	30.1	Very low	34.2	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	78%	0.783	S	S	*	*				77.4	113.8	68.6	-55.6	0	0	0	0	112.4
353	S	36.7	Very low	34.9	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	79%	0.785	S	S	*	*				95.2	141.8	113.8	52.6	0	0	0	0	111.1
354	E	37.3	Very low	34.8	Very low	170 Å²	170	129.5 Å²	129.5	79%	0.794	79%	0.786	S	S	*	*			cis	-172.7	136.6	15	-124.3	172.2	142.7	0	0	105.5
355	S	33.4	Very low	35	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	79%	0.787	S	S	*	*				80.5	137.8	109.3	76.4	0	0	0	0	118.5
356	G	31.5	Very low	35.1	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	79%	0.788	S	S	*	*			trans	138.1	72	155.9	0	0	0	0	0	115
357	T	33.3	Very low	35.1	Very low	131 Å²	131	132 Å²	132	80%	0.804	80%	0.796	S	S	*	*				60.3	103.2	105.1	56.9	0	0	0	0	115.3
358	L	35.1	Very low	35.1	Very low	166 Å²	166	130.3 Å²	130.3	87%	0.869	80%	0.798	S	S	*	*				72.6	127.8	81.8	-85	165.7	0	0	0	116.1
359	S	33.4	Very low	35.2	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	80%	0.8	S	S	*	*			trans	149.1	107.4	139	-64.4	0	0	0	0	109.8
360	S	35.3	Very low	35.3	Very low	122 Å²	122	128.3 Å²	128.3	85%	0.853	80%	0.796	S	S	*	*				90.3	121.1	65.3	70.5	0	0	0	0	115
361	G	33	Very low	35.6	Very low	74 Å²	74	134 Å²	134	76%	0.763	83%	0.833	S	S	*	*			trans	138	147.7	152.8	0	0	0	0	0	117.2
362	P	43	Very low	35.7	Very low	130 Å²	130	132.2 Å²	132.2	84%	0.844	84%	0.835	S	S	*	*				-128	-150.4	-128.6	44	-26	0	0	0	114.6
363	P	48	Very low	36	Very low	131 Å²	131	133.7 Å²	133.7	85%	0.851	84%	0.841	S	S	*	*				-106.2	165.9	-119.4	33	-12.1	0	0	0	115
364	G	32.8	Very low	36	Very low	80 Å²	80	135.4 Å²	135.4	83%	0.825	85%	0.848	S	S	*	*			trans	-135.4	118.6	176.9	0	0	0	0	0	113.3
365	H	37.2	Very low	35.9	Very low	189 Å²	189	133.4 Å²	133.4	88%	0.875	85%	0.851	S	S	*	*			trans	-72.7	147.4	166.7	-92.6	-79	0	0	0	111.8
366	T	37.3	Very low	36.1	Very low	147 Å²	147	134.5 Å²	134.5	90%	0.902	85%	0.854	S	S	*	*			trans	-160.3	126	137.2	31.6	0	0	0	0	110.8
367	M	35.2	Very low	36.4	Very low	175 Å²	175	139.3 Å²	139.3	86%	0.862	87%	0.869	S	S	*	*			trans	-75.6	152.8	157.9	-81.6	176.5	163.5	0	0	109.4
368	E	33.7	Very low	36.6	Very low	198 Å²	198	139.9 Å²	139.9	93%	0.925	87%	0.873	S	S	*	*				-171.1	160.1	129.5	-105.5	175.9	-169	0	0	112.1
369	V	34.7	Very low	36.7	Very low	129 Å²	129	137.9 Å²	137.9	78%	0.782	87%	0.874	S	S	*	*			trans	-120.5	157.3	-157.4	172	0	0	0	0	110.1
370	S	34.3	Very low	37	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	88%	0.884	S	S	*	*			trans	76.3	121.8	161.6	-73.3	0	0	0	0	120
371	C	39.6	Very low	37.1	Very low	205 Å²	205	142.2 Å²	142.2	100%	1.385	89%	0.887	S	S	*	*				-147.4	0	83	-84.4	0	0	0	0	110

Retrieved 371 of 371 residues in 437.6 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).