A0A0D9RNI8_CHLSB Loading...

Shisa family member 4

AlphaFold DB , UniProt , Accession A0A0D9RNI8, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene SHISA4, Length 197 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	49.3	Very low	238 Å²	238	137.6 Å²	137.6	100%	1.172	79%	0.786	S	S	*	*				0	96.2	0	-68.4	167.3	-178.8	0	0	108.2
2	P	44	Very low	49.8	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-82.7	138.1	173	31.7	-29.2	0	0	0	110	A4	P2-A4 PolarHBondContact O-N 3.25Å
3	P	46.4	Very low	50.5	Low	130 Å²	130	132.6 Å²	132.6	84%	0.844	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-72.2	128.2	-178.6	27.6	-31.1	0	0	0	111
4	A	47.8	Very low	51.2	Low	105 Å²	105	126.7 Å²	126.7	87%	0.868	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-62	140.6	165	0	0	0	0	0	110.2	P2	P2-A4 PolarHBondContact O-N 3.25Å
5	G	48.5	Very low	51.9	Low	68 Å²	68	124.8 Å²	124.8	70%	0.701	72%	0.715	S	S	*	*			trans	156.7	-1.2	162.8	0	0	0	0	0	119	R7	G5-R7 PolarHBondContact O-N 3.1Å
6	L	50.6	Low	52.5	Low	175 Å²	175	119.6 Å²	119.6	92%	0.916	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	52.1	-179.9	-116.4	80.6	0	0	0	113.2
7	R	54.5	Low	53	Low	242 Å²	242	120.3 Å²	120.3	91%	0.913	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	6.1	176.8	-75.7	-165.7	176.2	-167.5	-0	116.3	G5	G5-R7 PolarHBondContact O-N 3.1Å
8	R	51.8	Low	53.2	Low	229 Å²	229	120.8 Å²	120.8	86%	0.864	69%	0.691	S	S	*	*	S	Bend	trans	-115.3	-3.5	175.9	-90.4	-176.3	-177.4	168.1	1.2	116	P11	R8-P11 WeakPolarHBondContact O-CD 3.02Å
9	A	49	Very low	53.5	Low	66 Å²	66	121.6 Å²	121.6	55%	0.545	69%	0.69	S	S	.	*	S	Bend	trans	-87.6	-16.5	-179.4	0	0	0	0	0	114.2	T13	A9-T13 PolarHBondContact O-N 3.29Å; A9-T13 PolarHBondContact O-OG1 2.96Å
10	A	55.1	Low	53.7	Low	69 Å²	69	122.9 Å²	122.9	57%	0.57	69%	0.694	S	S	*	*	H	α-helix	trans	-66.7	-39	-176	0	0	0	0	0	116	T13 A14	A10-T13 PolarHBondContact O-OG1 3.17Å; A10-A14 VanDerWaalsContact O-CB 3.32Å; A10-A14 WeakPolarHBondContact O-CB 3.35Å; A10-A14 PolarHBondContact O-N 3.22Å; A10-A14 VanDerWaalsContact O-N 3.08Å
11	P	55.5	Low	53.7	Low	68 Å²	68	120.3 Å²	120.3	44%	0.442	69%	0.694	S	S	.	*	H	α-helix	trans	-72.9	-34.7	-176.1	28.3	-31.9	0	0	0	111.2	R8 I15	R8-P11 WeakPolarHBondContact O-CD 3.02Å; P11-I15 VanDerWaalsContact O-CB 3.27Å; P11-I15 WeakPolarHBondContact O-CB 3.19Å; P11-I15 VanDerWaalsContact O-CD1 3.27Å; P11-I15 WeakPolarHBondContact O-CD1 3.43Å; P11-I15 WeakPolarHBondContact O-CG1 3.41Å; P11-I15 PolarHBondContact O-N 3.38Å
12	L	54.9	Low	54.5	Low	126 Å²	126	112.2 Å²	112.2	66%	0.66	67%	0.665	S	S	*	*	H	α-helix	trans	-73.4	-35.5	-178.4	-64.4	175.7	0	0	0	112.2	A16	L12-A16 WeakPolarHBondContact O-CB 3.14Å; L12-A16 PolarHBondContact O-N 2.69Å
13	T	59.2	Low	54.7	Low	84 Å²	84	110.2 Å²	110.2	52%	0.515	65%	0.652	S	S	.	*	H	α-helix	trans	-72.7	-38	173.7	27.8	0	0	0	0	112	A9 A10 A16 L17	A9-T13 PolarHBondContact O-N 3.29Å; A9-T13 PolarHBondContact O-OG1 2.96Å; A10-T13 PolarHBondContact O-OG1 3.17Å; T13-A16 PolarHBondContact O-N 2.96Å; T13-L17 WeakPolarHBondContact O-CB 3.47Å; T13-L17 WeakPolarHBondContact O-CD1 3.18Å; T13-L17 WeakPolarHBondContact O-CG 3.39Å; T13-L17 PolarHBondContact O-N 3.43Å
14	A	60.5	Low	54.6	Low	50 Å²	50	112.4 Å²	112.4	41%	0.413	66%	0.656	S	S	.	*	H	α-helix	trans	-66.4	-42.6	174.6	0	0	0	0	0	112.4	A10 L17 L18	A10-A14 VanDerWaalsContact O-CB 3.32Å; A10-A14 WeakPolarHBondContact O-CB 3.35Å; A10-A14 PolarHBondContact O-N 3.22Å; A10-A14 VanDerWaalsContact O-N 3.08Å; A14-L17 PolarHBondContact O-N 2.88Å; A14-L18 WeakPolarHBondContact O-CB 3.24Å; A14-L18 PolarHBondContact O-N 2.86Å
15	I	61.7	Low	54.6	Low	98 Å²	98	111.8 Å²	111.8	50%	0.503	65%	0.651	S	S	.	*	H	α-helix	trans	-67.5	-42	174.9	-66.5	163.4	0	0	0	110.2	P11 L17 L18 M19	P11-I15 VanDerWaalsContact O-CB 3.27Å; P11-I15 WeakPolarHBondContact O-CB 3.19Å; P11-I15 VanDerWaalsContact O-CD1 3.27Å; P11-I15 WeakPolarHBondContact O-CD1 3.43Å; P11-I15 WeakPolarHBondContact O-CG1 3.41Å; P11-I15 PolarHBondContact O-N 3.38Å; I15-L17 PolarHBondContact O-N 2.81Å; I15-L18 PolarHBondContact O-N 3.43Å; I15-M19 HydrophobicContact CG2-CG 4.13Å; I15-M19 WeakPolarHBondContact O-CB 3.32Å; I15-M19 WeakPolarHBondContact O-CG 3.41Å; I15-M19 PolarHBondContact O-N 3.42Å
16	A	61.2	Low	54.3	Low	41 Å²	41	116 Å²	116	34%	0.339	66%	0.657	S	S	.	*	H	α-helix	trans	-62.2	-42.4	175.4	0	0	0	0	0	111.9	L12 T13 M19 L20	L12-A16 WeakPolarHBondContact O-CB 3.14Å; L12-A16 PolarHBondContact O-N 2.69Å; T13-A16 PolarHBondContact O-N 2.96Å; A16-M19 PolarHBondContact O-N 3.37Å; A16-L20 HydrophobicContact CB-CD1 4.38Å; A16-L20 VanDerWaalsContact O-CB 3.24Å; A16-L20 WeakPolarHBondContact O-CB 3.23Å; A16-L20 WeakPolarHBondContact O-CD1 3.14Å; A16-L20 PolarHBondContact O-N 2.89Å
17	L	60.5	Low	54	Low	132 Å²	132	111.3 Å²	111.3	69%	0.691	64%	0.643	S	S	*	*	H	α-helix	trans	-63.7	-38.6	174.2	-79.9	162	0	0	0	112.4	T13 A14 I15 G21	T13-L17 WeakPolarHBondContact O-CB 3.47Å; T13-L17 WeakPolarHBondContact O-CD1 3.18Å; T13-L17 WeakPolarHBondContact O-CG 3.39Å; T13-L17 PolarHBondContact O-N 3.43Å; A14-L17 PolarHBondContact O-N 2.88Å; I15-L17 PolarHBondContact O-N 2.81Å; L17-G21 PolarHBondContact O-N 3.23Å
18	L	57.5	Low	54.2	Low	129 Å²	129	102.5 Å²	102.5	68%	0.675	63%	0.628	S	S	*	*	H	α-helix	trans	-65.8	-36.4	174.1	-111.8	136.4	0	0	0	112.6	A14 I15 A22	A14-L18 WeakPolarHBondContact O-CB 3.24Å; A14-L18 PolarHBondContact O-N 2.86Å; I15-L18 PolarHBondContact O-N 3.43Å; L18-A22 WeakPolarHBondContact O-CB 3.49Å
19	M	58.2	Low	55.2	Low	136 Å²	136	95 Å²	95	67%	0.67	60%	0.603	S	S	*	*	H	α-helix	trans	-84.8	-32.1	-178.3	-62.9	-61.4	-75.6	0	0	112.8	I15 A16	I15-M19 HydrophobicContact CG2-CG 4.13Å; I15-M19 WeakPolarHBondContact O-CB 3.32Å; I15-M19 WeakPolarHBondContact O-CG 3.41Å; I15-M19 PolarHBondContact O-N 3.42Å; A16-M19 PolarHBondContact O-N 3.37Å
20	L	57.8	Low	56.7	Low	148 Å²	148	95.5 Å²	95.5	78%	0.775	60%	0.596	S	S	*	*	H	α-helix	trans	-76.6	-23.1	173.9	-85.7	142.7	0	0	0	112.8	A16	A16-L20 HydrophobicContact CB-CD1 4.38Å; A16-L20 VanDerWaalsContact O-CB 3.24Å; A16-L20 WeakPolarHBondContact O-CB 3.23Å; A16-L20 WeakPolarHBondContact O-CD1 3.14Å; A16-L20 PolarHBondContact O-N 2.89Å
21	G	54.1	Low	58.4	Low	68 Å²	68	92.2 Å²	92.2	70%	0.701	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-5.3	174.4	0	0	0	0	0	115.2	L17	L17-G21 PolarHBondContact O-N 3.23Å
22	A	56.4	Low	60	Low	68 Å²	68	90.5 Å²	90.5	56%	0.562	56%	0.556	S	S	*	*	S	Bend	trans	-115.1	12.9	-159.7	0	0	0	0	0	118.3	L18	L18-A22 WeakPolarHBondContact O-CB 3.49Å
23	P	47.4	Very low	61.7	Low	82 Å²	82	89.1 Å²	89.1	53%	0.532	54%	0.542	S	S	.	.	S	Bend	trans	-145.6	71	148.3	30.3	-9.1	0	0	0	113.9	L26	P23-L26 HydrophobicContact CB-CD1 3.95Å
24	L	45.3	Very low	63	Low	176 Å²	176	85.8 Å²	85.8	92%	0.921	52%	0.52	S	S	*	.	S	Bend	trans	-98.7	1.3	146.9	-84.8	160.1	0	0	0	112.1	L26	L24-L26 VanDerWaalsContact C-N 3.27Å; L24-L26 PolarHBondContact O-N 3.4Å
25	A	46.1	Very low	64.4	Low	93 Å²	93	86.1 Å²	86.1	77%	0.769	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	31.5	180	0	0	0	0	0	113.8
26	L	42.4	Very low	65.7	Low	155 Å²	155	83 Å²	83	81%	0.812	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	10.7	178.1	-88.6	146.3	0	0	0	113.7	P23 L24	P23-L26 HydrophobicContact CB-CD1 3.95Å; L24-L26 VanDerWaalsContact C-N 3.27Å; L24-L26 PolarHBondContact O-N 3.4Å
27	A	44.4	Very low	66.8	Low	77 Å²	77	90.4 Å²	90.4	64%	0.636	52%	0.518	S	S	*	.	S	Bend	trans	-91.3	90.5	154.4	0	0	0	0	0	106.7	E29	A27-E29 PolarHBondContact O-N 3.38Å
28	G	59.8	Low	68.1	Low	57 Å²	57	91.6 Å²	91.6	59%	0.588	53%	0.525	S	S	*	.			trans	-60.6	123.5	173.7	0	0	0	0	0	109.2
29	E	72	Confident	69.4	Low	73 Å²	73	87 Å²	87	34%	0.341	51%	0.509	S	S	.	.			trans	-69.3	132.7	175.4	-60.8	178.2	146.7	0	0	110.1	A27 G44 N46	A27-E29 PolarHBondContact O-N 3.38Å; E29-G44 WeakPolarHBondContact OE2-CA 3.08Å; E29-N46 VanDerWaalsContact CA-OD1 3.27Å; E29-N46 WeakPolarHBondContact CA-OD1 3.39Å
30	D	80.3	Confident	70.9	Confident	75 Å²	75	83.3 Å²	83.3	40%	0.401	50%	0.496	S	S	.	.	S	Bend	trans	-63	-44.3	176.5	-66.9	-52	0	0	0	111.6	N46 C47 C53 Q75	D30-N46 PolarHBondContact N-OD1 3.37Å; D30-C47 HydrophobicContact CB-CB 4.08Å; D30-C47 PolarHBondContact OD2-N 2.86Å; D30-C53 WeakPolarHBondContact O-CB 3.34Å; D30-Q75 PolarHBondContact O-NE2 2.82Å
31	C	90.8	Very high	72.4	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	49%	0.486	C	S	.	.	B	Isolated β-bridge	trans	-109.3	112.1	169.4	-73.8	0	0	0	0	109.6	G44 F45 C53	C31-G44 CarbonylContact O-C 3.46Å; C31-G44 WeakPolarHBondContact O-CA 3.26Å; C31-F45 HydrophobicContact CB-CD1 4.13Å; C31-F45 HydrophobicContact CB-CD2 3.96Å; C31-F45 HydrophobicContact CB-CE1 3.83Å; C31-F45 HydrophobicContact CB-CE2 3.64Å; C31-F45 HydrophobicContact CB-CG 4.19Å; C31-F45 HydrophobicContact CB-CZ 3.58Å; C31-F45 WeakPolarHBondContact CB-O 3.43Å; C31-F45 PolarHBondContact N-O 3.45Å; C31-F45 PolarHBondContact O-N 3.09Å; C31-F45 WeakPolarHBondContact SG-CE2 3.14Å; C31-F45 WeakPolarHBondContact SG-CZ 3.44Å; C31-C53 WeakPolarHBondContact CA-SG 3.32Å; C31-C53 HydrophobicContact CB-CB 4.07Å; C31-C53 WeakPolarHBondContact CB-SG 3.27Å; C31-C53 WeakPolarHBondContact SG-CA 3.39Å; C31-C53 WeakPolarHBondContact SG-CB 3.2Å; C31-C53 CovalentContact SG-SG 2.03Å; C31-C53 PolarHBondContact SG-SG 3.43Å
32	L	90.4	Very high	74.2	Confident	32 Å²	32	82.7 Å²	82.7	17%	0.168	47%	0.465	C	S	.	.			trans	-63.4	160.1	171.4	-63.4	171.2	0	0	0	110.8	R60 E72 Q75 K76	L32-R60 VanDerWaalsContact C-NH1 3.3Å; L32-R60 PolarHBondContact O-NH1 2.86Å; L32-E72 HydrophobicContact CD1-CG 4.14Å; L32-Q75 HydrophobicContact CD1-CB 4Å; L32-K76 HydrophobicContact CD1-CG 3.74Å
33	W	89	Confident	75.8	Confident	98 Å²	98	82.9 Å²	82.9	37%	0.371	46%	0.461	S	S	.	.			trans	-55.1	154.3	169.2	70.1	-92	0	0	0	112	L35 W41 H42 R60 L79	W33-L35 HydrophobicContact CZ3-CD1 4.35Å; W33-L35 HydrophobicContact CZ3-CG 4.25Å; W33-W41 HydrophobicContact CB-CZ2 4.15Å; W33-W41 AromaticContact CD2-NE1 3.76Å; W33-W41 AromaticContact CE3-CD1 3.68Å; W33-W41 AromaticContact CE3-NE1 3.28Å; W33-W41 VanDerWaalsContact CE3-NE1 3.28Å; W33-W41 AromaticContact CZ3-CD1 4Å; W33-W41 AromaticContact CZ3-NE1 3.91Å; W33-H42 VanDerWaalsContact CA-O 3.24Å; W33-H42 WeakPolarHBondContact CA-O 3.3Å; W33-H42 VanDerWaalsContact CB-O 3.26Å; W33-H42 WeakPolarHBondContact CB-O 3.29Å; W33-R60 PolarHBondContact O-NH1 3.25Å; W33-L79 HydrophobicContact CD2-CD2 4.26Å; W33-L79 HydrophobicContact CE3-CD2 3.96Å; W33-L79 HydrophobicContact CH2-CD2 3.56Å; W33-L79 HydrophobicContact CZ2-CD1 4.42Å; W33-L79 HydrophobicContact CZ2-CD2 3.86Å; W33-L79 HydrophobicContact CZ3-CD2 3.61Å
34	Y	88.4	Confident	77.9	Confident	14 Å²	14	79.7 Å²	79.7	6%	0.055	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	164.7	179	65.2	-75.4	0	0	0	112.5	D36 H42 F45 Y58 R60	Y34-D36 WeakPolarHBondContact CD2-OD1 3.11Å; Y34-D36 WeakPolarHBondContact CE2-OD1 3.22Å; Y34-H42 HydrophobicContact CD1-CB 3.8Å; Y34-H42 HydrophobicContact CD2-CB 4.39Å; Y34-H42 HydrophobicContact CE1-CB 3.51Å; Y34-H42 HydrophobicContact CE2-CB 4.17Å; Y34-H42 HydrophobicContact CG-CB 4.23Å; Y34-H42 AromaticContact CZ-CG 3.89Å; Y34-H42 PolarHBondContact N-O 2.77Å; Y34-H42 PolarHBondContact O-N 3.19Å; Y34-F45 HydrophobicContact CE1-CE1 4.27Å; Y34-Y58 VanDerWaalsContact CE2-C 3.45Å; Y34-Y58 WeakPolarHBondContact CE2-O 3.3Å; Y34-R60 HydrophobicContact CD1-CB 4.12Å; Y34-R60 HydrophobicContact CD1-CG 3.93Å; Y34-R60 HydrophobicContact CE1-CB 3.75Å; Y34-R60 HydrophobicContact CE1-CG 4.05Å; Y34-R60 HydrophobicContact CG-CG 4.18Å; Y34-R60 PolarHBondContact OH-N 3.23Å; Y34-R60 PolarHBondContact OH-O 2.96Å
35	L	88.8	Confident	80.1	Confident	56 Å²	56	74.4 Å²	74.4	29%	0.293	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.6	172.4	-76.2	161.9	0	0	0	108.3	W33 S40 W41 Y58	W33-L35 HydrophobicContact CZ3-CD1 4.35Å; W33-L35 HydrophobicContact CZ3-CG 4.25Å; L35-S40 CarbonylContact C-O 3.46Å; L35-S40 VanDerWaalsContact CA-O 3.3Å; L35-S40 WeakPolarHBondContact CA-O 3.46Å; L35-W41 HydrophobicContact CD2-CB 3.93Å; L35-Y58 WeakPolarHBondContact O-CD1 3.25Å
36	D	88.3	Confident	82.2	Confident	33 Å²	33	74.5 Å²	74.5	18%	0.176	40%	0.4	C	S	.	.			trans	-70.1	168.2	175.7	-82.2	14.1	0	0	0	111.4	Y34 N38 G39 S40 H42 Y58	Y34-D36 WeakPolarHBondContact CD2-OD1 3.11Å; Y34-D36 WeakPolarHBondContact CE2-OD1 3.22Å; D36-N38 PolarHBondContact O-N 3.34Å; D36-G39 WeakPolarHBondContact O-CA 3.28Å; D36-G39 PolarHBondContact O-N 3.37Å; D36-S40 PolarHBondContact N-O 3Å; D36-H42 IonicContact OD1-CD2 3.59Å; D36-H42 PolarHBondContact OD1-CD2 3.05Å; D36-H42 IonicContact OD1-CG 3.66Å; D36-H42 IonicContact OD1-NE2 3.83Å; D36-H42 PolarHBondContact OD1-NE2 3Å; D36-H42 IonicContact OD2-CD2 2.59Å; D36-H42 IonicContact OD2-CE1 3.05Å; D36-H42 IonicContact OD2-NE2 3.13Å; D36-H42 PolarHBondContact OD2-NE2 3.44Å; D36-Y58 VanDerWaalsContact OD1-O 3.08Å
37	R	86.1	Confident	84.5	Confident	197 Å²	197	67.9 Å²	67.9	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-33.6	172.9	-68.9	-173	-178.1	-142.1	1.6	112.1	G39 Y58	R37-G39 PolarHBondContact O-N 3.43Å; R37-Y58 HydrophobicContact CG-CD1 4.25Å; R37-Y58 HydrophobicContact CG-CD2 4.11Å; R37-Y58 HydrophobicContact CG-CG 3.82Å
38	N	87.9	Confident	86.7	Confident	156 Å²	156	72 Å²	72	83%	0.834	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-7	175.9	-66.5	75.7	0	0	0	113.5	D36 S40	D36-N38 PolarHBondContact O-N 3.34Å; N38-S40 VanDerWaalsContact C-N 3.31Å
39	G	83.6	Confident	87.8	Confident	32 Å²	32	78.1 Å²	78.1	33%	0.33	38%	0.383	S	S	.	.			trans	80.2	9.9	-176.4	0	0	0	0	0	114.3	D36 R37	D36-G39 WeakPolarHBondContact O-CA 3.28Å; D36-G39 PolarHBondContact O-N 3.37Å; R37-G39 PolarHBondContact O-N 3.43Å
40	S	89.8	Confident	88.4	Confident	59 Å²	59	83 Å²	83	41%	0.413	40%	0.404	S	S	.	.			trans	-66.7	138.9	168.8	178.9	0	0	0	0	109.7	L35 D36 N38 H42	L35-S40 CarbonylContact C-O 3.46Å; L35-S40 VanDerWaalsContact CA-O 3.3Å; L35-S40 WeakPolarHBondContact CA-O 3.46Å; D36-S40 PolarHBondContact N-O 3Å; N38-S40 VanDerWaalsContact C-N 3.31Å; S40-H42 PolarHBondContact O-CD2 2.79Å; S40-H42 PolarHBondContact OG-NE2 3.46Å; S40-H42 VanDerWaalsContact OG-NE2 3.08Å
41	W	89.4	Confident	88.9	Confident	150 Å²	150	80.7 Å²	80.7	57%	0.568	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.9	176.5	-179.7	86.8	0	0	0	110	W33 L35 P43	W33-W41 HydrophobicContact CB-CZ2 4.15Å; W33-W41 AromaticContact CD2-NE1 3.76Å; W33-W41 AromaticContact CE3-CD1 3.68Å; W33-W41 AromaticContact CE3-NE1 3.28Å; W33-W41 VanDerWaalsContact CE3-NE1 3.28Å; W33-W41 AromaticContact CZ3-CD1 4Å; W33-W41 AromaticContact CZ3-NE1 3.91Å; L35-W41 HydrophobicContact CD2-CB 3.93Å; W41-P43 HydrophobicContact CH2-CB 3.6Å; W41-P43 HydrophobicContact CZ2-CB 4.41Å; W41-P43 HydrophobicContact CZ3-CB 3.74Å; W41-P43 HydrophobicContact CZ3-CG 4.22Å
42	H	90.9	Very high	88.9	Confident	53 Å²	53	85.2 Å²	85.2	25%	0.245	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.9	178.8	-69	-97.1	0	0	0	108.7	W33 Y34 D36 S40	W33-H42 VanDerWaalsContact CA-O 3.24Å; W33-H42 WeakPolarHBondContact CA-O 3.3Å; W33-H42 VanDerWaalsContact CB-O 3.26Å; W33-H42 WeakPolarHBondContact CB-O 3.29Å; Y34-H42 HydrophobicContact CD1-CB 3.8Å; Y34-H42 HydrophobicContact CD2-CB 4.39Å; Y34-H42 HydrophobicContact CE1-CB 3.51Å; Y34-H42 HydrophobicContact CE2-CB 4.17Å; Y34-H42 HydrophobicContact CG-CB 4.23Å; Y34-H42 AromaticContact CZ-CG 3.89Å; Y34-H42 PolarHBondContact N-O 2.77Å; Y34-H42 PolarHBondContact O-N 3.19Å; D36-H42 IonicContact OD1-CD2 3.59Å; D36-H42 PolarHBondContact OD1-CD2 3.05Å; D36-H42 IonicContact OD1-CG 3.66Å; D36-H42 IonicContact OD1-NE2 3.83Å; D36-H42 PolarHBondContact OD1-NE2 3Å; D36-H42 IonicContact OD2-CD2 2.59Å; D36-H42 IonicContact OD2-CE1 3.05Å; D36-H42 IonicContact OD2-NE2 3.13Å; D36-H42 PolarHBondContact OD2-NE2 3.44Å; S40-H42 PolarHBondContact O-CD2 2.79Å; S40-H42 PolarHBondContact OG-NE2 3.46Å; S40-H42 VanDerWaalsContact OG-NE2 3.08Å
43	P	90.9	Very high	89	Confident	73 Å²	73	83.9 Å²	83.9	47%	0.474	41%	0.406	S	S	.	.			trans	-62.7	156.5	176.3	27.7	-34	0	0	0	110.6	W41	W41-P43 HydrophobicContact CH2-CB 3.6Å; W41-P43 HydrophobicContact CZ2-CB 4.41Å; W41-P43 HydrophobicContact CZ3-CB 3.74Å; W41-P43 HydrophobicContact CZ3-CG 4.22Å
44	G	91.1	Very high	89.2	Confident	15 Å²	15	79.2 Å²	79.2	16%	0.155	39%	0.388	C	S	.	.			trans	-70.1	159	169.2	0	0	0	0	0	111.1	E29 C31	E29-G44 WeakPolarHBondContact OE2-CA 3.08Å; C31-G44 CarbonylContact O-C 3.46Å; C31-G44 WeakPolarHBondContact O-CA 3.26Å
45	F	91.8	Very high	89.5	Confident	64 Å²	64	79.6 Å²	79.6	28%	0.281	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-149.7	152.7	-178.1	58.3	-91	0	0	0	111	C31 Y34 R60 C62	C31-F45 HydrophobicContact CB-CD1 4.13Å; C31-F45 HydrophobicContact CB-CD2 3.96Å; C31-F45 HydrophobicContact CB-CE1 3.83Å; C31-F45 HydrophobicContact CB-CE2 3.64Å; C31-F45 HydrophobicContact CB-CG 4.19Å; C31-F45 HydrophobicContact CB-CZ 3.58Å; C31-F45 WeakPolarHBondContact CB-O 3.43Å; C31-F45 PolarHBondContact N-O 3.45Å; C31-F45 PolarHBondContact O-N 3.09Å; C31-F45 WeakPolarHBondContact SG-CE2 3.14Å; C31-F45 WeakPolarHBondContact SG-CZ 3.44Å; Y34-F45 HydrophobicContact CE1-CE1 4.27Å; F45-R60 HydrophobicContact CE1-CB 4.34Å; F45-R60 HydrophobicContact CZ-CB 4.13Å; F45-R60 WeakPolarHBondContact CZ-O 3.19Å; F45-C62 VanDerWaalsContact CE2-SG 3.57Å
46	N	91.3	Very high	89.5	Confident	95 Å²	95	80.2 Å²	80.2	51%	0.508	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-90.6	146.3	174.8	-69	-53.1	0	0	0	110.6	E29 D30	E29-N46 VanDerWaalsContact CA-OD1 3.27Å; E29-N46 WeakPolarHBondContact CA-OD1 3.39Å; D30-N46 PolarHBondContact N-OD1 3.37Å
47	C	90	Very high	89.6	Confident	17 Å²	17	80.7 Å²	80.7	12%	0.115	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-94.4	152.4	175.3	-73.4	0	0	0	0	110.6	D30 T51 C62	D30-C47 HydrophobicContact CB-CB 4.08Å; D30-C47 PolarHBondContact OD2-N 2.86Å; C47-T51 WeakPolarHBondContact CB-OG1 3.45Å; C47-C62 WeakPolarHBondContact CA-SG 3.33Å; C47-C62 HydrophobicContact CB-CB 3.86Å; C47-C62 WeakPolarHBondContact CB-SG 3.36Å; C47-C62 VanDerWaalsContact SG-CA 3.55Å; C47-C62 WeakPolarHBondContact SG-CB 3.33Å; C47-C62 CovalentContact SG-SG 2.05Å; C47-C62 PolarHBondContact SG-SG 2.82Å
48	E	90.1	Very high	89.7	Confident	164 Å²	164	75.5 Å²	75.5	77%	0.766	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-73.9	164	179	-162.3	163.3	-154.7	0	0	110.7	F50 T51	E48-F50 PolarHBondContact O-N 2.9Å; E48-T51 PolarHBondContact N-OG1 3.39Å; E48-T51 PolarHBondContact O-N 2.85Å; E48-T51 PolarHBondContact O-OG1 2.92Å
49	F	83.4	Confident	89.9	Confident	185 Å²	185	73 Å²	73	81%	0.811	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	133.7	-179	-90.1	-88.8	0	0	0	112.6	T51	F49-T51 PolarHBondContact O-N 3.21Å
50	F	83.8	Confident	90.3	Very high	176 Å²	176	71.9 Å²	71.9	77%	0.772	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	15.2	-176.3	-64.8	-81.5	0	0	0	116.2	E48	E48-F50 PolarHBondContact O-N 2.9Å
51	T	90.8	Very high	90.5	Very high	26 Å²	26	73.1 Å²	73.1	16%	0.16	35%	0.353	C	S	.	.			trans	-112.2	151.8	169	63.6	0	0	0	0	110.4	C47 E48 F49 C63 R64	C47-T51 WeakPolarHBondContact CB-OG1 3.45Å; E48-T51 PolarHBondContact N-OG1 3.39Å; E48-T51 PolarHBondContact O-N 2.85Å; E48-T51 PolarHBondContact O-OG1 2.92Å; F49-T51 PolarHBondContact O-N 3.21Å; T51-C63 WeakPolarHBondContact CA-O 3.44Å; T51-R64 HydrophobicContact CG2-CG 3.8Å
52	F	91.5	Very high	90.7	Very high	94 Å²	94	68.3 Å²	68.3	41%	0.412	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	163	-177.8	-53.2	-81.3	0	0	0	110.7	C54 C62 C63 L66 L69	F52-C54 PolarHBondContact O-N 2.76Å; F52-C54 PolarHBondContact O-SG 3.48Å; F52-C62 WeakPolarHBondContact O-CA 3.48Å; F52-C63 PolarHBondContact N-O 2.82Å; F52-C63 PolarHBondContact O-N 3.4Å; F52-L66 HydrophobicContact CE2-CD2 4.38Å; F52-L69 HydrophobicContact CB-CD1 3.23Å; F52-L69 HydrophobicContact CD1-CD1 4.1Å; F52-L69 HydrophobicContact CD2-CD1 4.21Å; F52-L69 HydrophobicContact CG-CD1 3.61Å
53	C	93.1	Very high	90.8	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.034	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.5	173.4	-163.2	0	0	0	0	111.4	D30 C31 I70 Q75	D30-C53 WeakPolarHBondContact O-CB 3.34Å; C31-C53 WeakPolarHBondContact CA-SG 3.32Å; C31-C53 HydrophobicContact CB-CB 4.07Å; C31-C53 WeakPolarHBondContact CB-SG 3.27Å; C31-C53 WeakPolarHBondContact SG-CA 3.39Å; C31-C53 WeakPolarHBondContact SG-CB 3.2Å; C31-C53 CovalentContact SG-SG 2.03Å; C31-C53 PolarHBondContact SG-SG 3.43Å; C53-I70 PolarHBondContact O-N 3.43Å; C53-Q75 PolarHBondContact SG-NE2 2.85Å; C53-Q75 VanDerWaalsContact SG-NE2 3.41Å
54	C	93.3	Very high	90.9	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	164.4	-176.7	-54.2	0	0	0	0	112.4	F52 R60 Y61 C63 L68	F52-C54 PolarHBondContact O-N 2.76Å; F52-C54 PolarHBondContact O-SG 3.48Å; C54-R60 WeakPolarHBondContact O-CA 3.4Å; C54-Y61 WeakPolarHBondContact CA-O 3.47Å; C54-Y61 HydrophobicContact CB-CD2 4.39Å; C54-Y61 HydrophobicContact CB-CE2 4.04Å; C54-Y61 PolarHBondContact N-O 3.18Å; C54-Y61 PolarHBondContact O-N 3.39Å; C54-C63 HydrophobicContact CB-CB 3.68Å; C54-C63 WeakPolarHBondContact CB-SG 3.24Å; C54-C63 WeakPolarHBondContact SG-CB 3.46Å; C54-C63 CovalentContact SG-SG 2.02Å; C54-C63 PolarHBondContact SG-SG 3.45Å; C54-L68 WeakPolarHBondContact CA-O 3.28Å; C54-L68 HydrophobicContact CB-CB 4.1Å; C54-L68 VanDerWaalsContact CB-O 3.32Å; C54-L68 WeakPolarHBondContact CB-O 3.37Å
55	G	92.9	Very high	90.9	Very high	21 Å²	21	75.6 Å²	75.6	22%	0.216	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.7	-123.5	168.9	0	0	0	0	0	113.5	L68 I70	G55-L68 PolarHBondContact N-O 3.02Å; G55-L68 VanDerWaalsContact N-O 3.1Å; G55-I70 VanDerWaalsContact O-CD1 3.24Å; G55-I70 WeakPolarHBondContact O-CD1 3.24Å
56	T	90.3	Very high	90.7	Very high	70 Å²	70	78.3 Å²	78.3	43%	0.429	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	173.8	-179.3	69.5	0	0	0	0	111.8	Y58 H59 R60	T56-Y58 PolarHBondContact O-N 3.19Å; T56-Y58 VanDerWaalsContact O-N 3.11Å; T56-Y58 PolarHBondContact OG1-N 3.16Å; T56-H59 PolarHBondContact N-O 3.49Å; T56-H59 CarbonylContact O-C 3.56Å; T56-H59 PolarHBondContact O-N 2.79Å; T56-H59 PolarHBondContact OG1-N 3.4Å; T56-R60 WeakPolarHBondContact O-CG 3.25Å
57	C	88.9	Confident	90.7	Very high	42 Å²	42	80 Å²	80	28%	0.284	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.2	173.6	-62.4	0	0	0	0	113.9	C78	C57-C78 VanDerWaalsContact CA-SG 3.58Å; C57-C78 HydrophobicContact CB-CB 3.5Å; C57-C78 VanDerWaalsContact CB-CB 3.5Å; C57-C78 WeakPolarHBondContact CB-SG 3.49Å; C57-C78 WeakPolarHBondContact SG-CB 2.98Å; C57-C78 CovalentContact SG-SG 2.03Å; C57-C78 PolarHBondContact SG-SG 3.49Å
58	Y	88.9	Confident	90.8	Very high	89 Å²	89	83 Å²	83	35%	0.349	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	4.8	-171.9	-48.6	-73	0	0	0	113.4	Y34 L35 D36 R37 T56	Y34-Y58 VanDerWaalsContact CE2-C 3.45Å; Y34-Y58 WeakPolarHBondContact CE2-O 3.3Å; L35-Y58 WeakPolarHBondContact O-CD1 3.25Å; D36-Y58 VanDerWaalsContact OD1-O 3.08Å; R37-Y58 HydrophobicContact CG-CD1 4.25Å; R37-Y58 HydrophobicContact CG-CD2 4.11Å; R37-Y58 HydrophobicContact CG-CG 3.82Å; T56-Y58 PolarHBondContact O-N 3.19Å; T56-Y58 VanDerWaalsContact O-N 3.11Å; T56-Y58 PolarHBondContact OG1-N 3.16Å
59	H	91.8	Very high	90.8	Very high	104 Å²	104	78.3 Å²	78.3	48%	0.481	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	106.7	177.5	-174	-89.2	0	0	0	108.5	T56 Y61	T56-H59 PolarHBondContact N-O 3.49Å; T56-H59 CarbonylContact O-C 3.56Å; T56-H59 PolarHBondContact O-N 2.79Å; T56-H59 PolarHBondContact OG1-N 3.4Å; H59-Y61 AromaticContact CE1-CD1 3.9Å; H59-Y61 AromaticContact ND1-CD1 3.69Å
60	R	92.9	Very high	91.2	Very high	7 Å²	7	70.6 Å²	70.6	3%	0.026	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.4	-175.7	-59.9	-178.4	-177	166.2	2.8	110	L32 W33 Y34 F45 C54 T56 Q75	L32-R60 VanDerWaalsContact C-NH1 3.3Å; L32-R60 PolarHBondContact O-NH1 2.86Å; W33-R60 PolarHBondContact O-NH1 3.25Å; Y34-R60 HydrophobicContact CD1-CB 4.12Å; Y34-R60 HydrophobicContact CD1-CG 3.93Å; Y34-R60 HydrophobicContact CE1-CB 3.75Å; Y34-R60 HydrophobicContact CE1-CG 4.05Å; Y34-R60 HydrophobicContact CG-CG 4.18Å; Y34-R60 PolarHBondContact OH-N 3.23Å; Y34-R60 PolarHBondContact OH-O 2.96Å; F45-R60 HydrophobicContact CE1-CB 4.34Å; F45-R60 HydrophobicContact CZ-CB 4.13Å; F45-R60 WeakPolarHBondContact CZ-O 3.19Å; C54-R60 WeakPolarHBondContact O-CA 3.4Å; T56-R60 WeakPolarHBondContact O-CG 3.25Å; R60-Q75 PolarHBondContact NH2-O 2.82Å
61	Y	92.8	Very high	91.5	Very high	85 Å²	85	65.4 Å²	65.4	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	160	177.9	60	-84.6	0	0	0	110.5	C54 H59 C63 L68	C54-Y61 WeakPolarHBondContact CA-O 3.47Å; C54-Y61 HydrophobicContact CB-CD2 4.39Å; C54-Y61 HydrophobicContact CB-CE2 4.04Å; C54-Y61 PolarHBondContact N-O 3.18Å; C54-Y61 PolarHBondContact O-N 3.39Å; H59-Y61 AromaticContact CE1-CD1 3.9Å; H59-Y61 AromaticContact ND1-CD1 3.69Å; Y61-C63 HydrophobicContact CD2-CB 4.08Å; Y61-C63 HydrophobicContact CE2-CB 3.75Å; Y61-L68 WeakPolarHBondContact OH-CD1 3.3Å
62	C	93.4	Very high	91.3	Very high	50 Å²	50	68.7 Å²	68.7	34%	0.338	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	130.5	175.8	-59.7	0	0	0	0	110.8	F45 C47 F52	F45-C62 VanDerWaalsContact CE2-SG 3.57Å; C47-C62 WeakPolarHBondContact CA-SG 3.33Å; C47-C62 HydrophobicContact CB-CB 3.86Å; C47-C62 WeakPolarHBondContact CB-SG 3.36Å; C47-C62 VanDerWaalsContact SG-CA 3.55Å; C47-C62 WeakPolarHBondContact SG-CB 3.33Å; C47-C62 CovalentContact SG-SG 2.05Å; C47-C62 PolarHBondContact SG-SG 2.82Å; F52-C62 WeakPolarHBondContact O-CA 3.48Å
63	C	93.3	Very high	91.1	Very high	14 Å²	14	74.4 Å²	74.4	10%	0.095	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	165	176.3	92.3	0	0	0	0	111.9	T51 F52 C54 Y61 D65	T51-C63 WeakPolarHBondContact CA-O 3.44Å; F52-C63 PolarHBondContact N-O 2.82Å; F52-C63 PolarHBondContact O-N 3.4Å; C54-C63 HydrophobicContact CB-CB 3.68Å; C54-C63 WeakPolarHBondContact CB-SG 3.24Å; C54-C63 WeakPolarHBondContact SG-CB 3.46Å; C54-C63 CovalentContact SG-SG 2.02Å; C54-C63 PolarHBondContact SG-SG 3.45Å; Y61-C63 HydrophobicContact CD2-CB 4.08Å; Y61-C63 HydrophobicContact CE2-CB 3.75Å; C63-D65 PolarHBondContact SG-N 2.76Å; C63-D65 VanDerWaalsContact SG-N 3.45Å; C63-D65 PolarHBondContact SG-O 3.44Å
64	R	92.7	Very high	90.8	Very high	179 Å²	179	79.7 Å²	79.7	68%	0.675	39%	0.394	S	S	*	.	S	Bend	trans	-96.8	-12.8	173.7	-65.2	-173.2	177.5	178.9	-0.5	112.9	T51 L66	T51-R64 HydrophobicContact CG2-CG 3.8Å; R64-L66 PolarHBondContact O-N 2.76Å
65	D	92.1	Very high	90.6	Very high	100 Å²	100	79.8 Å²	79.8	54%	0.535	40%	0.395	S	S	.	.			trans	-79.5	108.9	-175.8	-64.2	-42	0	0	0	111.3	C63 T67 L68	C63-D65 PolarHBondContact SG-N 2.76Å; C63-D65 VanDerWaalsContact SG-N 3.45Å; C63-D65 PolarHBondContact SG-O 3.44Å; D65-T67 PolarHBondContact O-N 3.07Å; D65-T67 VanDerWaalsContact O-N 3.12Å; D65-L68 PolarHBondContact O-N 2.93Å; D65-L68 VanDerWaalsContact O-N 3.15Å
66	L	88.1	Confident	90.3	Very high	122 Å²	122	84.1 Å²	84.1	64%	0.639	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-63	-18.1	178.7	-72.4	135.2	0	0	0	113.5	F52 R64 L68 L69	F52-L66 HydrophobicContact CE2-CD2 4.38Å; R64-L66 PolarHBondContact O-N 2.76Å; L66-L68 VanDerWaalsContact C-N 3.28Å; L66-L68 PolarHBondContact O-N 3.39Å; L66-L69 VanDerWaalsContact O-CB 3.23Å; L66-L69 WeakPolarHBondContact O-CB 3.42Å; L66-L69 PolarHBondContact O-N 2.92Å
67	T	90.5	Very high	90.1	Very high	130 Å²	130	86 Å²	86	80%	0.798	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-70.6	-25	177.5	54.6	0	0	0	0	112.9	D65	D65-T67 PolarHBondContact O-N 3.07Å; D65-T67 VanDerWaalsContact O-N 3.12Å
68	L	91.9	Very high	89.8	Confident	79 Å²	79	85.2 Å²	85.2	41%	0.414	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-104.3	6.8	-179.8	-61.3	174.1	0	0	0	112.2	C54 G55 Y61 D65 L66 I70	C54-L68 WeakPolarHBondContact CA-O 3.28Å; C54-L68 HydrophobicContact CB-CB 4.1Å; C54-L68 VanDerWaalsContact CB-O 3.32Å; C54-L68 WeakPolarHBondContact CB-O 3.37Å; G55-L68 PolarHBondContact N-O 3.02Å; G55-L68 VanDerWaalsContact N-O 3.1Å; Y61-L68 WeakPolarHBondContact OH-CD1 3.3Å; D65-L68 PolarHBondContact O-N 2.93Å; D65-L68 VanDerWaalsContact O-N 3.15Å; L66-L68 VanDerWaalsContact C-N 3.28Å; L66-L68 PolarHBondContact O-N 3.39Å; L68-I70 PolarHBondContact O-N 3.31Å
69	L	91.5	Very high	89.3	Confident	67 Å²	67	82.8 Å²	82.8	35%	0.351	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-61.6	128.6	-177.8	-175.7	89.7	0	0	0	111.6	F52 L66 T71	F52-L69 HydrophobicContact CB-CD1 3.23Å; F52-L69 HydrophobicContact CD1-CD1 4.1Å; F52-L69 HydrophobicContact CD2-CD1 4.21Å; F52-L69 HydrophobicContact CG-CD1 3.61Å; L66-L69 VanDerWaalsContact O-CB 3.23Å; L66-L69 WeakPolarHBondContact O-CB 3.42Å; L66-L69 PolarHBondContact O-N 2.92Å; L69-T71 HydrophobicContact CD2-CG2 4.07Å
70	I	91.1	Very high	88.4	Confident	22 Å²	22	80.4 Å²	80.4	11%	0.113	40%	0.397	C	S	.	.			trans	-109.8	110.8	166	-58.5	-177.6	0	0	0	109.4	C53 G55 L68 Q74 Q75	C53-I70 PolarHBondContact O-N 3.43Å; G55-I70 VanDerWaalsContact O-CD1 3.24Å; G55-I70 WeakPolarHBondContact O-CD1 3.24Å; L68-I70 PolarHBondContact O-N 3.31Å; I70-Q74 HydrophobicContact CG2-CB 3.76Å; I70-Q75 HydrophobicContact CB-CG 4.34Å; I70-Q75 HydrophobicContact CG2-CB 4.49Å; I70-Q75 HydrophobicContact CG2-CG 3.46Å; I70-Q75 VanDerWaalsContact CG2-CG 3.46Å; I70-Q75 PolarHBondContact O-NE2 3.35Å; I70-Q75 VanDerWaalsContact O-NE2 3.09Å
71	T	89.8	Confident	87.2	Confident	68 Å²	68	86.1 Å²	86.1	42%	0.417	42%	0.423	S	S	.	.			trans	-64.4	150.1	173.4	67.1	0	0	0	0	111.8	L69 R73 Q74 Q75	L69-T71 HydrophobicContact CD2-CG2 4.07Å; T71-R73 PolarHBondContact O-N 2.96Å; T71-R73 VanDerWaalsContact O-N 3.1Å; T71-Q74 WeakPolarHBondContact O-CA 3.35Å; T71-Q74 WeakPolarHBondContact O-CB 3.26Å; T71-Q74 PolarHBondContact O-N 2.86Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.37Å; T71-Q74 PolarHBondContact OG1-N 2.73Å; T71-Q75 WeakPolarHBondContact O-CG 3.39Å; T71-Q75 PolarHBondContact O-N 2.71Å
72	E	87.3	Confident	86.1	Confident	94 Å²	94	82.9 Å²	82.9	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-51.9	-36.6	176.6	-167.4	-164.8	121	0	0	112.9	L32 Q74 Q75 K76	L32-E72 HydrophobicContact CD1-CG 4.14Å; E72-Q74 VanDerWaalsContact C-N 3.35Å; E72-Q74 PolarHBondContact O-N 3.13Å; E72-Q75 WeakPolarHBondContact O-CB 3.25Å; E72-Q75 PolarHBondContact O-N 3.34Å; E72-K76 WeakPolarHBondContact O-CG 3.36Å; E72-K76 PolarHBondContact O-N 3.46Å; E72-K76 WeakPolarHBondContact OE1-CE 3.03Å; E72-K76 IonicContact OE1-NZ 3.44Å; E72-K76 PolarHBondContact OE1-NZ 2.97Å
73	R	85.8	Confident	85.1	Confident	215 Å²	215	84.8 Å²	84.8	81%	0.811	42%	0.424	S	S	*	.	H	α-helix	trans	-60.9	-43.2	175.5	-68.7	-175.2	-176	136.1	1.5	112.1	T71 K76 H77	T71-R73 PolarHBondContact O-N 2.96Å; T71-R73 VanDerWaalsContact O-N 3.1Å; R73-K76 PolarHBondContact O-N 2.85Å; R73-H77 PolarHBondContact O-N 3.41Å; R73-H77 VanDerWaalsContact O-N 3.11Å
74	Q	87.8	Confident	84.1	Confident	115 Å²	115	90.6 Å²	90.6	54%	0.537	45%	0.448	S	S	.	.	H	α-helix	trans	-68	-39.5	176.4	-67.3	-66.2	-28.8	0	0	111	I70 T71 E72 K76 H77 C78	I70-Q74 HydrophobicContact CG2-CB 3.76Å; T71-Q74 WeakPolarHBondContact O-CA 3.35Å; T71-Q74 WeakPolarHBondContact O-CB 3.26Å; T71-Q74 PolarHBondContact O-N 2.86Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.37Å; T71-Q74 PolarHBondContact OG1-N 2.73Å; E72-Q74 VanDerWaalsContact C-N 3.35Å; E72-Q74 PolarHBondContact O-N 3.13Å; Q74-K76 VanDerWaalsContact C-N 3.33Å; Q74-K76 PolarHBondContact O-N 2.78Å; Q74-H77 WeakPolarHBondContact O-CB 3.43Å; Q74-H77 PolarHBondContact O-N 3.4Å; Q74-H77 VanDerWaalsContact O-N 3.12Å; Q74-C78 PolarHBondContact O-N 3.2Å; Q74-C78 PolarHBondContact O-SG 2.92Å
75	Q	88.7	Confident	83.4	Confident	2 Å²	2	84.6 Å²	84.6	1%	0.009	43%	0.431	C	S	.	.	H	α-helix	trans	-59.5	-42.1	175.9	-61.9	178.9	33.5	0	0	112.2	D30 L32 C53 R60 I70 T71 E72 C78 L79	D30-Q75 PolarHBondContact O-NE2 2.82Å; L32-Q75 HydrophobicContact CD1-CB 4Å; C53-Q75 PolarHBondContact SG-NE2 2.85Å; C53-Q75 VanDerWaalsContact SG-NE2 3.41Å; R60-Q75 PolarHBondContact NH2-O 2.82Å; I70-Q75 HydrophobicContact CB-CG 4.34Å; I70-Q75 HydrophobicContact CG2-CB 4.49Å; I70-Q75 HydrophobicContact CG2-CG 3.46Å; I70-Q75 VanDerWaalsContact CG2-CG 3.46Å; I70-Q75 PolarHBondContact O-NE2 3.35Å; I70-Q75 VanDerWaalsContact O-NE2 3.09Å; T71-Q75 WeakPolarHBondContact O-CG 3.39Å; T71-Q75 PolarHBondContact O-N 2.71Å; E72-Q75 WeakPolarHBondContact O-CB 3.25Å; E72-Q75 PolarHBondContact O-N 3.34Å; Q75-C78 WeakPolarHBondContact O-CB 3.09Å; Q75-C78 PolarHBondContact O-N 2.84Å; Q75-L79 PolarHBondContact O-N 3.3Å
76	K	86	Confident	82.8	Confident	112 Å²	112	83.6 Å²	83.6	49%	0.487	43%	0.425	S	S	.	.	H	α-helix	trans	-66.4	-36.9	174.8	-69.4	177.5	-174.4	171.6	0	112.3	L32 E72 R73 Q74 L79 A80	L32-K76 HydrophobicContact CD1-CG 3.74Å; E72-K76 WeakPolarHBondContact O-CG 3.36Å; E72-K76 PolarHBondContact O-N 3.46Å; E72-K76 WeakPolarHBondContact OE1-CE 3.03Å; E72-K76 IonicContact OE1-NZ 3.44Å; E72-K76 PolarHBondContact OE1-NZ 2.97Å; R73-K76 PolarHBondContact O-N 2.85Å; Q74-K76 VanDerWaalsContact C-N 3.33Å; Q74-K76 PolarHBondContact O-N 2.78Å; K76-L79 PolarHBondContact O-N 3.12Å; K76-A80 PolarHBondContact O-N 2.95Å
77	H	86	Confident	82.4	Confident	110 Å²	110	80.6 Å²	80.6	51%	0.509	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-42.1	176.8	-130.6	64.9	0	0	0	111.8	R73 Q74 L79 A80 F81	R73-H77 PolarHBondContact O-N 3.41Å; R73-H77 VanDerWaalsContact O-N 3.11Å; Q74-H77 WeakPolarHBondContact O-CB 3.43Å; Q74-H77 PolarHBondContact O-N 3.4Å; Q74-H77 VanDerWaalsContact O-N 3.12Å; H77-L79 PolarHBondContact O-N 3.37Å; H77-A80 PolarHBondContact O-N 3.4Å; H77-F81 AromaticContact CD2-CD2 3.64Å; H77-F81 AromaticContact CD2-CE2 3.56Å; H77-F81 AromaticContact CE1-CE2 3.58Å; H77-F81 AromaticContact NE2-CD2 3.86Å; H77-F81 AromaticContact NE2-CE2 3.25Å; H77-F81 WeakPolarHBondContact NE2-CE2 3.47Å; H77-F81 WeakPolarHBondContact O-CD2 3.34Å; H77-F81 PolarHBondContact O-N 2.95Å
78	C	84.2	Confident	82.1	Confident	26 Å²	26	76.2 Å²	76.2	18%	0.176	40%	0.399	C	S	.	.	H	α-helix	trans	-54.5	-38.1	173.9	-66.3	0	0	0	0	113	C57 Q74 Q75 S82	C57-C78 VanDerWaalsContact CA-SG 3.58Å; C57-C78 HydrophobicContact CB-CB 3.5Å; C57-C78 VanDerWaalsContact CB-CB 3.5Å; C57-C78 WeakPolarHBondContact CB-SG 3.49Å; C57-C78 WeakPolarHBondContact SG-CB 2.98Å; C57-C78 CovalentContact SG-SG 2.03Å; C57-C78 PolarHBondContact SG-SG 3.49Å; Q74-C78 PolarHBondContact O-N 3.2Å; Q74-C78 PolarHBondContact O-SG 2.92Å; Q75-C78 WeakPolarHBondContact O-CB 3.09Å; Q75-C78 PolarHBondContact O-N 2.84Å; C78-S82 PolarHBondContact O-N 3.49Å
79	L	77.6	Confident	81.9	Confident	37 Å²	37	77.5 Å²	77.5	19%	0.194	41%	0.405	C	S	.	.	H	α-helix	trans	-74.2	-43.6	-179.7	-67.7	163	0	0	0	111.5	W33 Q75 K76 H77 F81 S82 T85	W33-L79 HydrophobicContact CD2-CD2 4.26Å; W33-L79 HydrophobicContact CE3-CD2 3.96Å; W33-L79 HydrophobicContact CH2-CD2 3.56Å; W33-L79 HydrophobicContact CZ2-CD1 4.42Å; W33-L79 HydrophobicContact CZ2-CD2 3.86Å; W33-L79 HydrophobicContact CZ3-CD2 3.61Å; Q75-L79 PolarHBondContact O-N 3.3Å; K76-L79 PolarHBondContact O-N 3.12Å; H77-L79 PolarHBondContact O-N 3.37Å; L79-F81 VanDerWaalsContact C-N 3.29Å; L79-F81 PolarHBondContact O-N 3.39Å; L79-S82 PolarHBondContact O-N 3.01Å; L79-T85 PolarHBondContact O-OG1 3.48Å
80	A	72.9	Confident	81.7	Confident	54 Å²	54	76.3 Å²	76.3	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-62.5	-36.6	178.4	0	0	0	0	0	112.3	K76 H77	K76-A80 PolarHBondContact O-N 2.95Å; H77-A80 PolarHBondContact O-N 3.4Å
81	F	67	Low	81.6	Confident	127 Å²	127	78.2 Å²	78.2	56%	0.557	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	14.9	-177.2	-72.2	-81.7	0	0	0	114.5	H77 L79 I86	H77-F81 AromaticContact CD2-CD2 3.64Å; H77-F81 AromaticContact CD2-CE2 3.56Å; H77-F81 AromaticContact CE1-CE2 3.58Å; H77-F81 AromaticContact NE2-CD2 3.86Å; H77-F81 AromaticContact NE2-CE2 3.25Å; H77-F81 WeakPolarHBondContact NE2-CE2 3.47Å; H77-F81 WeakPolarHBondContact O-CD2 3.34Å; H77-F81 PolarHBondContact O-N 2.95Å; L79-F81 VanDerWaalsContact C-N 3.29Å; L79-F81 PolarHBondContact O-N 3.39Å; F81-I86 HydrophobicContact CB-CD1 4.36Å; F81-I86 HydrophobicContact CD1-CD1 4.22Å; F81-I86 VanDerWaalsContact O-CD1 3.3Å; F81-I86 WeakPolarHBondContact O-CD1 2.91Å
82	S	70.4	Confident	81.7	Confident	18 Å²	18	77.7 Å²	77.7	13%	0.126	42%	0.423	C	S	.	.			trans	-63.3	134.6	175.6	95.8	0	0	0	0	109.1	C78 L79 K84 T85 I86	C78-S82 PolarHBondContact O-N 3.49Å; L79-S82 PolarHBondContact O-N 3.01Å; S82-K84 PolarHBondContact O-N 3.48Å; S82-T85 WeakPolarHBondContact CB-OG1 3.43Å; S82-T85 PolarHBondContact N-OG1 3.37Å; S82-T85 PolarHBondContact O-N 2.99Å; S82-T85 PolarHBondContact O-OG1 3.27Å; S82-T85 WeakPolarHBondContact OG-CB 3.42Å; S82-T85 WeakPolarHBondContact OG-CG2 3.46Å; S82-T85 PolarHBondContact OG-N 3.26Å; S82-T85 PolarHBondContact OG-OG1 2.95Å; S82-I86 WeakPolarHBondContact O-CG1 3.49Å; S82-I86 PolarHBondContact O-N 2.94Å
83	P	71.6	Confident	82.1	Confident	90 Å²	90	77.1 Å²	77.1	58%	0.584	43%	0.425	S	S	*	.	H	α-helix	trans	-54.6	-30.3	-178.6	-25.8	32.1	0	0	0	112.7	A87	P83-A87 VanDerWaalsContact O-CB 3.28Å; P83-A87 WeakPolarHBondContact O-CB 3.39Å; P83-A87 PolarHBondContact O-N 2.96Å
84	K	73.2	Confident	82.6	Confident	135 Å²	135	72.4 Å²	72.4	59%	0.587	42%	0.415	S	S	*	.	H	α-helix	trans	-73.8	-43	177.7	-61.9	-171.4	175.7	81.8	0	112.4	S82 A87 G88	S82-K84 PolarHBondContact O-N 3.48Å; K84-A87 PolarHBondContact O-N 3.44Å; K84-G88 PolarHBondContact O-N 3.41Å
85	T	77.3	Confident	82.9	Confident	53 Å²	53	72.4 Å²	72.4	33%	0.325	42%	0.418	S	S	.	.	H	α-helix	trans	-68.7	-40.2	175.5	43.6	0	0	0	0	111.2	L79 S82 A87 G88 I89	L79-T85 PolarHBondContact O-OG1 3.48Å; S82-T85 WeakPolarHBondContact CB-OG1 3.43Å; S82-T85 PolarHBondContact N-OG1 3.37Å; S82-T85 PolarHBondContact O-N 2.99Å; S82-T85 PolarHBondContact O-OG1 3.27Å; S82-T85 WeakPolarHBondContact OG-CB 3.42Å; S82-T85 WeakPolarHBondContact OG-CG2 3.46Å; S82-T85 PolarHBondContact OG-N 3.26Å; S82-T85 PolarHBondContact OG-OG1 2.95Å; T85-A87 PolarHBondContact O-N 2.9Å; T85-G88 PolarHBondContact O-N 3.49Å; T85-I89 VanDerWaalsContact O-CG1 3.26Å; T85-I89 WeakPolarHBondContact O-CG1 3.34Å; T85-I89 PolarHBondContact O-N 3.45Å
86	I	79.3	Confident	83.3	Confident	80 Å²	80	79 Å²	79	41%	0.41	45%	0.447	S	S	.	.	H	α-helix	trans	-59.4	-47.6	173.6	-63.4	168.9	0	0	0	110.4	F81 S82 G88 I89 A90	F81-I86 HydrophobicContact CB-CD1 4.36Å; F81-I86 HydrophobicContact CD1-CD1 4.22Å; F81-I86 VanDerWaalsContact O-CD1 3.3Å; F81-I86 WeakPolarHBondContact O-CD1 2.91Å; S82-I86 WeakPolarHBondContact O-CG1 3.49Å; S82-I86 PolarHBondContact O-N 2.94Å; I86-G88 VanDerWaalsContact C-N 3.33Å; I86-G88 PolarHBondContact O-N 3.29Å; I86-I89 PolarHBondContact O-N 2.98Å; I86-A90 VanDerWaalsContact O-CB 3.25Å; I86-A90 WeakPolarHBondContact O-CB 3.48Å; I86-A90 PolarHBondContact O-N 2.92Å
87	A	79.9	Confident	83.8	Confident	58 Å²	58	77.7 Å²	77.7	48%	0.479	45%	0.448	S	S	.	.	H	α-helix	trans	-62	-39.3	177.6	0	0	0	0	0	112.6	P83 K84 T85 S91	P83-A87 VanDerWaalsContact O-CB 3.28Å; P83-A87 WeakPolarHBondContact O-CB 3.39Å; P83-A87 PolarHBondContact O-N 2.96Å; K84-A87 PolarHBondContact O-N 3.44Å; T85-A87 PolarHBondContact O-N 2.9Å; A87-S91 WeakPolarHBondContact O-CB 3.24Å; A87-S91 PolarHBondContact O-N 3.49Å; A87-S91 PolarHBondContact O-OG 2.86Å
88	G	85.7	Confident	84.3	Confident	39 Å²	39	74.7 Å²	74.7	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-41.5	176.2	0	0	0	0	0	113.5	K84 T85 I86 S91 A92	K84-G88 PolarHBondContact O-N 3.41Å; T85-G88 PolarHBondContact O-N 3.49Å; I86-G88 VanDerWaalsContact C-N 3.33Å; I86-G88 PolarHBondContact O-N 3.29Å; G88-S91 PolarHBondContact O-OG 2.97Å; G88-A92 PolarHBondContact O-N 3.17Å; G88-A92 VanDerWaalsContact O-N 3.14Å
89	I	87.2	Confident	84.9	Confident	105 Å²	105	77.7 Å²	77.7	54%	0.538	46%	0.46	S	S	.	.	H	α-helix	trans	-68.2	-46.5	176.4	-64.9	162.8	0	0	0	109.8	T85 I86 S91 A92 V93	T85-I89 VanDerWaalsContact O-CG1 3.26Å; T85-I89 WeakPolarHBondContact O-CG1 3.34Å; T85-I89 PolarHBondContact O-N 3.45Å; I86-I89 PolarHBondContact O-N 2.98Å; I89-S91 VanDerWaalsContact C-N 3.32Å; I89-S91 PolarHBondContact O-N 2.89Å; I89-A92 PolarHBondContact O-N 2.99Å; I89-V93 HydrophobicContact CG2-CG2 4.36Å; I89-V93 WeakPolarHBondContact O-CG2 3.3Å; I89-V93 PolarHBondContact O-N 3.01Å
90	A	86.3	Confident	85.8	Confident	43 Å²	43	78.4 Å²	78.4	36%	0.355	47%	0.466	S	S	.	.	H	α-helix	trans	-58.9	-43.7	178.8	0	0	0	0	0	111.6	I86 V93 I94	I86-A90 VanDerWaalsContact O-CB 3.25Å; I86-A90 WeakPolarHBondContact O-CB 3.48Å; I86-A90 PolarHBondContact O-N 2.92Å; A90-V93 PolarHBondContact O-N 3.23Å; A90-I94 WeakPolarHBondContact O-CB 3.47Å; A90-I94 WeakPolarHBondContact O-CD1 3.23Å; A90-I94 WeakPolarHBondContact O-CG1 3.44Å; A90-I94 PolarHBondContact O-N 3.35Å
91	S	90.4	Very high	86.9	Confident	61 Å²	61	78 Å²	78	43%	0.427	46%	0.463	S	S	.	.	H	α-helix	trans	-64.4	-42.2	177.9	67.9	0	0	0	0	112.3	A87 G88 I89 V93 I94 L95	A87-S91 WeakPolarHBondContact O-CB 3.24Å; A87-S91 PolarHBondContact O-N 3.49Å; A87-S91 PolarHBondContact O-OG 2.86Å; G88-S91 PolarHBondContact O-OG 2.97Å; I89-S91 VanDerWaalsContact C-N 3.32Å; I89-S91 PolarHBondContact O-N 2.89Å; S91-V93 PolarHBondContact O-N 2.92Å; S91-I94 PolarHBondContact O-N 2.89Å; S91-L95 WeakPolarHBondContact O-CB 3.38Å; S91-L95 VanDerWaalsContact O-CG 3.3Å; S91-L95 WeakPolarHBondContact O-CG 3.46Å; S91-L95 PolarHBondContact O-N 3Å
92	A	92	Very high	88.1	Confident	58 Å²	58	75.7 Å²	75.7	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-62	-43.1	175.9	0	0	0	0	0	112.3	G88 I89 L95 F96	G88-A92 PolarHBondContact O-N 3.17Å; G88-A92 VanDerWaalsContact O-N 3.14Å; I89-A92 PolarHBondContact O-N 2.99Å; A92-L95 PolarHBondContact O-N 3.43Å; A92-F96 WeakPolarHBondContact O-CB 3.32Å; A92-F96 PolarHBondContact O-N 3.35Å
93	V	95.6	Very high	89.2	Confident	81 Å²	81	77.7 Å²	77.7	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-65.2	-45.1	177.7	176.2	0	0	0	0	111.1	I89 A90 S91 L95 F96 V97	I89-V93 HydrophobicContact CG2-CG2 4.36Å; I89-V93 WeakPolarHBondContact O-CG2 3.3Å; I89-V93 PolarHBondContact O-N 3.01Å; A90-V93 PolarHBondContact O-N 3.23Å; S91-V93 PolarHBondContact O-N 2.92Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 3.26Å; V93-F96 PolarHBondContact O-N 3.11Å; V93-V97 HydrophobicContact CG1-CG2 4.35Å; V93-V97 WeakPolarHBondContact O-CG2 3.15Å; V93-V97 PolarHBondContact O-N 3.25Å
94	I	95.1	Very high	90.3	Very high	116 Å²	116	77.5 Å²	77.5	60%	0.595	46%	0.464	S	S	*	.	H	α-helix	trans	-60.2	-45.5	178.8	-69.1	163.6	0	0	0	110.7	A90 S91 V97 A98	A90-I94 WeakPolarHBondContact O-CB 3.47Å; A90-I94 WeakPolarHBondContact O-CD1 3.23Å; A90-I94 WeakPolarHBondContact O-CG1 3.44Å; A90-I94 PolarHBondContact O-N 3.35Å; S91-I94 PolarHBondContact O-N 2.89Å; I94-V97 PolarHBondContact O-N 3.14Å; I94-A98 WeakPolarHBondContact O-CB 3.24Å; I94-A98 PolarHBondContact O-N 3.28Å
95	L	95.6	Very high	91.2	Very high	115 Å²	115	74.5 Å²	74.5	60%	0.602	46%	0.458	S	S	*	.	H	α-helix	trans	-63.1	-42.9	177.8	-71.5	174.2	0	0	0	111.9	S91 A92 V93 A98 V99	S91-L95 WeakPolarHBondContact O-CB 3.38Å; S91-L95 VanDerWaalsContact O-CG 3.3Å; S91-L95 WeakPolarHBondContact O-CG 3.46Å; S91-L95 PolarHBondContact O-N 3Å; A92-L95 PolarHBondContact O-N 3.43Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 3.26Å; L95-A98 PolarHBondContact O-N 3.43Å; L95-V99 WeakPolarHBondContact O-CG2 3.4Å; L95-V99 PolarHBondContact O-N 3.16Å
96	F	96.1	Very high	91.9	Very high	142 Å²	142	75.6 Å²	75.6	62%	0.623	47%	0.467	S	S	*	.	H	α-helix	trans	-60.7	-47.7	176.9	179	-102.9	0	0	0	111.8	A92 V93 A98 V99 V100	A92-F96 WeakPolarHBondContact O-CB 3.32Å; A92-F96 PolarHBondContact O-N 3.35Å; V93-F96 PolarHBondContact O-N 3.11Å; F96-A98 VanDerWaalsContact C-N 3.32Å; F96-A98 PolarHBondContact O-N 2.63Å; F96-V99 PolarHBondContact O-N 2.86Å; F96-V100 HydrophobicContact CD1-CG2 4.34Å; F96-V100 HydrophobicContact CD2-CG2 4.46Å; F96-V100 HydrophobicContact CE1-CG2 3.94Å; F96-V100 HydrophobicContact CE2-CG2 4.07Å; F96-V100 HydrophobicContact CZ-CG2 3.79Å; F96-V100 WeakPolarHBondContact O-CG2 3.44Å; F96-V100 PolarHBondContact O-N 3.33Å
97	V	97.1	Very high	92.4	Very high	84 Å²	84	78.5 Å²	78.5	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-61.6	-42.1	177.4	173.8	0	0	0	0	110.8	V93 I94 V99 V100 A101	V93-V97 HydrophobicContact CG1-CG2 4.35Å; V93-V97 WeakPolarHBondContact O-CG2 3.15Å; V93-V97 PolarHBondContact O-N 3.25Å; I94-V97 PolarHBondContact O-N 3.14Å; V97-V99 PolarHBondContact O-N 3.02Å; V97-V100 PolarHBondContact O-N 2.03Å; V97-A101 VanDerWaalsContact O-CB 3.24Å; V97-A101 WeakPolarHBondContact O-CB 3.26Å; V97-A101 PolarHBondContact O-N 3.31Å
98	A	96	Very high	92.8	Very high	47 Å²	47	80.9 Å²	80.9	39%	0.388	48%	0.482	S	S	.	.	H	α-helix	trans	-61.5	-42.9	176.8	0	0	0	0	0	112.3	I94 L95 F96 T102	I94-A98 WeakPolarHBondContact O-CB 3.24Å; I94-A98 PolarHBondContact O-N 3.28Å; L95-A98 PolarHBondContact O-N 3.43Å; F96-A98 VanDerWaalsContact C-N 3.32Å; F96-A98 PolarHBondContact O-N 2.63Å; A98-T102 VanDerWaalsContact O-CB 3.32Å; A98-T102 WeakPolarHBondContact O-CB 3.11Å; A98-T102 WeakPolarHBondContact O-CG2 3.42Å; A98-T102 PolarHBondContact O-N 3.01Å; A98-T102 PolarHBondContact O-OG1 3.22Å
99	V	96	Very high	92.9	Very high	88 Å²	88	83.3 Å²	83.3	53%	0.533	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-43.8	176.2	173.4	0	0	0	0	111.3	L95 F96 V97 T102 T103	L95-V99 WeakPolarHBondContact O-CG2 3.4Å; L95-V99 PolarHBondContact O-N 3.16Å; F96-V99 PolarHBondContact O-N 2.86Å; V97-V99 PolarHBondContact O-N 3.02Å; V99-T102 WeakPolarHBondContact CA-OG1 2.91Å; V99-T102 PolarHBondContact O-OG1 3.25Å; V99-T103 HydrophobicContact CG1-CG2 4.44Å; V99-T103 WeakPolarHBondContact O-CB 3.49Å; V99-T103 VanDerWaalsContact O-CG2 3.24Å; V99-T103 WeakPolarHBondContact O-CG2 3.49Å; V99-T103 PolarHBondContact O-N 3.45Å; V99-T103 PolarHBondContact O-OG1 3.4Å
100	V	96.9	Very high	93	Very high	53 Å²	53	81.3 Å²	81.3	32%	0.321	49%	0.487	S	S	.	.	H	α-helix	trans	-66.1	-45.5	178.4	174	0	0	0	0	110.9	F96 V97 T103 I104	F96-V100 HydrophobicContact CD1-CG2 4.34Å; F96-V100 HydrophobicContact CD2-CG2 4.46Å; F96-V100 HydrophobicContact CE1-CG2 3.94Å; F96-V100 HydrophobicContact CE2-CG2 4.07Å; F96-V100 HydrophobicContact CZ-CG2 3.79Å; F96-V100 WeakPolarHBondContact O-CG2 3.44Å; F96-V100 PolarHBondContact O-N 3.33Å; V97-V100 PolarHBondContact O-N 2.03Å; V100-T103 WeakPolarHBondContact CA-OG1 3.48Å; V100-T103 PolarHBondContact O-N 3.17Å; V100-T103 PolarHBondContact O-OG1 3.37Å; V100-I104 HydrophobicContact CG1-CD1 3.75Å; V100-I104 HydrophobicContact CG1-CG1 4.47Å; V100-I104 WeakPolarHBondContact O-CB 3.39Å; V100-I104 VanDerWaalsContact O-CG1 3.25Å; V100-I104 WeakPolarHBondContact O-CG1 2.96Å; V100-I104 PolarHBondContact O-N 3.31Å
101	A	95.3	Very high	92.8	Very high	46 Å²	46	82.9 Å²	82.9	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-47.2	177.4	0	0	0	0	0	111.5	V97 T103 I104 C105	V97-A101 VanDerWaalsContact O-CB 3.24Å; V97-A101 WeakPolarHBondContact O-CB 3.26Å; V97-A101 PolarHBondContact O-N 3.31Å; A101-T103 PolarHBondContact O-N 2.98Å; A101-I104 PolarHBondContact O-N 3.46Å; A101-C105 VanDerWaalsContact O-CB 3.3Å; A101-C105 WeakPolarHBondContact O-CB 3.47Å; A101-C105 PolarHBondContact O-N 3.26Å; A101-C105 PolarHBondContact O-SG 2.86Å
102	T	93.4	Very high	92.5	Very high	78 Å²	78	83.8 Å²	83.8	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-42.3	177.9	49.2	0	0	0	0	111.9	A98 V99 C105 C106	A98-T102 VanDerWaalsContact O-CB 3.32Å; A98-T102 WeakPolarHBondContact O-CB 3.11Å; A98-T102 WeakPolarHBondContact O-CG2 3.42Å; A98-T102 PolarHBondContact O-N 3.01Å; A98-T102 PolarHBondContact O-OG1 3.22Å; V99-T102 WeakPolarHBondContact CA-OG1 2.91Å; V99-T102 PolarHBondContact O-OG1 3.25Å; T102-C105 PolarHBondContact O-N 3.23Å; T102-C106 VanDerWaalsContact O-CB 3.27Å; T102-C106 WeakPolarHBondContact O-CB 3.08Å; T102-C106 PolarHBondContact O-N 3.05Å; T102-C106 PolarHBondContact O-SG 3.11Å
103	T	92.3	Very high	91.8	Very high	60 Å²	60	88.3 Å²	88.3	37%	0.368	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-46.7	176.6	52.2	0	0	0	0	111.6	V99 V100 A101 C105 C106 F107	V99-T103 HydrophobicContact CG1-CG2 4.44Å; V99-T103 WeakPolarHBondContact O-CB 3.49Å; V99-T103 VanDerWaalsContact O-CG2 3.24Å; V99-T103 WeakPolarHBondContact O-CG2 3.49Å; V99-T103 PolarHBondContact O-N 3.45Å; V99-T103 PolarHBondContact O-OG1 3.4Å; V100-T103 WeakPolarHBondContact CA-OG1 3.48Å; V100-T103 PolarHBondContact O-N 3.17Å; V100-T103 PolarHBondContact O-OG1 3.37Å; A101-T103 PolarHBondContact O-N 2.98Å; T103-C105 PolarHBondContact O-N 3.37Å; T103-C106 WeakPolarHBondContact O-CB 3.13Å; T103-C106 PolarHBondContact O-N 3.38Å; T103-F107 WeakPolarHBondContact O-CD2 3.34Å; T103-F107 PolarHBondContact O-N 3.23Å
104	I	95.2	Very high	91	Very high	86 Å²	86	88.9 Å²	88.9	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-58.9	-48.8	175.1	-67.1	167.8	0	0	0	110.6	V100 A101 C106 F107 L108	V100-I104 HydrophobicContact CG1-CD1 3.75Å; V100-I104 HydrophobicContact CG1-CG1 4.47Å; V100-I104 WeakPolarHBondContact O-CB 3.39Å; V100-I104 VanDerWaalsContact O-CG1 3.25Å; V100-I104 WeakPolarHBondContact O-CG1 2.96Å; V100-I104 PolarHBondContact O-N 3.31Å; A101-I104 PolarHBondContact O-N 3.46Å; I104-C106 VanDerWaalsContact C-N 3.31Å; I104-C106 PolarHBondContact O-N 3.11Å; I104-F107 PolarHBondContact O-N 3.19Å; I104-L108 HydrophobicContact CG2-CD1 3.77Å; I104-L108 HydrophobicContact CG2-CG 4.17Å; I104-L108 WeakPolarHBondContact O-CB 3.39Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.39Å; I104-L108 PolarHBondContact O-N 2.84Å
105	C	93.2	Very high	90.2	Very high	71 Å²	71	90.5 Å²	90.5	48%	0.48	51%	0.505	S	S	.	.	H	α-helix	trans	-57.9	-43.8	175.9	-70.3	0	0	0	0	111.4	A101 T102 T103 F107 L108 C109	A101-C105 VanDerWaalsContact O-CB 3.3Å; A101-C105 WeakPolarHBondContact O-CB 3.47Å; A101-C105 PolarHBondContact O-N 3.26Å; A101-C105 PolarHBondContact O-SG 2.86Å; T102-C105 PolarHBondContact O-N 3.23Å; T103-C105 PolarHBondContact O-N 3.37Å; C105-F107 PolarHBondContact O-N 3.13Å; C105-L108 PolarHBondContact O-N 2.88Å; C105-C109 WeakPolarHBondContact O-CB 3.04Å; C105-C109 PolarHBondContact O-N 3.43Å; C105-C109 PolarHBondContact O-SG 2.86Å
106	C	90.6	Very high	89.4	Confident	76 Å²	76	93.4 Å²	93.4	51%	0.514	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-42.4	176.2	-74	0	0	0	0	112	T102 T103 I104 S110	T102-C106 VanDerWaalsContact O-CB 3.27Å; T102-C106 WeakPolarHBondContact O-CB 3.08Å; T102-C106 PolarHBondContact O-N 3.05Å; T102-C106 PolarHBondContact O-SG 3.11Å; T103-C106 WeakPolarHBondContact O-CB 3.13Å; T103-C106 PolarHBondContact O-N 3.38Å; I104-C106 VanDerWaalsContact C-N 3.31Å; I104-C106 PolarHBondContact O-N 3.11Å; C106-S110 WeakPolarHBondContact O-CB 3.3Å; C106-S110 PolarHBondContact O-N 3.24Å; C106-S110 PolarHBondContact O-OG 3.12Å
107	F	90	Very high	88.7	Confident	142 Å²	142	93.7 Å²	93.7	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-66	-46.7	176.2	-75.4	-63.3	0	0	0	111.2	T103 I104 C105 S110 C111	T103-F107 WeakPolarHBondContact O-CD2 3.34Å; T103-F107 PolarHBondContact O-N 3.23Å; I104-F107 PolarHBondContact O-N 3.19Å; C105-F107 PolarHBondContact O-N 3.13Å; F107-S110 PolarHBondContact O-N 2.98Å; F107-C111 WeakPolarHBondContact O-CB 3.06Å; F107-C111 PolarHBondContact O-N 3.43Å; F107-C111 PolarHBondContact O-SG 3.15Å
108	L	88.1	Confident	87.9	Confident	108 Å²	108	98.3 Å²	98.3	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-44.6	177.6	-65	177.4	0	0	0	111.1	I104 C105 C111 C112	I104-L108 HydrophobicContact CG2-CD1 3.77Å; I104-L108 HydrophobicContact CG2-CG 4.17Å; I104-L108 WeakPolarHBondContact O-CB 3.39Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.39Å; I104-L108 PolarHBondContact O-N 2.84Å; C105-L108 PolarHBondContact O-N 2.88Å; L108-C111 PolarHBondContact O-N 3.48Å; L108-C112 WeakPolarHBondContact O-CB 3.35Å; L108-C112 PolarHBondContact O-N 3.45Å; L108-C112 PolarHBondContact O-SG 3.48Å
109	C	87.8	Confident	86.9	Confident	89 Å²	89	100.4 Å²	100.4	60%	0.601	52%	0.515	S	S	*	.	H	α-helix	trans	-63.9	-44.6	175.6	-70.2	0	0	0	0	112.5	C105 C112 Y113	C105-C109 WeakPolarHBondContact O-CB 3.04Å; C105-C109 PolarHBondContact O-N 3.43Å; C105-C109 PolarHBondContact O-SG 2.86Å; C109-C112 PolarHBondContact O-N 3.47Å; C109-Y113 VanDerWaalsContact O-CB 3.28Å; C109-Y113 WeakPolarHBondContact O-CB 3.1Å; C109-Y113 PolarHBondContact O-N 2.98Å
110	S	89.4	Confident	85.9	Confident	64 Å²	64	102.3 Å²	102.3	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-65.7	-41.3	177.5	-59.7	0	0	0	0	111.4	C106 F107 Y113 L114	C106-S110 WeakPolarHBondContact O-CB 3.3Å; C106-S110 PolarHBondContact O-N 3.24Å; C106-S110 PolarHBondContact O-OG 3.12Å; F107-S110 PolarHBondContact O-N 2.98Å; S110-Y113 PolarHBondContact O-N 3.45Å; S110-L114 WeakPolarHBondContact O-CB 3.44Å; S110-L114 VanDerWaalsContact O-CG 3.26Å; S110-L114 WeakPolarHBondContact O-CG 3.4Å; S110-L114 PolarHBondContact O-N 3.45Å
111	C	82.3	Confident	84.6	Confident	75 Å²	75	105.4 Å²	105.4	51%	0.507	53%	0.532	S	S	.	.	H	α-helix	trans	-68	-42	175.9	-71	0	0	0	0	111.7	F107 L108 L114 Y115	F107-C111 WeakPolarHBondContact O-CB 3.06Å; F107-C111 PolarHBondContact O-N 3.43Å; F107-C111 PolarHBondContact O-SG 3.15Å; L108-C111 PolarHBondContact O-N 3.48Å; C111-L114 PolarHBondContact O-N 2.9Å; C111-Y115 WeakPolarHBondContact O-CB 3.27Å; C111-Y115 PolarHBondContact O-N 3.1Å
112	C	83.7	Confident	83.3	Confident	81 Å²	81	109.4 Å²	109.4	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-41.1	174.3	-73.1	0	0	0	0	111.3	L108 C109 R116	L108-C112 WeakPolarHBondContact O-CB 3.35Å; L108-C112 PolarHBondContact O-N 3.45Å; L108-C112 PolarHBondContact O-SG 3.48Å; C109-C112 PolarHBondContact O-N 3.47Å; C112-R116 VanDerWaalsContact O-CB 3.24Å; C112-R116 WeakPolarHBondContact O-CB 3.13Å; C112-R116 PolarHBondContact O-N 3.4Å
113	Y	78.7	Confident	81.7	Confident	153 Å²	153	108.5 Å²	108.5	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-61.3	-49	174.6	174.9	-101.2	0	0	0	111.5	C109 S110 R117	C109-Y113 VanDerWaalsContact O-CB 3.28Å; C109-Y113 WeakPolarHBondContact O-CB 3.1Å; C109-Y113 PolarHBondContact O-N 2.98Å; S110-Y113 PolarHBondContact O-N 3.45Å; Y113-R117 WeakPolarHBondContact O-CB 3.32Å; Y113-R117 PolarHBondContact O-N 3.08Å
114	L	77.3	Confident	79.9	Confident	92 Å²	92	109.9 Å²	109.9	48%	0.482	55%	0.55	S	S	.	.	H	α-helix	trans	-68	-38.8	178.9	-69.3	176.1	0	0	0	112.5	S110 C111 R117 R118	S110-L114 WeakPolarHBondContact O-CB 3.44Å; S110-L114 VanDerWaalsContact O-CG 3.26Å; S110-L114 WeakPolarHBondContact O-CG 3.4Å; S110-L114 PolarHBondContact O-N 3.45Å; C111-L114 PolarHBondContact O-N 2.9Å; L114-R117 PolarHBondContact O-N 3.5Å; L114-R118 WeakPolarHBondContact O-CB 3.44Å; L114-R118 WeakPolarHBondContact O-CG 3.48Å; L114-R118 PolarHBondContact O-N 2.99Å
115	Y	78.8	Confident	77.9	Confident	150 Å²	150	115 Å²	115	59%	0.588	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-48	176.6	179.7	-105.1	0	0	0	111	C111 R117 R118 Q119	C111-Y115 WeakPolarHBondContact O-CB 3.27Å; C111-Y115 PolarHBondContact O-N 3.1Å; Y115-R117 VanDerWaalsContact C-N 3.32Å; Y115-R117 PolarHBondContact O-N 3.27Å; Y115-R118 PolarHBondContact O-N 2.84Å; Y115-Q119 HydrophobicContact CD1-CG 4.44Å; Y115-Q119 HydrophobicContact CE1-CG 4.11Å; Y115-Q119 WeakPolarHBondContact O-CG 3.27Å; Y115-Q119 PolarHBondContact O-N 3.1Å; Y115-Q119 PolarHBondContact OH-NE2 2.83Å
116	R	79.8	Confident	76	Confident	177 Å²	177	119.9 Å²	119.9	67%	0.668	59%	0.585	S	S	*	*	H	α-helix	trans	-62.4	-40	175.5	-167.8	179.8	-169.9	-176	3.8	111.5	C112 Q119 Q120	C112-R116 VanDerWaalsContact O-CB 3.24Å; C112-R116 WeakPolarHBondContact O-CB 3.13Å; C112-R116 PolarHBondContact O-N 3.4Å; R116-Q119 PolarHBondContact O-N 3.05Å; R116-Q120 WeakPolarHBondContact O-CB 3.41Å; R116-Q120 WeakPolarHBondContact O-CG 3.42Å; R116-Q120 PolarHBondContact O-N 3.44Å
117	R	80.1	Confident	74.2	Confident	147 Å²	147	119.2 Å²	119.2	56%	0.555	59%	0.591	S	S	*	*	H	α-helix	trans	-64.3	-41.5	175.4	-172.4	178	-177.3	-158.2	1.3	111.9	Y113 L114 Y115 Q120 L121	Y113-R117 WeakPolarHBondContact O-CB 3.32Å; Y113-R117 PolarHBondContact O-N 3.08Å; L114-R117 PolarHBondContact O-N 3.5Å; Y115-R117 VanDerWaalsContact C-N 3.32Å; Y115-R117 PolarHBondContact O-N 3.27Å; R117-Q120 PolarHBondContact O-N 3Å; R117-L121 HydrophobicContact CG-CD1 4.33Å; R117-L121 WeakPolarHBondContact O-CG 3.36Å; R117-L121 PolarHBondContact O-N 2.98Å
118	R	81	Confident	72.2	Confident	182 Å²	182	119.5 Å²	119.5	69%	0.687	59%	0.594	S	S	*	*	H	α-helix	trans	-63.7	-45.4	173.8	-76.5	-170.1	-179.3	-169.8	1.4	111.1	L114 Y115 Q120 L121 Q122	L114-R118 WeakPolarHBondContact O-CB 3.44Å; L114-R118 WeakPolarHBondContact O-CG 3.48Å; L114-R118 PolarHBondContact O-N 2.99Å; Y115-R118 PolarHBondContact O-N 2.84Å; R118-Q120 VanDerWaalsContact C-N 3.31Å; R118-Q120 PolarHBondContact O-N 2.69Å; R118-L121 CarbonylContact O-C 3.6Å; R118-L121 PolarHBondContact O-N 3.12Å; R118-Q122 WeakPolarHBondContact O-CB 3.47Å; R118-Q122 PolarHBondContact O-N 3.45Å; R118-Q122 PolarHBondContact O-OE1 3.3Å
119	Q	75.9	Confident	70.3	Confident	90 Å²	90	122.7 Å²	122.7	42%	0.421	61%	0.606	S	S	.	*	H	α-helix	trans	-57.5	-42.2	173.4	-75.6	-177.1	-32.9	0	0	112.4	Y115 R116 L121 Q122 S123	Y115-Q119 HydrophobicContact CD1-CG 4.44Å; Y115-Q119 HydrophobicContact CE1-CG 4.11Å; Y115-Q119 WeakPolarHBondContact O-CG 3.27Å; Y115-Q119 PolarHBondContact O-N 3.1Å; Y115-Q119 PolarHBondContact OH-NE2 2.83Å; R116-Q119 PolarHBondContact O-N 3.05Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.31Å; Q119-Q122 PolarHBondContact O-N 2.02Å; Q119-S123 WeakPolarHBondContact O-CB 3.33Å; Q119-S123 PolarHBondContact O-N 3.4Å; Q119-S123 PolarHBondContact O-OG 3.41Å
120	Q	74.2	Confident	68.4	Low	128 Å²	128	124.5 Å²	124.5	60%	0.598	61%	0.609	S	S	*	*	H	α-helix	trans	-69.1	-23.1	176	-71.2	-78.2	-50.7	0	0	113.8	R116 R117 R118 S123 P124	R116-Q120 WeakPolarHBondContact O-CB 3.41Å; R116-Q120 WeakPolarHBondContact O-CG 3.42Å; R116-Q120 PolarHBondContact O-N 3.44Å; R117-Q120 PolarHBondContact O-N 3Å; R118-Q120 VanDerWaalsContact C-N 3.31Å; R118-Q120 PolarHBondContact O-N 2.69Å; Q120-S123 WeakPolarHBondContact CA-OG 3.33Å; Q120-S123 PolarHBondContact O-OG 2.99Å; Q120-P124 WeakPolarHBondContact O-CD 3.27Å; Q120-P124 VanDerWaalsContact O-CG 3.23Å; Q120-P124 WeakPolarHBondContact O-CG 3.08Å
121	L	69.9	Low	66.6	Low	119 Å²	119	125.7 Å²	125.7	62%	0.623	62%	0.615	S	S	*	*	H	α-helix	trans	-89.1	-19	171.4	-73.1	171	0	0	0	112.6	R117 R118 Q119 P124	R117-L121 HydrophobicContact CG-CD1 4.33Å; R117-L121 WeakPolarHBondContact O-CG 3.36Å; R117-L121 PolarHBondContact O-N 2.98Å; R118-L121 CarbonylContact O-C 3.6Å; R118-L121 PolarHBondContact O-N 3.12Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.31Å; L121-P124 WeakPolarHBondContact O-CD 3.24Å
122	Q	67.6	Low	64.9	Low	129 Å²	129	130.5 Å²	130.5	60%	0.603	63%	0.632	S	S	*	*	H	α-helix	trans	-84.1	-37.6	172.9	-130.6	93	9.1	0	0	111.1	R118 Q119 F125 E126	R118-Q122 WeakPolarHBondContact O-CB 3.47Å; R118-Q122 PolarHBondContact O-N 3.45Å; R118-Q122 PolarHBondContact O-OE1 3.3Å; Q119-Q122 PolarHBondContact O-N 2.02Å; Q122-F125 PolarHBondContact O-N 3.09Å; Q122-E126 PolarHBondContact O-N 3.31Å
123	S	59.4	Low	63.5	Low	60 Å²	60	132.7 Å²	132.7	42%	0.42	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	-21	177.9	64.9	0	0	0	0	116.9	Q119 Q120 F125 G127	Q119-S123 WeakPolarHBondContact O-CB 3.33Å; Q119-S123 PolarHBondContact O-N 3.4Å; Q119-S123 PolarHBondContact O-OG 3.41Å; Q120-S123 WeakPolarHBondContact CA-OG 3.33Å; Q120-S123 PolarHBondContact O-OG 2.99Å; S123-F125 PolarHBondContact O-N 2.03Å; S123-G127 PolarHBondContact O-N 2.59Å
124	P	54.9	Low	62.3	Low	89 Å²	89	128.6 Å²	128.6	58%	0.578	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-13.8	168.4	-9	27.1	0	0	0	112.1	Q120 L121	Q120-P124 WeakPolarHBondContact O-CD 3.27Å; Q120-P124 VanDerWaalsContact O-CG 3.23Å; Q120-P124 WeakPolarHBondContact O-CG 3.08Å; L121-P124 WeakPolarHBondContact O-CD 3.24Å
125	F	53	Low	60.6	Low	192 Å²	192	130.7 Å²	130.7	84%	0.842	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-17	-179.9	-143.1	-92.3	0	0	0	113.6	Q122 S123	Q122-F125 PolarHBondContact O-N 3.09Å; S123-F125 PolarHBondContact O-N 2.03Å
126	E	54.5	Low	58.9	Low	174 Å²	174	128.9 Å²	128.9	81%	0.813	66%	0.664	S	S	*	*	S	Bend	trans	-100	10.8	171.2	-147.2	-171.6	120.1	0	0	112.5	Q122	Q122-E126 PolarHBondContact O-N 3.31Å
127	G	51.6	Low	57.4	Low	62 Å²	62	127.1 Å²	127.1	64%	0.639	67%	0.673	S	S	*	*	S	Bend	trans	-123.3	10.8	179.2	0	0	0	0	0	114	S123	S123-G127 PolarHBondContact O-N 2.59Å
128	Q	48.5	Very low	55.7	Low	148 Å²	148	127.6 Å²	127.6	69%	0.692	68%	0.681	S	S	*	*			trans	-120	68.1	160.6	-164	136.2	-56.6	0	0	107.3	I130	Q128-I130 HydrophobicContact CG-CG1 3.93Å; Q128-I130 PolarHBondContact O-N 2.05Å
129	E	47.5	Very low	54	Low	175 Å²	175	123.5 Å²	123.5	82%	0.818	68%	0.678	S	S	*	*			trans	-53.4	93.8	136.5	-47.4	-167	130.5	0	0	103.8	P131	E129-P131 VanDerWaalsContact C-N 3.34Å; E129-P131 WeakPolarHBondContact O-CD 3.38Å
130	I	49.2	Very low	52.4	Low	128 Å²	128	126 Å²	126	66%	0.656	70%	0.699	S	S	*	*			trans	-47.6	111.7	164	-62.2	164.3	0	0	0	102.5	Q128 M132	Q128-I130 HydrophobicContact CG-CG1 3.93Å; Q128-I130 PolarHBondContact O-N 2.05Å; I130-M132 PolarHBondContact O-N 2.87Å
131	P	51.1	Low	50.6	Low	88 Å²	88	128.6 Å²	128.6	57%	0.571	71%	0.705	S	S	*	*			trans	-57.5	117	169.3	-15.8	30.2	0	0	0	102.6	E129 T133	E129-P131 VanDerWaalsContact C-N 3.34Å; E129-P131 WeakPolarHBondContact O-CD 3.38Å; P131-T133 HydrophobicContact CB-CG2 3.79Å; P131-T133 PolarHBondContact O-N 2.94Å; P131-T133 PolarHBondContact O-OG1 3Å
132	M	46.7	Very low	49.3	Very low	177 Å²	177	128.5 Å²	128.5	87%	0.872	71%	0.711	S	S	*	*			trans	-67.5	55.2	166.7	-109.9	-162.8	-73.5	0	0	107.9	I130 G134	I130-M132 PolarHBondContact O-N 2.87Å; M132-G134 PolarHBondContact O-N 2.81Å
133	T	54.6	Low	48	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	84.2	168.2	50.9	0	0	0	0	105.6	P131	P131-T133 HydrophobicContact CB-CG2 3.79Å; P131-T133 PolarHBondContact O-N 2.94Å; P131-T133 PolarHBondContact O-OG1 3Å
134	G	52.7	Low	47.3	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	175.2	6.7	179	0	0	0	0	0	117.5	M132	M132-G134 PolarHBondContact O-N 2.81Å
135	I	41.5	Very low	47	Very low	136 Å²	136	139.9 Å²	139.9	70%	0.697	75%	0.752	S	S	*	*			trans	-140.3	107.9	158.7	-17.8	172.8	0	0	0	106.1	V137	I135-V137 VanDerWaalsContact C-N 3.33Å; I135-V137 PolarHBondContact O-N 3.27Å
136	P	43	Very low	46.5	Very low	112 Å²	112	137.7 Å²	137.7	73%	0.727	75%	0.75	S	S	*	*			trans	-62	105.7	166.4	25.6	-29.2	0	0	0	106.2	Q138	P136-Q138 PolarHBondContact O-N 3.36Å
137	V	48.5	Very low	46.2	Very low	139 Å²	139	135.5 Å²	135.5	84%	0.842	75%	0.75	S	S	*	*			trans	-62.2	96.4	161.3	176.3	0	0	0	0	104.4	I135	I135-V137 VanDerWaalsContact C-N 3.33Å; I135-V137 PolarHBondContact O-N 3.27Å
138	Q	45.5	Very low	46.2	Very low	157 Å²	157	142.4 Å²	142.4	73%	0.734	76%	0.763	S	S	*	*			trans	-59	133.8	175.8	-70.9	-159.6	35.3	0	0	108.1	P136 V140	P136-Q138 PolarHBondContact O-N 3.36Å; Q138-V140 PolarHBondContact O-N 2.89Å
139	P	43.7	Very low	46	Very low	97 Å²	97	139.9 Å²	139.9	63%	0.63	77%	0.768	S	S	*	*			trans	-62	121.3	169.1	24.3	-29.6	0	0	0	108.1	Y141	P139-Y141 HydrophobicContact CG-CE2 4.37Å; P139-Y141 PolarHBondContact O-N 2.95Å
140	V	42.3	Very low	46.2	Very low	141 Å²	141	134.7 Å²	134.7	86%	0.855	76%	0.76	S	S	*	*			trans	-61.9	103.2	170.5	174.9	0	0	0	0	107.2	Q138	Q138-V140 PolarHBondContact O-N 2.89Å
141	Y	37.8	Very low	45.9	Very low	184 Å²	184	135.2 Å²	135.2	72%	0.722	77%	0.772	S	S	*	*			trans	-71.6	129.6	169.8	-93	-89.5	0	0	0	108.9	P139 Y143	P139-Y141 HydrophobicContact CG-CE2 4.37Å; P139-Y141 PolarHBondContact O-N 2.95Å; Y141-Y143 PolarHBondContact O-N 3.47Å; Y141-Y143 VanDerWaalsContact O-N 3.1Å
142	P	41.5	Very low	45.7	Very low	117 Å²	117	135.3 Å²	135.3	76%	0.76	78%	0.781	S	S	*	*			trans	-66.4	110.4	166.1	-8.5	23.5	0	0	0	107.5
143	Y	40.1	Very low	46	Very low	210 Å²	210	132.2 Å²	132.2	82%	0.824	77%	0.774	S	S	*	*			trans	-66.4	138.3	170.2	-94.5	-90.6	0	0	0	109.6	Y141 Q145	Y141-Y143 PolarHBondContact O-N 3.47Å; Y141-Y143 VanDerWaalsContact O-N 3.1Å; Y143-Q145 PolarHBondContact O-N 2.67Å
144	P	45.4	Very low	45.5	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	78%	0.775	S	S	*	*			trans	-59.9	123.9	167.7	-19.4	31.5	0	0	0	109.6	D146	P144-D146 PolarHBondContact O-N 3.07Å
145	Q	47.4	Very low	45.2	Very low	194 Å²	194	137.3 Å²	137.3	91%	0.907	78%	0.782	S	S	*	*			trans	-68.3	114.8	173.2	-91.1	-163.8	-62.7	0	0	110	Y143	Y143-Q145 PolarHBondContact O-N 2.67Å
146	D	44.2	Very low	45.4	Very low	147 Å²	147	135.9 Å²	135.9	79%	0.786	78%	0.781	S	S	*	*			trans	-71.1	127.3	165.6	-93.9	-56.3	0	0	0	110.4	P144 K148	P144-D146 PolarHBondContact O-N 3.07Å; D146-K148 PolarHBondContact O-N 2.96Å
147	P	47.2	Very low	45.3	Very low	128 Å²	128	134.2 Å²	134.2	83%	0.831	78%	0.784	S	S	*	*	S	Bend	trans	-74.7	16.9	-173.6	-15.4	30	0	0	0	116
148	K	51.9	Low	44.8	Very low	206 Å²	206	137 Å²	137	90%	0.896	79%	0.785	S	S	*	*			trans	-133.8	69.8	-177.7	-86.4	-151.2	177.7	-171	0	112.5	D146	D146-K148 PolarHBondContact O-N 2.96Å
149	A	44.8	Very low	44.4	Very low	96 Å²	96	138.1 Å²	138.1	79%	0.793	79%	0.792	S	S	*	*			trans	-145.7	121.8	157.6	0	0	0	0	0	108.8
150	G	50.7	Low	44.4	Very low	65 Å²	65	143.9 Å²	143.9	67%	0.67	80%	0.803	S	S	*	*			trans	-67.7	177.1	-178	0	0	0	0	0	113.7	A152	G150-A152 PolarHBondContact O-N 3.34Å
151	P	43	Very low	45.1	Very low	139 Å²	139	142.5 Å²	142.5	90%	0.903	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.6	120	-171.6	23.8	-31.5	0	0	0	111.8
152	A	46.7	Very low	45.5	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-90.1	142	171.4	0	0	0	0	0	110.5	G150	G150-A152 PolarHBondContact O-N 3.34Å
153	P	52.4	Low	46.2	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72.3	157.1	-171.3	27.8	-34.1	0	0	0	113.6	Q155	P153-Q155 PolarHBondContact O-N 2.85Å
154	P	46.1	Very low	46.7	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.7	129.6	-178.3	24.8	-31.5	0	0	0	112
155	Q	46.3	Very low	47	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.9	132.1	174.1	-71.1	-85.5	-31.1	0	0	110.1	P153	P153-Q155 PolarHBondContact O-N 2.85Å
156	P	44.2	Very low	47.2	Very low	106 Å²	106	128.2 Å²	128.2	69%	0.688	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.5	139.9	-177.1	-15.7	29.3	0	0	0	112.8	F158	P156-F158 PolarHBondContact O-N 3.33Å
157	G	41.9	Very low	47.4	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.7	128.6	178.1	0	0	0	0	0	112.7	M159	G157-M159 PolarHBondContact O-N 3.27Å
158	F	37.9	Very low	47.2	Very low	199 Å²	199	128.2 Å²	128.2	87%	0.873	78%	0.783	S	S	*	*			trans	-77.2	114.6	171.5	-82.3	-85.3	0	0	0	110.1	P156	P156-F158 PolarHBondContact O-N 3.33Å
159	M	37.8	Very low	46.4	Very low	179 Å²	179	127.2 Å²	127.2	88%	0.882	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-62.9	136.2	171.1	-66.4	-171.7	86.6	0	0	110.7	G157	G157-M159 PolarHBondContact O-N 3.27Å
160	Y	42.9	Very low	46.5	Very low	218 Å²	218	128.2 Å²	128.2	86%	0.855	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.9	134.6	163.1	-76.6	-94.2	0	0	0	109.7
161	P	56	Low	46.3	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.9	145.3	166.8	27.8	-30.5	0	0	0	110.4
162	P	47.4	Very low	46.2	Very low	122 Å²	122	136.9 Å²	136.9	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.8	147.3	-177.1	26.9	-32.6	0	0	0	111.4	G164	P162-G164 PolarHBondContact O-N 3.06Å
163	S	55.6	Low	46.4	Very low	124 Å²	124	138.2 Å²	138.2	87%	0.867	78%	0.782	S	S	*	*			trans	-55.2	107.1	176.5	47.7	0	0	0	0	111.3
164	G	51.8	Low	46.3	Very low	61 Å²	61	138.5 Å²	138.5	63%	0.629	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-67	152.4	166.3	0	0	0	0	0	111.4	P162	P162-G164 PolarHBondContact O-N 3.06Å
165	P	50.4	Low	46.8	Very low	132 Å²	132	135.2 Å²	135.2	86%	0.857	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.2	139.9	-178	25.9	-31.2	0	0	0	111.2
166	A	51.3	Low	47	Very low	78 Å²	78	132.4 Å²	132.4	65%	0.645	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-55.1	143.9	-179.8	0	0	0	0	0	111.9	Q168	A166-Q168 PolarHBondContact O-N 3.25Å; A166-Q168 VanDerWaalsContact O-N 3.12Å
167	P	48.1	Very low	47.5	Very low	93 Å²	93	133.6 Å²	133.6	60%	0.604	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61.1	118.8	173.3	23.9	-31	0	0	0	109.7	Y169	P167-Y169 WeakPolarHBondContact O-CD2 3.15Å; P167-Y169 WeakPolarHBondContact O-CE2 3.42Å; P167-Y169 PolarHBondContact O-N 3.48Å
168	Q	44.8	Very low	48.1	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	79%	0.789	S	S	*	*			trans	-73.5	109	171.6	-72.3	-83.6	-40.9	0	0	108.1	A166	A166-Q168 PolarHBondContact O-N 3.25Å; A166-Q168 VanDerWaalsContact O-N 3.12Å
169	Y	33.8	Very low	48.5	Very low	185 Å²	185	136.5 Å²	136.5	73%	0.725	79%	0.785	S	S	*	*			trans	-72.8	141.6	171.8	-55.2	-83.8	0	0	0	109.8	P167 L171	P167-Y169 WeakPolarHBondContact O-CD2 3.15Å; P167-Y169 WeakPolarHBondContact O-CE2 3.42Å; P167-Y169 PolarHBondContact O-N 3.48Å; Y169-L171 PolarHBondContact O-N 2.87Å
170	P	46.5	Very low	49.4	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	77%	0.77	S	S	*	*			trans	-62.4	119.5	178.2	-20.2	31.5	0	0	0	111.2	Y172	P170-Y172 PolarHBondContact O-N 3.28Å
171	L	47	Very low	49.9	Very low	172 Å²	172	127.9 Å²	127.9	90%	0.901	76%	0.763	S	S	*	*			trans	-66.5	115.7	169.5	-93	169.1	0	0	0	109.4	Y169	Y169-L171 PolarHBondContact O-N 2.87Å
172	Y	42	Very low	49.8	Very low	213 Å²	213	126.5 Å²	126.5	84%	0.835	76%	0.761	S	S	*	*			trans	-73.9	135.6	167.5	-92.6	-90.3	0	0	0	110.1	P170 A174	P170-Y172 PolarHBondContact O-N 3.28Å; Y172-A174 PolarHBondContact O-N 2.8Å
173	P	49.5	Very low	50	Low	120 Å²	120	124.1 Å²	124.1	78%	0.779	75%	0.752	S	S	*	*			trans	-70.5	131.2	177.4	-10.9	25.8	0	0	0	110.7	G175	P173-G175 PolarHBondContact O-N 3.08Å; P173-G175 VanDerWaalsContact O-N 3.16Å
174	A	50.5	Low	49.9	Very low	117 Å²	117	123.7 Å²	123.7	97%	0.967	75%	0.746	S	S	*	*			trans	-79.2	91.6	169.2	0	0	0	0	0	109.5	Y172	Y172-A174 PolarHBondContact O-N 2.8Å
175	G	57.7	Low	50.1	Low	56 Å²	56	126.6 Å²	126.6	58%	0.577	75%	0.754	S	S	*	*			trans	-142.9	143.8	172.9	0	0	0	0	0	111.3	P173	P173-G175 PolarHBondContact O-N 3.08Å; P173-G175 VanDerWaalsContact O-N 3.16Å
176	P	49.6	Very low	50	Low	117 Å²	117	126.2 Å²	126.2	76%	0.76	75%	0.751	S	S	*	*			trans	-64.8	146.1	178	26.7	-32.2	0	0	0	110.9	V178	P176-V178 PolarHBondContact O-N 3.47Å
177	P	55.9	Low	50	Low	131 Å²	131	133.3 Å²	133.3	85%	0.851	76%	0.763	S	S	*	*			trans	-66.5	121.5	-174.7	26	-32.6	0	0	0	110.7	Y179	P177-Y179 PolarHBondContact O-N 3.37Å
178	V	53.3	Low	50.3	Low	137 Å²	137	137.6 Å²	137.6	83%	0.83	78%	0.777	S	S	*	*			trans	-82	105.9	169.1	-175.6	0	0	0	0	107.1	P176 N180	P176-V178 PolarHBondContact O-N 3.47Å; V178-N180 PolarHBondContact O-N 3.37Å; V178-N180 VanDerWaalsContact O-N 3.17Å
179	Y	46.7	Very low	50.5	Low	200 Å²	200	134.1 Å²	134.1	78%	0.784	77%	0.771	S	S	*	*			trans	-66.1	111.7	174.7	-177.9	-97.9	0	0	0	109.4	P177 P181	P177-Y179 PolarHBondContact O-N 3.37Å; Y179-P181 HydrophobicContact CD1-CG 4.04Å; Y179-P181 HydrophobicContact CE1-CB 4.1Å; Y179-P181 HydrophobicContact CE1-CG 3.93Å; Y179-P181 WeakPolarHBondContact O-CD 3.09Å
180	N	55.6	Low	51.5	Low	107 Å²	107	131.5 Å²	131.5	57%	0.572	78%	0.776	S	S	*	*			trans	-97.9	110.7	172.2	-175.8	3.7	0	0	0	109.2	V178 A182	V178-N180 PolarHBondContact O-N 3.37Å; V178-N180 VanDerWaalsContact O-N 3.17Å; N180-A182 PolarHBondContact O-N 2.7Å; N180-A182 VanDerWaalsContact O-N 3.11Å; N180-A182 PolarHBondContact OD1-N 3.36Å
181	P	53.9	Low	51.8	Low	108 Å²	108	134.8 Å²	134.8	70%	0.701	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-5.1	-176.5	-16.6	29.3	0	0	0	115.4	Y179	Y179-P181 HydrophobicContact CD1-CG 4.04Å; Y179-P181 HydrophobicContact CE1-CB 4.1Å; Y179-P181 HydrophobicContact CE1-CG 3.93Å; Y179-P181 WeakPolarHBondContact O-CD 3.09Å
182	A	54.3	Low	51.8	Low	83 Å²	83	131.5 Å²	131.5	69%	0.686	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	10.3	-172.9	0	0	0	0	0	114.9	N180	N180-A182 PolarHBondContact O-N 2.7Å; N180-A182 VanDerWaalsContact O-N 3.11Å; N180-A182 PolarHBondContact OD1-N 3.36Å
183	A	52.8	Low	52.2	Low	73 Å²	73	127 Å²	127	60%	0.603	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-80.9	124.4	178.8	0	0	0	0	0	111.5
184	P	53.4	Low	52	Low	114 Å²	114	131.3 Å²	131.3	74%	0.74	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.9	144.8	175.3	26.1	-30.9	0	0	0	111.3
185	P	55.2	Low	52.1	Low	122 Å²	122	131.4 Å²	131.4	79%	0.792	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.6	142.5	-176.5	26.4	-33.2	0	0	0	111.8	Y187	P185-Y187 PolarHBondContact O-N 3.41Å
186	P	48.5	Very low	51.3	Low	125 Å²	125	132.7 Å²	132.7	81%	0.812	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-78.9	116.8	178.7	9.2	4.8	0	0	0	111.5
187	Y	50.8	Low	50.6	Low	227 Å²	227	135.7 Å²	135.7	89%	0.89	81%	0.811	S	S	*	*			trans	32.1	110.5	154.4	-72.1	-88.1	0	0	0	120	P185	P185-Y187 PolarHBondContact O-N 3.41Å
188	M	53.5	Low	50.4	Low	183 Å²	183	136 Å²	136	90%	0.901	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-63.6	142.2	155.4	-102.9	179.7	145.1	0	0	111
189	P	49.8	Very low	50.2	Low	110 Å²	110	135.9 Å²	135.9	71%	0.714	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.7	154.9	172.5	29.4	-32.7	0	0	0	112.2
190	P	54.3	Low	50.4	Low	130 Å²	130	132.3 Å²	132.3	84%	0.844	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-66.2	133.6	-180	-14	27.9	0	0	0	111.9
191	Q	53.4	Low	50.1	Low	186 Å²	186	133.8 Å²	133.8	87%	0.869	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70.8	141.6	172.2	-84	-166.9	-75.1	0	0	111.5	S193	Q191-S193 PolarHBondContact O-N 2.87Å
192	P	47.7	Very low	49.9	Very low	103 Å²	103	135.4 Å²	135.4	67%	0.669	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-72.9	123.8	168.9	6.3	5.4	0	0	0	110.9	Y194	P192-Y194 PolarHBondContact O-N 2.85Å
193	S	49.7	Very low	49.6	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	84%	0.84	S	S	*	*			trans	-72.1	112.9	164.1	32.8	0	0	0	0	109.6	Q191	Q191-S193 PolarHBondContact O-N 2.87Å
194	Y	45.3	Very low	49.4	Very low	210 Å²	210	143.6 Å²	143.6	82%	0.824	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-86	132.8	167.1	-84.9	-86.8	0	0	0	110	P192	P192-Y194 PolarHBondContact O-N 2.85Å
195	P	52.4	Low	49	Very low	120 Å²	120	145.9 Å²	145.9	78%	0.779	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-76.8	144.3	168.8	32.3	-30.1	0	0	0	109.8
196	G	41.4	Very low	48.5	Very low	82 Å²	82	147.9 Å²	147.9	85%	0.845	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-71.2	169.5	-168	0	0	0	0	0	116.9
197	A	35.8	Very low	48.5	Very low	181 Å²	181	150 Å²	150	100%	1.496	88%	0.878	S	S	*	*			trans	-146.4	0	145.6	0	0	0	0	0	107.1

Retrieved 197 of 197 residues in 679.7 ms (Link to these results)

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