A0A3Q0KGC6_SCHMA Loading...

Protein phosphatase 1 regulatory inhibitor subunit 16a, putative

AlphaFold DB , UniProt , Accession A0A3Q0KGC6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 774 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	37.4	Very low	39.8	Very low	224 Å²	224	152.9 Å²	152.9	100%	1.103	83%	0.833	S	S	*	*				0	94.8	0	-63.7	-172.9	-163.1	0	0	109.5	D3	M1-D3 PolarHBondContact N-OD2 3.04Å
2	M	36.1	Very low	39.7	Very low	179 Å²	179	150.9 Å²	150.9	88%	0.882	83%	0.828	S	S	*	*			cis	-97.6	118.1	1.5	-63.6	179.5	-175.8	0	0	111.3
3	D	39.2	Very low	39.7	Very low	126 Å²	126	146.4 Å²	146.4	67%	0.674	81%	0.808	S	S	*	*			trans	-84.3	165	151.3	-52.4	-96.2	0	0	0	106.2	M1	M1-D3 PolarHBondContact N-OD2 3.04Å
4	N	41.8	Very low	39.9	Very low	156 Å²	156	145.3 Å²	145.3	83%	0.834	80%	0.798	S	S	*	*			trans	71.5	69.1	178.5	-49	-29.7	0	0	0	117.7
5	L	41.5	Very low	40.1	Very low	158 Å²	158	144.5 Å²	144.5	83%	0.827	79%	0.793	S	S	*	*			trans	-122.9	-3.5	149.9	-82.5	177.3	0	0	0	114.5	G7	L5-G7 PolarHBondContact O-N 2.84Å; L5-G7 VanDerWaalsContact O-N 3.1Å
6	N	42.8	Very low	40.3	Very low	181 Å²	181	143.3 Å²	143.3	97%	0.968	78%	0.783	S	S	*	*	S	Bend	trans	-84.2	28.7	-179.2	-124.8	2.6	0	0	0	113.2
7	G	41.5	Very low	40.5	Very low	64 Å²	64	138.6 Å²	138.6	66%	0.66	77%	0.769	S	S	*	*			trans	-125.6	5.1	-157.8	0	0	0	0	0	118.1	L5	L5-G7 PolarHBondContact O-N 2.84Å; L5-G7 VanDerWaalsContact O-N 3.1Å
8	S	36.9	Very low	40.9	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	77%	0.767	S	S	*	*	S	Bend	trans	-135.7	26.4	-169.6	-50.8	0	0	0	0	115.5
9	I	41.7	Very low	41.4	Very low	170 Å²	170	139.9 Å²	139.9	87%	0.872	77%	0.773	S	S	*	*	S	Bend	trans	-110.9	1.6	170.9	-66	177.9	0	0	0	111.5
10	E	40.4	Very low	42.2	Very low	165 Å²	165	139.1 Å²	139.1	77%	0.771	77%	0.765	S	S	*	*	S	Bend	trans	-88.5	148.7	159.9	-57.9	-166.8	142.2	0	0	108.6
11	N	38.6	Very low	42.8	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	77%	0.769	S	S	*	*			trans	78.6	23.9	-178.1	-50.7	-23.5	0	0	0	118.7	T13	N11-T13 PolarHBondContact O-N 2.9Å
12	V	39	Very low	43.7	Very low	129 Å²	129	134.4 Å²	134.4	78%	0.782	74%	0.743	S	S	*	*			trans	-91.1	71.7	137.8	-175	0	0	0	0	107.3	I14	V12-I14 HydrophobicContact CG1-CG1 4.26Å; V12-I14 PolarHBondContact O-N 3.23Å
13	T	39	Very low	44.5	Very low	92 Å²	92	132 Å²	132	56%	0.564	74%	0.741	S	S	*	*			trans	-75.7	94.3	177	-40.7	0	0	0	0	107.7	N11 N15	N11-T13 PolarHBondContact O-N 2.9Å; T13-N15 WeakPolarHBondContact CG2-OD1 3.25Å; T13-N15 PolarHBondContact O-N 3.38Å
14	I	43.1	Very low	45.6	Very low	131 Å²	131	129.6 Å²	129.6	67%	0.672	75%	0.746	S	S	*	*			trans	-68.8	84.3	168.1	-59.8	-178.9	0	0	0	107	V12 I16	V12-I14 HydrophobicContact CG1-CG1 4.26Å; V12-I14 PolarHBondContact O-N 3.23Å; I14-I16 HydrophobicContact CG2-CB 4.35Å; I14-I16 HydrophobicContact CG2-CD1 3.74Å; I14-I16 HydrophobicContact CG2-CG1 3.72Å; I14-I16 PolarHBondContact O-N 2.96Å
15	N	42	Very low	46.6	Very low	133 Å²	133	128 Å²	128	71%	0.711	74%	0.736	S	S	*	*			trans	-72.2	63.5	166	-75.6	-12.2	0	0	0	109.1	T13 A17	T13-N15 WeakPolarHBondContact CG2-OD1 3.25Å; T13-N15 PolarHBondContact O-N 3.38Å; N15-A17 PolarHBondContact O-N 2.7Å; N15-A17 VanDerWaalsContact O-N 3.07Å
16	I	44.1	Very low	47.5	Very low	125 Å²	125	131.8 Å²	131.8	64%	0.641	74%	0.739	S	S	*	*			trans	-75.9	79.4	145.1	-64.3	168.1	0	0	0	103.7	I14 I20	I14-I16 HydrophobicContact CG2-CB 4.35Å; I14-I16 HydrophobicContact CG2-CD1 3.74Å; I14-I16 HydrophobicContact CG2-CG1 3.72Å; I14-I16 PolarHBondContact O-N 2.96Å; I16-I20 HydrophobicContact CG2-CD1 3.88Å
17	A	44.3	Very low	48.5	Very low	65 Å²	65	129 Å²	129	54%	0.537	73%	0.729	S	S	.	*			trans	-75.3	131.2	175.3	0	0	0	0	0	108.1	N15	N15-A17 PolarHBondContact O-N 2.7Å; N15-A17 VanDerWaalsContact O-N 3.07Å
18	D	47.3	Very low	50	Low	137 Å²	137	130 Å²	130	73%	0.733	72%	0.723	S	S	*	*	S	Bend	trans	64.2	142.9	155.7	-45.6	-34.2	0	0	0	118.4	I20	D18-I20 PolarHBondContact O-N 3.04Å; D18-I20 VanDerWaalsContact O-N 3.12Å
19	D	50	Low	52.1	Low	165 Å²	165	129 Å²	129	88%	0.882	71%	0.709	S	S	*	*			trans	56.6	26.6	159.6	-55.6	-14.3	0	0	0	120.5	D21	D19-D21 PolarHBondContact O-N 2.64Å
20	I	57	Low	54.3	Low	122 Å²	122	126.1 Å²	126.1	63%	0.626	69%	0.694	S	S	*	*			trans	-91.1	78.5	157	-52.2	-175.5	0	0	0	109.9	I16 D18 L22	I16-I20 HydrophobicContact CG2-CD1 3.88Å; D18-I20 PolarHBondContact O-N 3.04Å; D18-I20 VanDerWaalsContact O-N 3.12Å; I20-L22 VanDerWaalsContact C-N 3.32Å; I20-L22 HydrophobicContact CG2-CD1 3.96Å; I20-L22 PolarHBondContact O-N 2.88Å
21	D	55.5	Low	56.5	Low	156 Å²	156	125.9 Å²	125.9	83%	0.834	69%	0.69	S	S	*	*			trans	-77	78	178.5	-160.9	11.7	0	0	0	111	D19 P23	D19-D21 PolarHBondContact O-N 2.64Å; D21-P23 VanDerWaalsContact O-CD 3.25Å; D21-P23 WeakPolarHBondContact O-CD 3.39Å
22	L	56.4	Low	58.8	Low	109 Å²	109	127.9 Å²	127.9	57%	0.571	69%	0.687	S	S	*	*			trans	-88.9	104.2	-178.2	-136	82.4	0	0	0	110.9	I20 G24 I25	I20-L22 VanDerWaalsContact C-N 3.32Å; I20-L22 HydrophobicContact CG2-CD1 3.96Å; I20-L22 PolarHBondContact O-N 2.88Å; L22-G24 PolarHBondContact O-N 2.76Å; L22-I25 HydrophobicContact CD2-CD1 3.88Å
23	P	52.4	Low	61.2	Low	130 Å²	130	124.5 Å²	124.5	84%	0.844	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	109	-169.5	27.4	-35.5	0	0	0	112	D21	D21-P23 VanDerWaalsContact O-CD 3.25Å; D21-P23 WeakPolarHBondContact O-CD 3.39Å
24	G	62.7	Low	63.7	Low	75 Å²	75	126.5 Å²	126.5	77%	0.773	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	137	-25.3	171.9	0	0	0	0	0	114.7	L22 R26	L22-G24 PolarHBondContact O-N 2.76Å; G24-R26 PolarHBondContact O-N 3.08Å; G24-R26 VanDerWaalsContact O-N 3.12Å
25	I	61.4	Low	66.1	Low	122 Å²	122	124.6 Å²	124.6	63%	0.626	66%	0.656	S	S	*	*			trans	-82.4	95.7	-179.2	-56.2	179.7	0	0	0	109.6	L22 V27	L22-I25 HydrophobicContact CD2-CD1 3.88Å; I25-V27 PolarHBondContact O-N 3.38Å
26	R	62	Low	68.5	Low	237 Å²	237	120.7 Å²	120.7	89%	0.894	64%	0.642	S	S	*	*			trans	-66.6	93.1	168.2	-88.7	-171.7	169.5	-175.6	-1.9	110.4	G24 P28	G24-R26 PolarHBondContact O-N 3.08Å; G24-R26 VanDerWaalsContact O-N 3.12Å; R26-P28 WeakPolarHBondContact O-CD 3.48Å
27	V	63.7	Low	70.9	Confident	122 Å²	122	123.7 Å²	123.7	74%	0.739	65%	0.645	S	S	*	*			trans	-53.8	121.7	168.5	-175.6	0	0	0	0	108.8	I25 D29	I25-V27 PolarHBondContact O-N 3.38Å; V27-D29 PolarHBondContact O-N 3.19Å
28	P	71.7	Confident	73.3	Confident	85 Å²	85	127.3 Å²	127.3	55%	0.552	65%	0.649	S	S	*	*			trans	-63.8	134.5	178.5	-24.7	35.7	0	0	0	111.6	R26 M30 I33	R26-P28 WeakPolarHBondContact O-CD 3.48Å; P28-M30 PolarHBondContact O-N 3.12Å; P28-I33 HydrophobicContact CB-CD1 3.73Å; P28-I33 HydrophobicContact CB-CG1 4.49Å
29	D	82.9	Confident	75.6	Confident	90 Å²	90	126.8 Å²	126.8	48%	0.481	64%	0.642	S	S	.	*			trans	-55.8	113.9	176.6	169.3	26.5	0	0	0	111.1	V27 K31 R32 I33	V27-D29 PolarHBondContact O-N 3.19Å; D29-K31 PolarHBondContact O-N 2.91Å; D29-K31 WeakPolarHBondContact OD1-CB 3.31Å; D29-K31 PolarHBondContact OD1-N 3.41Å; D29-R32 HydrophobicContact CB-CB 3.96Å; D29-R32 WeakPolarHBondContact O-CB 3.38Å; D29-R32 PolarHBondContact O-N 3.17Å; D29-R32 VanDerWaalsContact O-N 3.16Å; D29-R32 VanDerWaalsContact OD2-CB 3.28Å; D29-R32 WeakPolarHBondContact OD2-CB 3.33Å; D29-R32 PolarHBondContact OD2-N 3.43Å; D29-I33 PolarHBondContact O-N 2.78Å
30	M	86.3	Confident	77.7	Confident	110 Å²	110	127.3 Å²	127.3	54%	0.542	63%	0.632	S	S	.	*	H	α-helix	trans	-65.6	-26.4	-178	-166.4	57.8	63.3	0	0	112.2	P28 I33 K34	P28-M30 PolarHBondContact O-N 3.12Å; M30-I33 HydrophobicContact SD-CB 4.48Å; M30-I33 HydrophobicContact SD-CG2 4.49Å; M30-K34 WeakPolarHBondContact O-CB 3.22Å; M30-K34 WeakPolarHBondContact O-CG 3.27Å; M30-K34 PolarHBondContact O-N 3.38Å
31	K	86.8	Confident	79.6	Confident	160 Å²	160	123.7 Å²	123.7	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-68.5	-47.2	172.9	-61.7	177.4	-178.6	174.1	0	110.1	D29 I33 K34 N35	D29-K31 PolarHBondContact O-N 2.91Å; D29-K31 WeakPolarHBondContact OD1-CB 3.31Å; D29-K31 PolarHBondContact OD1-N 3.41Å; K31-I33 VanDerWaalsContact C-N 3.34Å; K31-I33 PolarHBondContact O-N 3.17Å; K31-K34 PolarHBondContact O-N 3.11Å; K31-N35 WeakPolarHBondContact O-CB 3.06Å; K31-N35 PolarHBondContact O-N 3.19Å
32	R	87.3	Confident	81.5	Confident	191 Å²	191	119.7 Å²	119.7	72%	0.721	60%	0.599	S	S	*	*	H	α-helix	trans	-57.7	-41.3	172.5	-173.7	178.8	-179.7	-163.4	-0.8	112.8	D29 A36	D29-R32 HydrophobicContact CB-CB 3.96Å; D29-R32 WeakPolarHBondContact O-CB 3.38Å; D29-R32 PolarHBondContact O-N 3.17Å; D29-R32 VanDerWaalsContact O-N 3.16Å; D29-R32 VanDerWaalsContact OD2-CB 3.28Å; D29-R32 WeakPolarHBondContact OD2-CB 3.33Å; D29-R32 PolarHBondContact OD2-N 3.43Å; R32-A36 WeakPolarHBondContact O-CB 3.47Å; R32-A36 PolarHBondContact O-N 2.91Å
33	I	89.4	Confident	83.4	Confident	58 Å²	58	120.5 Å²	120.5	30%	0.297	60%	0.599	S	S	.	*	H	α-helix	trans	-64.5	-46.3	174.7	-71	180	0	0	0	111.5	P28 D29 M30 K31 N35 A36 R37	P28-I33 HydrophobicContact CB-CD1 3.73Å; P28-I33 HydrophobicContact CB-CG1 4.49Å; D29-I33 PolarHBondContact O-N 2.78Å; M30-I33 HydrophobicContact SD-CB 4.48Å; M30-I33 HydrophobicContact SD-CG2 4.49Å; K31-I33 VanDerWaalsContact C-N 3.34Å; K31-I33 PolarHBondContact O-N 3.17Å; I33-N35 VanDerWaalsContact C-N 3.34Å; I33-N35 PolarHBondContact O-N 3.49Å; I33-A36 PolarHBondContact O-N 3.12Å; I33-R37 WeakPolarHBondContact O-CG 3.49Å; I33-R37 PolarHBondContact O-N 3.02Å
34	K	91.8	Very high	85.5	Confident	133 Å²	133	118.8 Å²	118.8	58%	0.578	58%	0.583	S	S	*	*	H	α-helix	trans	-63	-39.3	178.2	-74.5	-177.4	178	-169.2	0	111.9	M30 K31 K38	M30-K34 WeakPolarHBondContact O-CB 3.22Å; M30-K34 WeakPolarHBondContact O-CG 3.27Å; M30-K34 PolarHBondContact O-N 3.38Å; K31-K34 PolarHBondContact O-N 3.11Å; K34-K38 PolarHBondContact O-N 3.07Å; K34-K38 VanDerWaalsContact O-N 3.09Å
35	N	92.9	Very high	87.1	Confident	91 Å²	91	121.1 Å²	121.1	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-49.4	173.7	-74.2	1.1	0	0	0	111.9	K31 I33 R37 K38 E39	K31-N35 WeakPolarHBondContact O-CB 3.06Å; K31-N35 PolarHBondContact O-N 3.19Å; I33-N35 VanDerWaalsContact C-N 3.34Å; I33-N35 PolarHBondContact O-N 3.49Å; N35-R37 VanDerWaalsContact C-N 3.28Å; N35-R37 PolarHBondContact O-N 3.35Å; N35-K38 CarbonylContact O-C 2.76Å; N35-K38 WeakPolarHBondContact O-CA 3.43Å; N35-K38 WeakPolarHBondContact O-CB 3.37Å; N35-K38 PolarHBondContact O-N 2.89Å; N35-E39 WeakPolarHBondContact O-CG 3.48Å; N35-E39 PolarHBondContact O-N 3.19Å
36	A	92.9	Very high	88.7	Confident	52 Å²	52	121.6 Å²	121.6	43%	0.43	57%	0.571	S	S	.	*	H	α-helix	trans	-60.2	-35.5	178.7	0	0	0	0	0	113	R32 I33 R40	R32-A36 WeakPolarHBondContact O-CB 3.47Å; R32-A36 PolarHBondContact O-N 2.91Å; I33-A36 PolarHBondContact O-N 3.12Å; A36-R40 WeakPolarHBondContact O-CB 3.4Å; A36-R40 PolarHBondContact O-N 3.12Å
37	R	93.8	Very high	90.3	Very high	187 Å²	187	117.6 Å²	117.6	71%	0.706	56%	0.556	S	S	*	*	H	α-helix	trans	-63.9	-44.1	171.2	-73.5	179.9	179.5	-170.8	0.6	111.7	I33 N35 A41	I33-R37 WeakPolarHBondContact O-CG 3.49Å; I33-R37 PolarHBondContact O-N 3.02Å; N35-R37 VanDerWaalsContact C-N 3.28Å; N35-R37 PolarHBondContact O-N 3.35Å; R37-A41 WeakPolarHBondContact O-CB 3.41Å; R37-A41 PolarHBondContact O-N 3.08Å
38	K	95.2	Very high	91.8	Very high	141 Å²	141	116.6 Å²	116.6	61%	0.613	54%	0.543	S	S	*	.	H	α-helix	trans	-66.1	-41.2	177.9	-173.1	-179.7	179.3	-177.5	0	112.3	K34 N35 A41 N42	K34-K38 PolarHBondContact O-N 3.07Å; K34-K38 VanDerWaalsContact O-N 3.09Å; N35-K38 CarbonylContact O-C 2.76Å; N35-K38 WeakPolarHBondContact O-CA 3.43Å; N35-K38 WeakPolarHBondContact O-CB 3.37Å; N35-K38 PolarHBondContact O-N 2.89Å; K38-A41 PolarHBondContact O-N 3.5Å; K38-N42 PolarHBondContact O-N 3.45Å
39	E	94.7	Very high	92.9	Very high	126 Å²	126	118.3 Å²	118.3	59%	0.589	55%	0.547	S	S	*	.	H	α-helix	trans	-62.6	-49.2	176	-73.4	162.5	-165.3	0	0	111.1	N35 A41 N42 Q43	N35-E39 WeakPolarHBondContact O-CG 3.48Å; N35-E39 PolarHBondContact O-N 3.19Å; E39-A41 VanDerWaalsContact C-N 3.31Å; E39-A41 PolarHBondContact O-N 3.42Å; E39-N42 PolarHBondContact O-N 2.84Å; E39-N42 VanDerWaalsContact O-N 3.16Å; E39-Q43 WeakPolarHBondContact O-CB 3.31Å; E39-Q43 PolarHBondContact O-N 3.12Å
40	R	95.8	Very high	93.4	Very high	177 Å²	177	120.8 Å²	120.8	67%	0.668	55%	0.55	S	S	*	*	H	α-helix	trans	-60	-38.8	173.7	179	173.1	-80.5	-173.9	-6.5	112.2	A36 N42 Q43 L44	A36-R40 WeakPolarHBondContact O-CB 3.4Å; A36-R40 PolarHBondContact O-N 3.12Å; R40-N42 VanDerWaalsContact C-N 3.35Å; R40-Q43 PolarHBondContact O-N 3.23Å; R40-L44 HydrophobicContact CG-CD1 4.25Å; R40-L44 WeakPolarHBondContact O-CG 3.34Å; R40-L44 PolarHBondContact O-N 2.88Å
41	A	96.4	Very high	93.7	Very high	45 Å²	45	117.7 Å²	117.7	37%	0.372	54%	0.536	S	S	.	.	H	α-helix	trans	-67.3	-32.3	176.7	0	0	0	0	0	113.2	R37 K38 E39 K45	R37-A41 WeakPolarHBondContact O-CB 3.41Å; R37-A41 PolarHBondContact O-N 3.08Å; K38-A41 PolarHBondContact O-N 3.5Å; E39-A41 VanDerWaalsContact C-N 3.31Å; E39-A41 PolarHBondContact O-N 3.42Å; A41-K45 WeakPolarHBondContact O-CG 3.28Å; A41-K45 PolarHBondContact O-N 2.87Å
42	N	96.1	Very high	94.1	Very high	73 Å²	73	115.7 Å²	115.7	39%	0.39	53%	0.527	S	S	.	.	H	α-helix	trans	-73.3	-44.9	171.9	-76.3	-2.3	0	0	0	111.4	K38 E39 R40 L44 K45 E46	K38-N42 PolarHBondContact O-N 3.45Å; E39-N42 PolarHBondContact O-N 2.84Å; E39-N42 VanDerWaalsContact O-N 3.16Å; R40-N42 VanDerWaalsContact C-N 3.35Å; N42-L44 VanDerWaalsContact C-N 3.27Å; N42-L44 PolarHBondContact O-N 2.93Å; N42-K45 WeakPolarHBondContact O-CA 3.34Å; N42-K45 WeakPolarHBondContact O-CB 3.45Å; N42-K45 PolarHBondContact O-N 3.45Å; N42-E46 PolarHBondContact O-N 2.9Å
43	Q	95.8	Very high	94.4	Very high	126 Å²	126	112.4 Å²	112.4	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-55.2	-41	176.5	-173.2	-178.5	31.2	0	0	112.1	E39 R40 E46 W47	E39-Q43 WeakPolarHBondContact O-CB 3.31Å; E39-Q43 PolarHBondContact O-N 3.12Å; R40-Q43 PolarHBondContact O-N 3.23Å; Q43-E46 PolarHBondContact O-N 2.97Å; Q43-W47 WeakPolarHBondContact O-CB 3.35Å; Q43-W47 PolarHBondContact O-N 2.81Å
44	L	96.3	Very high	94.3	Very high	94 Å²	94	112.4 Å²	112.4	49%	0.492	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-33.6	175.7	-72.4	169	0	0	0	113	R40 N42 Q48	R40-L44 HydrophobicContact CG-CD1 4.25Å; R40-L44 WeakPolarHBondContact O-CG 3.34Å; R40-L44 PolarHBondContact O-N 2.88Å; N42-L44 VanDerWaalsContact C-N 3.27Å; N42-L44 PolarHBondContact O-N 2.93Å; L44-Q48 VanDerWaalsContact O-CG 3.32Å; L44-Q48 WeakPolarHBondContact O-CG 3.36Å; L44-Q48 PolarHBondContact O-N 3.44Å
45	K	95.8	Very high	94.1	Very high	124 Å²	124	110.8 Å²	110.8	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-70.2	-43.2	174.1	-69.1	169.5	-177.9	176.6	0	111.7	A41 N42 W47 Q48 I49	A41-K45 WeakPolarHBondContact O-CG 3.28Å; A41-K45 PolarHBondContact O-N 2.87Å; N42-K45 WeakPolarHBondContact O-CA 3.34Å; N42-K45 WeakPolarHBondContact O-CB 3.45Å; N42-K45 PolarHBondContact O-N 3.45Å; K45-W47 VanDerWaalsContact C-N 3.32Å; K45-Q48 PolarHBondContact O-N 3.3Å; K45-I49 WeakPolarHBondContact O-CG1 3.38Å; K45-I49 PolarHBondContact O-N 3.01Å
46	E	96.1	Very high	93.9	Very high	132 Å²	132	112.6 Å²	112.6	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-61.2	-42.6	174.9	-71.2	171.4	-166.8	0	0	110.9	N42 Q43 I49 Y50	N42-E46 PolarHBondContact O-N 2.9Å; Q43-E46 PolarHBondContact O-N 2.97Å; E46-I49 PolarHBondContact O-N 3.16Å; E46-Y50 WeakPolarHBondContact O-CB 3.34Å; E46-Y50 PolarHBondContact O-N 3.47Å
47	W	94.9	Very high	93.5	Very high	153 Å²	153	114.4 Å²	114.4	58%	0.58	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-45	173.4	-177.9	84.6	0	0	0	112.5	Q43 K45 I49 Y50 D51	Q43-W47 WeakPolarHBondContact O-CB 3.35Å; Q43-W47 PolarHBondContact O-N 2.81Å; K45-W47 VanDerWaalsContact C-N 3.32Å; W47-I49 VanDerWaalsContact C-N 3.28Å; W47-I49 PolarHBondContact O-N 2.95Å; W47-Y50 PolarHBondContact O-N 2.61Å; W47-D51 WeakPolarHBondContact O-CB 3.34Å; W47-D51 PolarHBondContact O-N 3.32Å
48	Q	95.3	Very high	92.7	Very high	100 Å²	100	107.3 Å²	107.3	47%	0.467	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-31.8	175.3	-76.1	177.3	4	0	0	113.5	L44 K45 K52	L44-Q48 VanDerWaalsContact O-CG 3.32Å; L44-Q48 WeakPolarHBondContact O-CG 3.36Å; L44-Q48 PolarHBondContact O-N 3.44Å; K45-Q48 PolarHBondContact O-N 3.3Å; Q48-K52 WeakPolarHBondContact O-CB 3.36Å; Q48-K52 WeakPolarHBondContact O-CD 3.47Å; Q48-K52 VanDerWaalsContact O-CG 3.25Å; Q48-K52 WeakPolarHBondContact O-CG 3.39Å; Q48-K52 PolarHBondContact O-N 2.92Å
49	I	95.2	Very high	92.2	Very high	122 Å²	122	104.5 Å²	104.5	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-73.2	-41.7	174.7	-67.6	164	0	0	0	110.3	K45 E46 W47 K53	K45-I49 WeakPolarHBondContact O-CG1 3.38Å; K45-I49 PolarHBondContact O-N 3.01Å; E46-I49 PolarHBondContact O-N 3.16Å; W47-I49 VanDerWaalsContact C-N 3.28Å; W47-I49 PolarHBondContact O-N 2.95Å; I49-K53 PolarHBondContact O-N 3.34Å
50	Y	93.7	Very high	91.7	Very high	141 Å²	141	105.5 Å²	105.5	55%	0.553	49%	0.485	S	S	*	.	H	α-helix	trans	-63.8	-49.1	176.5	177.3	-92.7	0	0	0	112.1	E46 W47 K52 K53 M54	E46-Y50 WeakPolarHBondContact O-CB 3.34Å; E46-Y50 PolarHBondContact O-N 3.47Å; W47-Y50 PolarHBondContact O-N 2.61Å; Y50-K52 PolarHBondContact O-N 3.02Å; Y50-K53 WeakPolarHBondContact O-CA 3.3Å; Y50-K53 VanDerWaalsContact O-CB 3.28Å; Y50-K53 WeakPolarHBondContact O-CB 3.49Å; Y50-K53 PolarHBondContact O-N 3.04Å; Y50-M54 HydrophobicContact CD1-CG 3.99Å; Y50-M54 HydrophobicContact CE1-CG 3.52Å; Y50-M54 HydrophobicContact CE1-SD 4.31Å; Y50-M54 HydrophobicContact CE2-CE 4.39Å; Y50-M54 HydrophobicContact CE2-CG 4.2Å; Y50-M54 HydrophobicContact CE2-SD 4.22Å; Y50-M54 WeakPolarHBondContact O-CG 3.33Å; Y50-M54 PolarHBondContact O-N 2.79Å
51	D	92.3	Very high	90.6	Very high	45 Å²	45	99.7 Å²	99.7	24%	0.241	47%	0.467	C	S	.	.	H	α-helix	trans	-57.6	-50.2	177.2	172.5	47.6	0	0	0	111.3	W47 K53 M54 Q55	W47-D51 WeakPolarHBondContact O-CB 3.34Å; W47-D51 PolarHBondContact O-N 3.32Å; D51-K53 PolarHBondContact O-N 3Å; D51-K53 VanDerWaalsContact O-N 3.15Å; D51-M54 PolarHBondContact O-N 2.99Å; D51-Q55 WeakPolarHBondContact O-CG 3.43Å; D51-Q55 PolarHBondContact O-N 2.79Å; D51-Q55 PolarHBondContact OD1-NE2 2.71Å; D51-Q55 PolarHBondContact OD2-NE2 2.74Å
52	K	93.9	Very high	89.4	Confident	119 Å²	119	103.1 Å²	103.1	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-22.3	174	-71.9	173.5	-177.1	174.3	0	114	Q48 Y50 K56	Q48-K52 WeakPolarHBondContact O-CB 3.36Å; Q48-K52 WeakPolarHBondContact O-CD 3.47Å; Q48-K52 VanDerWaalsContact O-CG 3.25Å; Q48-K52 WeakPolarHBondContact O-CG 3.39Å; Q48-K52 PolarHBondContact O-N 2.92Å; Y50-K52 PolarHBondContact O-N 3.02Å; K52-K56 WeakPolarHBondContact O-CD 3.19Å; K52-K56 VanDerWaalsContact O-CG 3.26Å; K52-K56 WeakPolarHBondContact O-CG 3.49Å
53	K	93.9	Very high	88.6	Confident	121 Å²	121	107.2 Å²	107.2	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-75.2	-49	169.2	-175.1	-162.9	167	-157.7	0	110.2	I49 Y50 D51 K56 E57	I49-K53 PolarHBondContact O-N 3.34Å; Y50-K53 WeakPolarHBondContact O-CA 3.3Å; Y50-K53 VanDerWaalsContact O-CB 3.28Å; Y50-K53 WeakPolarHBondContact O-CB 3.49Å; Y50-K53 PolarHBondContact O-N 3.04Å; D51-K53 PolarHBondContact O-N 3Å; D51-K53 VanDerWaalsContact O-N 3.15Å; K53-K56 PolarHBondContact O-N 2.84Å; K53-E57 WeakPolarHBondContact CE-OE2 3.29Å; K53-E57 IonicContact NZ-OE2 2.73Å; K53-E57 WeakPolarHBondContact O-CB 3.5Å; K53-E57 PolarHBondContact O-N 3.34Å
54	M	87.9	Confident	87.7	Confident	59 Å²	59	108.8 Å²	108.8	29%	0.291	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-40.1	-178.9	-65.3	-62	92.6	0	0	112.7	Y50 D51 E57 S58	Y50-M54 HydrophobicContact CD1-CG 3.99Å; Y50-M54 HydrophobicContact CE1-CG 3.52Å; Y50-M54 HydrophobicContact CE1-SD 4.31Å; Y50-M54 HydrophobicContact CE2-CE 4.39Å; Y50-M54 HydrophobicContact CE2-CG 4.2Å; Y50-M54 HydrophobicContact CE2-SD 4.22Å; Y50-M54 WeakPolarHBondContact O-CG 3.33Å; Y50-M54 PolarHBondContact O-N 2.79Å; D51-M54 PolarHBondContact O-N 2.99Å; M54-E57 VanDerWaalsContact CE-OE2 3.25Å; M54-E57 WeakPolarHBondContact CE-OE2 3.41Å; M54-E57 PolarHBondContact O-N 3.17Å; M54-S58 WeakPolarHBondContact O-CB 2.99Å; M54-S58 PolarHBondContact O-N 3.05Å
55	Q	86.4	Confident	86.1	Confident	98 Å²	98	107.5 Å²	107.5	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-59.1	-49	172.6	-69.5	168.9	6.6	0	0	111.3	D51 E57 S58 E59	D51-Q55 WeakPolarHBondContact O-CG 3.43Å; D51-Q55 PolarHBondContact O-N 2.79Å; D51-Q55 PolarHBondContact OD1-NE2 2.71Å; D51-Q55 PolarHBondContact OD2-NE2 2.74Å; Q55-E57 VanDerWaalsContact C-N 3.25Å; Q55-E57 PolarHBondContact O-N 2.81Å; Q55-S58 WeakPolarHBondContact O-CB 3.4Å; Q55-S58 PolarHBondContact O-N 3.21Å; Q55-E59 PolarHBondContact O-N 3.25Å
56	K	89.2	Confident	84.4	Confident	129 Å²	129	105 Å²	105	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-64.9	-27.2	176.1	-72.2	176.1	-176.9	179.7	0	113.4	K52 K53 K60	K52-K56 WeakPolarHBondContact O-CD 3.19Å; K52-K56 VanDerWaalsContact O-CG 3.26Å; K52-K56 WeakPolarHBondContact O-CG 3.49Å; K53-K56 PolarHBondContact O-N 2.84Å; K56-K60 WeakPolarHBondContact O-CB 3.39Å; K56-K60 WeakPolarHBondContact O-CD 3.48Å; K56-K60 WeakPolarHBondContact O-CG 3.25Å; K56-K60 PolarHBondContact O-N 2.8Å; K56-K60 VanDerWaalsContact O-N 3.17Å
57	E	83.9	Confident	82.3	Confident	90 Å²	90	100.3 Å²	100.3	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-76.6	-43.1	175.9	-161.8	152.2	-179.3	0	0	110.6	K53 M54 Q55 K60 L61	K53-E57 WeakPolarHBondContact CE-OE2 3.29Å; K53-E57 IonicContact NZ-OE2 2.73Å; K53-E57 WeakPolarHBondContact O-CB 3.5Å; K53-E57 PolarHBondContact O-N 3.34Å; M54-E57 VanDerWaalsContact CE-OE2 3.25Å; M54-E57 WeakPolarHBondContact CE-OE2 3.41Å; M54-E57 PolarHBondContact O-N 3.17Å; Q55-E57 VanDerWaalsContact C-N 3.25Å; Q55-E57 PolarHBondContact O-N 2.81Å; E57-K60 PolarHBondContact O-N 3.36Å; E57-L61 WeakPolarHBondContact O-CD1 3.37Å; E57-L61 VanDerWaalsContact O-CG 3.31Å; E57-L61 WeakPolarHBondContact O-CG 3.46Å; E57-L61 PolarHBondContact O-N 2.82Å
58	S	78.3	Confident	80.2	Confident	38 Å²	38	96.3 Å²	96.3	27%	0.266	47%	0.472	S	S	.	.	H	α-helix	trans	-57.3	-51	170.1	-177.5	0	0	0	0	112.1	M54 Q55 K60 L61 Q62 P68	M54-S58 WeakPolarHBondContact O-CB 2.99Å; M54-S58 PolarHBondContact O-N 3.05Å; Q55-S58 WeakPolarHBondContact O-CB 3.4Å; Q55-S58 PolarHBondContact O-N 3.21Å; S58-K60 VanDerWaalsContact C-N 3.35Å; S58-K60 PolarHBondContact O-N 3.43Å; S58-L61 WeakPolarHBondContact O-CB 3.18Å; S58-L61 PolarHBondContact O-N 3.09Å; S58-L61 VanDerWaalsContact O-N 3.16Å; S58-Q62 WeakPolarHBondContact O-CG 3.44Å; S58-Q62 PolarHBondContact O-N 3.43Å; S58-Q62 PolarHBondContact OG-NE2 3.04Å; S58-P68 VanDerWaalsContact OG-CG 3.23Å; S58-P68 WeakPolarHBondContact OG-CG 3.38Å
59	E	83.7	Confident	78.1	Confident	83 Å²	83	94.9 Å²	94.9	39%	0.388	47%	0.468	S	S	.	.	H	α-helix	trans	-56.9	-44	174.6	-79.3	-175.4	-119	0	0	112.8	Q55 L61 Q62 K63	Q55-E59 PolarHBondContact O-N 3.25Å; E59-L61 PolarHBondContact O-N 3.5Å; E59-Q62 PolarHBondContact O-N 2.98Å; E59-K63 VanDerWaalsContact O-CB 3.28Å; E59-K63 WeakPolarHBondContact O-CB 3.44Å; E59-K63 WeakPolarHBondContact O-CD 3.3Å; E59-K63 VanDerWaalsContact O-CG 3.25Å; E59-K63 WeakPolarHBondContact O-CG 3.48Å; E59-K63 PolarHBondContact O-N 3.05Å; E59-K63 IonicContact OE2-NZ 3.99Å; E59-K63 PolarHBondContact OE2-NZ 3.44Å
60	K	84	Confident	75.7	Confident	146 Å²	146	92.4 Å²	92.4	64%	0.635	46%	0.456	S	S	*	.	H	α-helix	trans	-65.8	-29.1	179.7	-82.1	170.6	-176.7	178.8	0	112.6	K56 E57 S58 K64	K56-K60 WeakPolarHBondContact O-CB 3.39Å; K56-K60 WeakPolarHBondContact O-CD 3.48Å; K56-K60 WeakPolarHBondContact O-CG 3.25Å; K56-K60 PolarHBondContact O-N 2.8Å; K56-K60 VanDerWaalsContact O-N 3.17Å; E57-K60 PolarHBondContact O-N 3.36Å; S58-K60 VanDerWaalsContact C-N 3.35Å; S58-K60 PolarHBondContact O-N 3.43Å; K60-K64 WeakPolarHBondContact O-CD 3.28Å; K60-K64 WeakPolarHBondContact O-CG 3.37Å
61	L	73.2	Confident	73.4	Confident	55 Å²	55	89.5 Å²	89.5	29%	0.288	45%	0.45	S	S	.	.	H	α-helix	trans	-73.4	-55.6	172.3	-68.6	162.1	0	0	0	108.7	E57 S58 E59 K63 K64 L66 P68	E57-L61 WeakPolarHBondContact O-CD1 3.37Å; E57-L61 VanDerWaalsContact O-CG 3.31Å; E57-L61 WeakPolarHBondContact O-CG 3.46Å; E57-L61 PolarHBondContact O-N 2.82Å; S58-L61 WeakPolarHBondContact O-CB 3.18Å; S58-L61 PolarHBondContact O-N 3.09Å; S58-L61 VanDerWaalsContact O-N 3.16Å; E59-L61 PolarHBondContact O-N 3.5Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.31Å; L61-K64 WeakPolarHBondContact O-CA 3.46Å; L61-K64 WeakPolarHBondContact O-CB 3.4Å; L61-K64 PolarHBondContact O-N 3.12Å; L61-L66 CarbonylContact C-O 3.59Å; L61-L66 WeakPolarHBondContact CA-O 3.16Å; L61-L66 HydrophobicContact CB-CB 4.4Å; L61-L66 WeakPolarHBondContact CB-O 3.35Å; L61-L66 HydrophobicContact CD2-CB 4.25Å; L61-L66 HydrophobicContact CD2-CD1 4.34Å; L61-L66 CarbonylContact O-C 3.55Å; L61-L66 PolarHBondContact O-N 2.87Å; L61-P68 HydrophobicContact CD1-CB 4.27Å
62	Q	72.1	Confident	71.3	Confident	118 Å²	118	97.7 Å²	97.7	55%	0.551	48%	0.477	S	S	*	.	H	α-helix	trans	-52.5	-45.5	-179.6	-69	176	20	0	0	112.3	S58 E59 K64 G65 L66 P68	S58-Q62 WeakPolarHBondContact O-CG 3.44Å; S58-Q62 PolarHBondContact O-N 3.43Å; S58-Q62 PolarHBondContact OG-NE2 3.04Å; E59-Q62 PolarHBondContact O-N 2.98Å; Q62-K64 PolarHBondContact O-N 2.74Å; Q62-K64 VanDerWaalsContact O-N 3.11Å; Q62-G65 PolarHBondContact O-N 3.42Å; Q62-L66 WeakPolarHBondContact CA-O 3.14Å; Q62-L66 PolarHBondContact N-O 2.78Å; Q62-L66 VanDerWaalsContact N-O 3.12Å; Q62-P68 HydrophobicContact CG-CG 4.39Å
63	K	79.5	Confident	69.1	Low	159 Å²	159	101.7 Å²	101.7	69%	0.691	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-10.4	177.7	-72.2	165.6	179.1	168.8	0	114.5	E59 L61	E59-K63 VanDerWaalsContact O-CB 3.28Å; E59-K63 WeakPolarHBondContact O-CB 3.44Å; E59-K63 WeakPolarHBondContact O-CD 3.3Å; E59-K63 VanDerWaalsContact O-CG 3.25Å; E59-K63 WeakPolarHBondContact O-CG 3.48Å; E59-K63 PolarHBondContact O-N 3.05Å; E59-K63 IonicContact OE2-NZ 3.99Å; E59-K63 PolarHBondContact OE2-NZ 3.44Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.31Å
64	K	76.9	Confident	66.9	Low	158 Å²	158	101.2 Å²	101.2	69%	0.687	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	5	171.8	-69.2	176.3	176.7	-174.3	0	113.5	K60 L61 Q62 L66	K60-K64 WeakPolarHBondContact O-CD 3.28Å; K60-K64 WeakPolarHBondContact O-CG 3.37Å; L61-K64 WeakPolarHBondContact O-CA 3.46Å; L61-K64 WeakPolarHBondContact O-CB 3.4Å; L61-K64 PolarHBondContact O-N 3.12Å; Q62-K64 PolarHBondContact O-N 2.74Å; Q62-K64 VanDerWaalsContact O-N 3.11Å; K64-L66 HydrophobicContact CB-CB 4.46Å; K64-L66 HydrophobicContact CB-CD1 4.04Å; K64-L66 HydrophobicContact CB-CG 4.16Å; K64-L66 HydrophobicContact CD-CD1 4.19Å; K64-L66 PolarHBondContact O-N 2.84Å
65	G	62.9	Low	64.8	Low	67 Å²	67	103.7 Å²	103.7	69%	0.691	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	10.2	-168.7	0	0	0	0	0	113.5	Q62	Q62-G65 PolarHBondContact O-N 3.42Å
66	L	58.4	Low	62.9	Low	71 Å²	71	104.4 Å²	104.4	37%	0.372	50%	0.502	S	S	.	.			trans	-93.8	114.8	172.4	-64.9	168.4	0	0	0	106.8	L61 Q62 K64 N70	L61-L66 CarbonylContact C-O 3.59Å; L61-L66 WeakPolarHBondContact CA-O 3.16Å; L61-L66 HydrophobicContact CB-CB 4.4Å; L61-L66 WeakPolarHBondContact CB-O 3.35Å; L61-L66 HydrophobicContact CD2-CB 4.25Å; L61-L66 HydrophobicContact CD2-CD1 4.34Å; L61-L66 CarbonylContact O-C 3.55Å; L61-L66 PolarHBondContact O-N 2.87Å; Q62-L66 WeakPolarHBondContact CA-O 3.14Å; Q62-L66 PolarHBondContact N-O 2.78Å; Q62-L66 VanDerWaalsContact N-O 3.12Å; K64-L66 HydrophobicContact CB-CB 4.46Å; K64-L66 HydrophobicContact CB-CD1 4.04Å; K64-L66 HydrophobicContact CB-CG 4.16Å; K64-L66 HydrophobicContact CD-CD1 4.19Å; K64-L66 PolarHBondContact O-N 2.84Å; L66-N70 HydrophobicContact CB-CB 4.08Å; L66-N70 HydrophobicContact CD2-CB 3.92Å
67	S	52.7	Low	61.1	Low	34 Å²	34	101.2 Å²	101.2	24%	0.238	50%	0.496	C	S	.	.			trans	-58	156.7	165.2	74.4	0	0	0	0	109.3	L69 N70	S67-L69 PolarHBondContact O-N 3.47Å; S67-L69 WeakPolarHBondContact OG-CB 3.48Å; S67-L69 PolarHBondContact OG-N 3.25Å; S67-N70 WeakPolarHBondContact CB-OD1 3.3Å; S67-N70 VanDerWaalsContact N-CG 3.28Å; S67-N70 PolarHBondContact N-OD1 2.62Å; S67-N70 WeakPolarHBondContact O-CB 3.3Å; S67-N70 PolarHBondContact O-N 2.88Å; S67-N70 PolarHBondContact OG-N 3.32Å; S67-N70 VanDerWaalsContact OG-N 3.15Å; S67-N70 PolarHBondContact OG-OD1 2.93Å
68	P	51.2	Low	59.7	Low	69 Å²	69	100.1 Å²	100.1	45%	0.448	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-12.5	169.8	-23.9	34.5	0	0	0	113.6	S58 L61 Q62	S58-P68 VanDerWaalsContact OG-CG 3.23Å; S58-P68 WeakPolarHBondContact OG-CG 3.38Å; L61-P68 HydrophobicContact CD1-CB 4.27Å; Q62-P68 HydrophobicContact CG-CG 4.39Å
69	L	50.1	Low	58.8	Low	71 Å²	71	106.7 Å²	106.7	37%	0.372	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	1.1	176.8	-63.2	163.3	0	0	0	113.5	S67 D71 Y75	S67-L69 PolarHBondContact O-N 3.47Å; S67-L69 WeakPolarHBondContact OG-CB 3.48Å; S67-L69 PolarHBondContact OG-N 3.25Å; L69-D71 VanDerWaalsContact C-N 3.25Å; L69-D71 CarbonylContact O-C 3.59Å; L69-D71 PolarHBondContact O-N 2.93Å; L69-Y75 HydrophobicContact CB-CD2 4.03Å; L69-Y75 WeakPolarHBondContact O-CA 3.5Å; L69-Y75 WeakPolarHBondContact O-CB 3.38Å; L69-Y75 PolarHBondContact O-N 3Å
70	N	46.3	Very low	58.2	Low	70 Å²	70	106.3 Å²	106.3	37%	0.374	53%	0.528	S	S	.	.			trans	-71.7	3.1	-165.8	-103.2	42.8	0	0	0	117.3	L66 S67 R72	L66-N70 HydrophobicContact CB-CB 4.08Å; L66-N70 HydrophobicContact CD2-CB 3.92Å; S67-N70 WeakPolarHBondContact CB-OD1 3.3Å; S67-N70 VanDerWaalsContact N-CG 3.28Å; S67-N70 PolarHBondContact N-OD1 2.62Å; S67-N70 WeakPolarHBondContact O-CB 3.3Å; S67-N70 PolarHBondContact O-N 2.88Å; S67-N70 PolarHBondContact OG-N 3.32Å; S67-N70 VanDerWaalsContact OG-N 3.15Å; S67-N70 PolarHBondContact OG-OD1 2.93Å; N70-R72 PolarHBondContact O-N 3.12Å
71	D	45.9	Very low	58.3	Low	80 Å²	80	104.5 Å²	104.5	43%	0.428	53%	0.529	S	S	.	.	S	Bend	trans	-65.9	119	152.2	-174.8	-14.4	0	0	0	106.7	L69 R73 H74 Y75	L69-D71 VanDerWaalsContact C-N 3.25Å; L69-D71 CarbonylContact O-C 3.59Å; L69-D71 PolarHBondContact O-N 2.93Å; D71-R73 PolarHBondContact O-N 2.9Å; D71-R73 WeakPolarHBondContact OD1-CB 3.47Å; D71-R73 VanDerWaalsContact OD1-CG 3.29Å; D71-R73 WeakPolarHBondContact OD1-CG 3.47Å; D71-R73 PolarHBondContact OD1-N 3.36Å; D71-R73 IonicContact OD1-NE 3.93Å; D71-R73 IonicContact OD2-NE 3.86Å; D71-H74 WeakPolarHBondContact O-CA 3.42Å; D71-H74 PolarHBondContact O-N 2.8Å; D71-Y75 PolarHBondContact O-N 3.32Å
72	R	48	Very low	58.9	Low	217 Å²	217	109.9 Å²	109.9	82%	0.819	55%	0.551	S	S	*	*	H	α-helix	trans	-55	-20.8	-179.6	-72	-177.6	173.5	177.9	-2.9	113	N70	N70-R72 PolarHBondContact O-N 3.12Å
73	R	47.5	Very low	59.8	Low	203 Å²	203	110.3 Å²	110.3	77%	0.766	55%	0.551	S	S	*	*	H	α-helix	trans	-66.3	-40.3	170.2	-57.3	173.7	-144	-131.4	2.4	112.7	D71 S77	D71-R73 PolarHBondContact O-N 2.9Å; D71-R73 WeakPolarHBondContact OD1-CB 3.47Å; D71-R73 VanDerWaalsContact OD1-CG 3.29Å; D71-R73 WeakPolarHBondContact OD1-CG 3.47Å; D71-R73 PolarHBondContact OD1-N 3.36Å; D71-R73 IonicContact OD1-NE 3.93Å; D71-R73 IonicContact OD2-NE 3.86Å; R73-S77 PolarHBondContact O-N 3.19Å
74	H	47.6	Very low	60.5	Low	110 Å²	110	106.5 Å²	106.5	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-91.1	-30.4	-178	-75.3	-64.3	0	0	0	113.8	D71 N76 S77 S78	D71-H74 WeakPolarHBondContact O-CA 3.42Å; D71-H74 PolarHBondContact O-N 2.8Å; H74-N76 VanDerWaalsContact C-N 3.28Å; H74-N76 PolarHBondContact O-N 3.04Å; H74-S77 WeakPolarHBondContact O-CA 3.43Å; H74-S77 WeakPolarHBondContact O-CB 3.32Å; H74-S77 PolarHBondContact O-N 3.36Å; H74-S78 PolarHBondContact O-N 3.38Å; H74-S78 VanDerWaalsContact O-N 3.07Å
75	Y	43	Very low	61.3	Low	112 Å²	112	103.3 Å²	103.3	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-60.4	-38.2	171.5	-166.2	-96.8	0	0	0	112.4	L69 D71 S77 S78	L69-Y75 HydrophobicContact CB-CD2 4.03Å; L69-Y75 WeakPolarHBondContact O-CA 3.5Å; L69-Y75 WeakPolarHBondContact O-CB 3.38Å; L69-Y75 PolarHBondContact O-N 3Å; D71-Y75 PolarHBondContact O-N 3.32Å; Y75-S77 VanDerWaalsContact C-N 3.32Å; Y75-S78 PolarHBondContact O-OG 3.47Å
76	N	47.2	Very low	62.7	Low	113 Å²	113	102.5 Å²	102.5	60%	0.604	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.8	171.3	-73.5	-5.3	0	0	0	112.5	H74 R79 A80	H74-N76 VanDerWaalsContact C-N 3.28Å; H74-N76 PolarHBondContact O-N 3.04Å; N76-R79 CarbonylContact O-C 3.59Å; N76-R79 PolarHBondContact O-N 3Å; N76-A80 PolarHBondContact O-N 2.93Å; N76-A80 VanDerWaalsContact O-N 3.11Å
77	S	51.4	Low	64.5	Low	62 Å²	62	103.2 Å²	103.2	43%	0.434	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-32.1	-179.9	-167.9	0	0	0	0	113.5	R73 H74 Y75 R79 A80	R73-S77 PolarHBondContact O-N 3.19Å; H74-S77 WeakPolarHBondContact O-CA 3.43Å; H74-S77 WeakPolarHBondContact O-CB 3.32Å; H74-S77 PolarHBondContact O-N 3.36Å; Y75-S77 VanDerWaalsContact C-N 3.32Å; S77-R79 PolarHBondContact O-N 2.93Å; S77-A80 WeakPolarHBondContact O-CB 3.3Å; S77-A80 PolarHBondContact O-N 2.93Å; S77-A80 VanDerWaalsContact O-N 3.15Å
78	S	54.4	Low	66.5	Low	67 Å²	67	103.4 Å²	103.4	47%	0.469	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.3	172.1	58.8	0	0	0	0	112.6	H74 Y75	H74-S78 PolarHBondContact O-N 3.38Å; H74-S78 VanDerWaalsContact O-N 3.07Å; Y75-S78 PolarHBondContact O-OG 3.47Å
79	R	58.4	Low	68.7	Low	176 Å²	176	100.1 Å²	100.1	66%	0.664	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	3	169.9	-75.9	-177.5	164	-167.7	-5.6	114	N76 S77 K82	N76-R79 CarbonylContact O-C 3.59Å; N76-R79 PolarHBondContact O-N 3Å; S77-R79 PolarHBondContact O-N 2.93Å; R79-K82 WeakPolarHBondContact O-CE 3.47Å
80	A	72.8	Confident	71	Confident	75 Å²	75	98.5 Å²	98.5	62%	0.62	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-26.9	-179.3	0	0	0	0	0	113	N76 S77	N76-A80 PolarHBondContact O-N 2.93Å; N76-A80 VanDerWaalsContact O-N 3.11Å; S77-A80 WeakPolarHBondContact O-CB 3.3Å; S77-A80 PolarHBondContact O-N 2.93Å; S77-A80 VanDerWaalsContact O-N 3.15Å
81	V	85.6	Confident	73.4	Confident	108 Å²	108	100 Å²	100	66%	0.655	49%	0.49	S	S	*	.			trans	-88.3	127.6	163.6	-176.3	0	0	0	0	107.5	F83	V81-F83 HydrophobicContact CG1-CE2 4.5Å; V81-F83 HydrophobicContact CG1-CZ 4.47Å
82	K	85.8	Confident	75.8	Confident	168 Å²	168	96.1 Å²	96.1	73%	0.73	47%	0.469	S	S	*	.			trans	-141.3	147.8	173	-65.5	-173.3	177.7	-172.2	0	108.6	R79	R79-K82 WeakPolarHBondContact O-CE 3.47Å
83	F	91.5	Very high	78.1	Confident	127 Å²	127	86.2 Å²	86.2	56%	0.557	43%	0.434	S	S	*	.			trans	-100.8	160.9	169.4	-61.8	-77.5	0	0	0	110	V81 L87 I88	V81-F83 HydrophobicContact CG1-CE2 4.5Å; V81-F83 HydrophobicContact CG1-CZ 4.47Å; F83-L87 HydrophobicContact CB-CD2 4.18Å; F83-L87 HydrophobicContact CG-CD2 4.38Å; F83-I88 HydrophobicContact CB-CD1 4.15Å; F83-I88 HydrophobicContact CB-CG1 3.88Å
84	P	93.1	Very high	80.4	Confident	78 Å²	78	79.4 Å²	79.4	51%	0.506	42%	0.421	S	S	.	.			trans	-55.8	141.8	168.9	-23.5	34.9	0	0	0	110.8	S86 L87 I88	P84-S86 PolarHBondContact O-N 3.29Å; P84-L87 HydrophobicContact CB-CB 4.43Å; P84-L87 PolarHBondContact O-N 3.29Å; P84-I88 PolarHBondContact O-N 2.72Å; P84-I88 VanDerWaalsContact O-N 3.15Å
85	Q	93	Very high	82.7	Confident	92 Å²	92	79.6 Å²	79.6	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-65.7	-27.5	-175.3	-154.5	64.1	65.6	0	0	112.6	I88 F89 L104 V109	Q85-I88 PolarHBondContact O-N 2.97Å; Q85-F89 WeakPolarHBondContact O-CB 3.36Å; Q85-F89 PolarHBondContact O-N 3.24Å; Q85-L104 HydrophobicContact CG-CD2 4.39Å; Q85-V109 HydrophobicContact CB-CG2 4.41Å; Q85-V109 HydrophobicContact CG-CG2 3.52Å
86	S	93.4	Very high	85.1	Confident	50 Å²	50	75.6 Å²	75.6	35%	0.35	41%	0.41	S	S	.	.	H	α-helix	trans	-58.5	-48.5	169	42.9	0	0	0	0	112.9	P84 F89 L90 V113	P84-S86 PolarHBondContact O-N 3.29Å; S86-F89 PolarHBondContact O-N 3.08Å; S86-L90 WeakPolarHBondContact O-CG 3.43Å; S86-L90 PolarHBondContact O-N 2.97Å; S86-V113 VanDerWaalsContact CB-CG1 3.48Å
87	L	95.1	Very high	87.5	Confident	85 Å²	85	73.1 Å²	73.1	45%	0.445	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-43.1	178.3	-171.6	158.8	0	0	0	111.1	F83 P84 F89 L90 E91	F83-L87 HydrophobicContact CB-CD2 4.18Å; F83-L87 HydrophobicContact CG-CD2 4.38Å; P84-L87 HydrophobicContact CB-CB 4.43Å; P84-L87 PolarHBondContact O-N 3.29Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 2.82Å; L87-L90 PolarHBondContact O-N 2.7Å; L87-E91 VanDerWaalsContact O-CB 3.29Å; L87-E91 WeakPolarHBondContact O-CB 3.48Å; L87-E91 PolarHBondContact O-N 3.27Å
88	I	96.1	Very high	89.7	Confident	38 Å²	38	72.7 Å²	72.7	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-61.8	-39.9	177	-60.1	170.1	0	0	0	110.7	F83 P84 Q85 A92 L104	F83-I88 HydrophobicContact CB-CD1 4.15Å; F83-I88 HydrophobicContact CB-CG1 3.88Å; P84-I88 PolarHBondContact O-N 2.72Å; P84-I88 VanDerWaalsContact O-N 3.15Å; Q85-I88 PolarHBondContact O-N 2.97Å; I88-A92 WeakPolarHBondContact O-CB 3.39Å; I88-A92 PolarHBondContact O-N 3.31Å; I88-L104 HydrophobicContact CG2-CD1 4.07Å
89	F	97.6	Very high	91.8	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-66	-46.8	177.3	168.8	-100.2	0	0	0	113.1	Q85 S86 L87 E91 A92 A93 V101 L104 L105 V109 P111 V113 A121 L137	Q85-F89 WeakPolarHBondContact O-CB 3.36Å; Q85-F89 PolarHBondContact O-N 3.24Å; S86-F89 PolarHBondContact O-N 3.08Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 2.82Å; F89-E91 PolarHBondContact O-N 3.05Å; F89-A92 PolarHBondContact O-N 2.88Å; F89-A93 WeakPolarHBondContact O-CB 3.31Å; F89-A93 PolarHBondContact O-N 3.47Å; F89-V101 HydrophobicContact CE2-CG1 4.03Å; F89-L104 HydrophobicContact CB-CD1 4.05Å; F89-L104 HydrophobicContact CD2-CB 4.31Å; F89-L104 HydrophobicContact CD2-CD1 4.49Å; F89-L105 HydrophobicContact CE2-CD1 4.39Å; F89-L105 HydrophobicContact CE2-CD2 3.65Å; F89-L105 HydrophobicContact CE2-CG 3.88Å; F89-L105 HydrophobicContact CZ-CD2 4.11Å; F89-V109 HydrophobicContact CB-CG1 3.89Å; F89-V109 HydrophobicContact CD1-CG1 4.32Å; F89-V109 HydrophobicContact CD2-CG1 4.1Å; F89-V109 HydrophobicContact CG-CG1 3.85Å; F89-P111 WeakPolarHBondContact CE1-O 3.47Å; F89-V113 HydrophobicContact CD1-CB 4.01Å; F89-V113 HydrophobicContact CD1-CG1 4.3Å; F89-V113 HydrophobicContact CE1-CB 4.19Å; F89-A121 HydrophobicContact CE1-CB 3.74Å; F89-A121 HydrophobicContact CZ-CB 3.89Å; F89-L137 HydrophobicContact CE2-CD2 4.18Å; F89-L137 HydrophobicContact CZ-CD2 3.7Å
90	L	97	Very high	93.6	Very high	38 Å²	38	69 Å²	69	20%	0.199	38%	0.375	C	S	.	.	H	α-helix	trans	-61.4	-43.3	175.6	-70.1	174.1	0	0	0	111.8	S86 L87 A93 A94 V113 N115 A121	S86-L90 WeakPolarHBondContact O-CG 3.43Å; S86-L90 PolarHBondContact O-N 2.97Å; L87-L90 PolarHBondContact O-N 2.7Å; L90-A93 PolarHBondContact O-N 2.95Å; L90-A94 WeakPolarHBondContact O-CB 3.06Å; L90-A94 PolarHBondContact O-N 3.42Å; L90-V113 HydrophobicContact CD1-CG1 3.96Å; L90-V113 HydrophobicContact CD2-CG1 4.23Å; L90-V113 HydrophobicContact CG-CG1 3.88Å; L90-N115 HydrophobicContact CD1-CB 4.31Å; L90-A121 HydrophobicContact CD2-CB 4.46Å
91	E	96.3	Very high	94.8	Very high	100 Å²	100	65.4 Å²	65.4	47%	0.467	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-38.2	176.1	172.1	60.1	-143.4	0	0	112.3	L87 F89 R95	L87-E91 VanDerWaalsContact O-CB 3.29Å; L87-E91 WeakPolarHBondContact O-CB 3.48Å; L87-E91 PolarHBondContact O-N 3.27Å; F89-E91 PolarHBondContact O-N 3.05Å; E91-R95 WeakPolarHBondContact O-CB 3.37Å; E91-R95 WeakPolarHBondContact O-CG 3.47Å; E91-R95 PolarHBondContact O-N 2.82Å; E91-R95 VanDerWaalsContact O-N 3.1Å; E91-R95 PolarHBondContact O-NE 3.03Å; E91-R95 VanDerWaalsContact OE1-CD 3.29Å; E91-R95 WeakPolarHBondContact OE1-CD 3.47Å; E91-R95 IonicContact OE1-NE 2.82Å; E91-R95 PolarHBondContact OE1-NE 2.74Å
92	A	97.2	Very high	95.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-67.7	-39.9	174.3	0	0	0	0	0	112.2	I88 F89 G96 D97 E100 V101 L104	I88-A92 WeakPolarHBondContact O-CB 3.39Å; I88-A92 PolarHBondContact O-N 3.31Å; F89-A92 PolarHBondContact O-N 2.88Å; A92-G96 PolarHBondContact O-N 2.73Å; A92-D97 PolarHBondContact O-N 3.19Å; A92-E100 HydrophobicContact CB-CB 4.21Å; A92-E100 HydrophobicContact CB-CG 3.91Å; A92-V101 HydrophobicContact CB-CG2 3.68Å; A92-L104 HydrophobicContact CB-CD1 4.18Å
93	A	96.9	Very high	96	Very high	8 Å²	8	64.2 Å²	64.2	7%	0.066	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-46.9	175.3	0	0	0	0	0	112.1	F89 L90 R95 G96 V101 A121	F89-A93 WeakPolarHBondContact O-CB 3.31Å; F89-A93 PolarHBondContact O-N 3.47Å; L90-A93 PolarHBondContact O-N 2.95Å; A93-R95 VanDerWaalsContact C-N 3.29Å; A93-R95 PolarHBondContact O-N 3.41Å; A93-G96 WeakPolarHBondContact O-CA 3.1Å; A93-G96 PolarHBondContact O-N 2.7Å; A93-V101 HydrophobicContact CB-CG2 4.22Å; A93-A121 HydrophobicContact CB-CB 3.7Å
94	A	95	Very high	96.2	Very high	60 Å²	60	58.9 Å²	58.9	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-29.2	178.6	0	0	0	0	0	113.4	L90 G96	L90-A94 WeakPolarHBondContact O-CB 3.06Å; L90-A94 PolarHBondContact O-N 3.42Å; A94-G96 VanDerWaalsContact C-N 3.27Å; A94-G96 PolarHBondContact O-N 3.03Å
95	R	95.4	Very high	96.4	Very high	115 Å²	115	55.7 Å²	55.7	43%	0.434	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.1	169.6	-79	-176.8	-75.5	113.8	-4.9	114.4	E91 A93 D97 E100	E91-R95 WeakPolarHBondContact O-CB 3.37Å; E91-R95 WeakPolarHBondContact O-CG 3.47Å; E91-R95 PolarHBondContact O-N 2.82Å; E91-R95 VanDerWaalsContact O-N 3.1Å; E91-R95 PolarHBondContact O-NE 3.03Å; E91-R95 VanDerWaalsContact OE1-CD 3.29Å; E91-R95 WeakPolarHBondContact OE1-CD 3.47Å; E91-R95 IonicContact OE1-NE 2.82Å; E91-R95 PolarHBondContact OE1-NE 2.74Å; A93-R95 VanDerWaalsContact C-N 3.29Å; A93-R95 PolarHBondContact O-N 3.41Å; R95-D97 VanDerWaalsContact C-N 3.3Å; R95-D97 IonicContact NH1-OD2 2.69Å; R95-D97 PolarHBondContact NH1-OD2 2.82Å; R95-E100 IonicContact CZ-OE2 3.12Å; R95-E100 VanDerWaalsContact CZ-OE2 3.24Å; R95-E100 IonicContact NH1-OE2 2.68Å; R95-E100 PolarHBondContact NH1-OE2 3.31Å; R95-E100 IonicContact NH2-OE1 3.7Å; R95-E100 IonicContact NH2-OE2 2.72Å; R95-E100 PolarHBondContact NH2-OE2 3.35Å
96	G	95	Very high	96.6	Very high	28 Å²	28	55 Å²	55	29%	0.289	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	21.2	-171.9	0	0	0	0	0	114.1	A92 A93 A94 L98	A92-G96 PolarHBondContact O-N 2.73Å; A93-G96 WeakPolarHBondContact O-CA 3.1Å; A93-G96 PolarHBondContact O-N 2.7Å; A94-G96 VanDerWaalsContact C-N 3.27Å; A94-G96 PolarHBondContact O-N 3.03Å; G96-L98 PolarHBondContact O-N 2.87Å
97	D	97	Very high	96.7	Very high	60 Å²	60	56.5 Å²	56.5	32%	0.321	30%	0.303	S	S	.	.			trans	-79	82.1	-175.4	-161.4	-39.6	0	0	0	111.4	A92 R95 D99 E100 V101	A92-D97 PolarHBondContact O-N 3.19Å; R95-D97 VanDerWaalsContact C-N 3.3Å; R95-D97 IonicContact NH1-OD2 2.69Å; R95-D97 PolarHBondContact NH1-OD2 2.82Å; D97-D99 PolarHBondContact O-N 2.97Å; D97-D99 VanDerWaalsContact O-N 3.15Å; D97-D99 PolarHBondContact OD1-N 3.06Å; D97-E100 HydrophobicContact CB-CB 4.09Å; D97-E100 PolarHBondContact O-N 3.03Å; D97-E100 WeakPolarHBondContact OD1-CB 3.34Å; D97-E100 PolarHBondContact OD1-N 3.26Å; D97-V101 WeakPolarHBondContact O-CB 3.41Å; D97-V101 VanDerWaalsContact O-CG2 3.29Å; D97-V101 WeakPolarHBondContact O-CG2 3.44Å; D97-V101 PolarHBondContact O-N 3.49Å
98	L	97.4	Very high	96.6	Very high	53 Å²	53	55.7 Å²	55.7	28%	0.277	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-20.5	-177.2	-66.7	170.8	0	0	0	114.2	G96 R102 E132 M133 L136	G96-L98 PolarHBondContact O-N 2.87Å; L98-R102 VanDerWaalsContact O-CB 3.28Å; L98-R102 WeakPolarHBondContact O-CB 3.46Å; L98-R102 PolarHBondContact O-N 2.92Å; L98-R102 PolarHBondContact O-NH2 3.35Å; L98-E132 HydrophobicContact CD1-CB 3.92Å; L98-E132 HydrophobicContact CD2-CB 4.32Å; L98-M133 HydrophobicContact CD2-CB 3.99Å; L98-M133 HydrophobicContact CD2-CE 3.72Å; L98-M133 HydrophobicContact CD2-SD 3.93Å; L98-M133 HydrophobicContact CG-CE 4.29Å; L98-L136 HydrophobicContact CB-CD2 4.39Å; L98-L136 HydrophobicContact CD2-CB 4.46Å; L98-L136 HydrophobicContact CD2-CD2 3.89Å; L98-L136 WeakPolarHBondContact O-CD2 3.09Å
99	D	97.6	Very high	96.6	Very high	106 Å²	106	54.8 Å²	54.8	57%	0.567	31%	0.311	S	S	*	.	H	α-helix	trans	-90.4	-44.9	-179.6	-75	-18.1	0	0	0	110.7	D97 R102 E103	D97-D99 PolarHBondContact O-N 2.97Å; D97-D99 VanDerWaalsContact O-N 3.15Å; D97-D99 PolarHBondContact OD1-N 3.06Å; D99-R102 PolarHBondContact O-N 2.81Å; D99-R102 IonicContact OD1-CZ 2.73Å; D99-R102 IonicContact OD1-NH1 2.58Å; D99-R102 PolarHBondContact OD1-NH1 3.28Å; D99-R102 IonicContact OD1-NH2 3.37Å; D99-R102 PolarHBondContact OD1-NH2 3.13Å; D99-E103 PolarHBondContact O-N 2.61Å
100	E	97.4	Very high	96.5	Very high	59 Å²	59	58.1 Å²	58.1	28%	0.276	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-47	171.9	-173.7	174.9	-161.3	0	0	111	A92 R95 D97 R102 E103 L104	A92-E100 HydrophobicContact CB-CB 4.21Å; A92-E100 HydrophobicContact CB-CG 3.91Å; R95-E100 IonicContact CZ-OE2 3.12Å; R95-E100 VanDerWaalsContact CZ-OE2 3.24Å; R95-E100 IonicContact NH1-OE2 2.68Å; R95-E100 PolarHBondContact NH1-OE2 3.31Å; R95-E100 IonicContact NH2-OE1 3.7Å; R95-E100 IonicContact NH2-OE2 2.72Å; R95-E100 PolarHBondContact NH2-OE2 3.35Å; D97-E100 HydrophobicContact CB-CB 4.09Å; D97-E100 PolarHBondContact O-N 3.03Å; D97-E100 WeakPolarHBondContact OD1-CB 3.34Å; D97-E100 PolarHBondContact OD1-N 3.26Å; E100-R102 PolarHBondContact O-N 2.73Å; E100-E103 PolarHBondContact O-N 2.94Å; E100-E103 VanDerWaalsContact O-N 3.14Å; E100-L104 HydrophobicContact CG-CD1 4.12Å; E100-L104 HydrophobicContact CG-CG 4.41Å; E100-L104 VanDerWaalsContact O-CG 3.28Å; E100-L104 WeakPolarHBondContact O-CG 3.14Å; E100-L104 PolarHBondContact O-N 3.07Å
101	V	98.1	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.3	-39	176	169.7	0	0	0	0	111.5	F89 A92 A93 D97 L104 L105 M133 L136 L137	F89-V101 HydrophobicContact CE2-CG1 4.03Å; A92-V101 HydrophobicContact CB-CG2 3.68Å; A93-V101 HydrophobicContact CB-CG2 4.22Å; D97-V101 WeakPolarHBondContact O-CB 3.41Å; D97-V101 VanDerWaalsContact O-CG2 3.29Å; D97-V101 WeakPolarHBondContact O-CG2 3.44Å; D97-V101 PolarHBondContact O-N 3.49Å; V101-L104 PolarHBondContact O-N 2.74Å; V101-L105 HydrophobicContact CG1-CD1 3.62Å; V101-L105 HydrophobicContact CG1-CG 4.25Å; V101-L105 WeakPolarHBondContact O-CB 3.11Å; V101-L105 WeakPolarHBondContact O-CD1 3.4Å; V101-L105 VanDerWaalsContact O-CG 3.24Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.49Å; V101-M133 HydrophobicContact CB-CE 4.42Å; V101-M133 HydrophobicContact CB-SD 4.2Å; V101-M133 HydrophobicContact CG1-SD 3.87Å; V101-M133 HydrophobicContact CG2-CE 3.94Å; V101-M133 HydrophobicContact CG2-SD 4.06Å; V101-L136 HydrophobicContact CB-CD2 4.19Å; V101-L136 HydrophobicContact CG1-CD2 3.81Å; V101-L137 HydrophobicContact CG1-CD2 4.47Å
102	R	98.1	Very high	96.6	Very high	98 Å²	98	55 Å²	55	37%	0.37	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-37.3	177.9	-166.9	-174.2	-43.8	117.1	19.2	112.8	L98 D99 E100 S106 L136 Y140	L98-R102 VanDerWaalsContact O-CB 3.28Å; L98-R102 WeakPolarHBondContact O-CB 3.46Å; L98-R102 PolarHBondContact O-N 2.92Å; L98-R102 PolarHBondContact O-NH2 3.35Å; D99-R102 PolarHBondContact O-N 2.81Å; D99-R102 IonicContact OD1-CZ 2.73Å; D99-R102 IonicContact OD1-NH1 2.58Å; D99-R102 PolarHBondContact OD1-NH1 3.28Å; D99-R102 IonicContact OD1-NH2 3.37Å; D99-R102 PolarHBondContact OD1-NH2 3.13Å; E100-R102 PolarHBondContact O-N 2.73Å; R102-S106 WeakPolarHBondContact O-CB 3.46Å; R102-S106 PolarHBondContact O-N 3.34Å; R102-S106 PolarHBondContact O-OG 3.45Å; R102-L136 HydrophobicContact CB-CD1 4.27Å; R102-L136 HydrophobicContact CB-CD2 4.37Å; R102-L136 HydrophobicContact CG-CD1 4.15Å; R102-Y140 HydrophobicContact CG-CE2 4.2Å; R102-Y140 WeakPolarHBondContact CG-OH 3.33Å
103	E	97.1	Very high	96.5	Very high	153 Å²	153	56.2 Å²	56.2	72%	0.715	33%	0.329	S	S	*	.	H	α-helix	trans	-64	-45	172.2	-173.3	174.2	162.1	0	0	110.6	D99 E100 S106 S107	D99-E103 PolarHBondContact O-N 2.61Å; E100-E103 PolarHBondContact O-N 2.94Å; E100-E103 VanDerWaalsContact O-N 3.14Å; E103-S106 CarbonylContact O-C 3.56Å; E103-S106 PolarHBondContact O-N 3.48Å; E103-S107 WeakPolarHBondContact O-CB 3.43Å; E103-S107 PolarHBondContact O-N 3.25Å
104	L	96.9	Very high	96.5	Very high	16 Å²	16	57.9 Å²	57.9	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-48.3	179.8	-66.9	178.5	0	0	0	112.6	Q85 I88 F89 A92 E100 V101 S106 S107 G108 V109	Q85-L104 HydrophobicContact CG-CD2 4.39Å; I88-L104 HydrophobicContact CG2-CD1 4.07Å; F89-L104 HydrophobicContact CB-CD1 4.05Å; F89-L104 HydrophobicContact CD2-CB 4.31Å; F89-L104 HydrophobicContact CD2-CD1 4.49Å; A92-L104 HydrophobicContact CB-CD1 4.18Å; E100-L104 HydrophobicContact CG-CD1 4.12Å; E100-L104 HydrophobicContact CG-CG 4.41Å; E100-L104 VanDerWaalsContact O-CG 3.28Å; E100-L104 WeakPolarHBondContact O-CG 3.14Å; E100-L104 PolarHBondContact O-N 3.07Å; V101-L104 PolarHBondContact O-N 2.74Å; L104-S106 VanDerWaalsContact C-N 3.33Å; L104-S106 PolarHBondContact O-N 3.4Å; L104-S107 WeakPolarHBondContact O-CB 3.22Å; L104-S107 PolarHBondContact O-N 2.76Å; L104-S107 VanDerWaalsContact O-N 3.09Å; L104-S107 PolarHBondContact O-OG 3.32Å; L104-G108 PolarHBondContact O-N 3.34Å; L104-V109 HydrophobicContact CB-CG2 4.19Å; L104-V109 WeakPolarHBondContact O-CB 3.4Å; L104-V109 WeakPolarHBondContact O-CG2 3.28Å; L104-V109 PolarHBondContact O-N 2.93Å
105	L	97.2	Very high	96.5	Very high	11 Å²	11	58.1 Å²	58.1	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-41.3	174.7	-68	165.2	0	0	0	111.4	F89 V101 S107 G108 P111 L136 L137 Y140	F89-L105 HydrophobicContact CE2-CD1 4.39Å; F89-L105 HydrophobicContact CE2-CD2 3.65Å; F89-L105 HydrophobicContact CE2-CG 3.88Å; F89-L105 HydrophobicContact CZ-CD2 4.11Å; V101-L105 HydrophobicContact CG1-CD1 3.62Å; V101-L105 HydrophobicContact CG1-CG 4.25Å; V101-L105 WeakPolarHBondContact O-CB 3.11Å; V101-L105 WeakPolarHBondContact O-CD1 3.4Å; V101-L105 VanDerWaalsContact O-CG 3.24Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.49Å; L105-S107 PolarHBondContact O-N 3.21Å; L105-G108 PolarHBondContact O-N 3.48Å; L105-P111 HydrophobicContact CD2-CB 3.84Å; L105-L136 HydrophobicContact CD1-CG 4.36Å; L105-L137 HydrophobicContact CD1-CD2 4.33Å; L105-Y140 HydrophobicContact CB-CD1 3.51Å; L105-Y140 HydrophobicContact CB-CD2 4.32Å; L105-Y140 HydrophobicContact CB-CE1 3.84Å; L105-Y140 HydrophobicContact CB-CG 3.75Å; L105-Y140 HydrophobicContact CD1-CD2 3.98Å; L105-Y140 HydrophobicContact CD1-CG 3.92Å; L105-Y140 HydrophobicContact CG-CG 4.32Å
106	S	96.8	Very high	96.4	Very high	77 Å²	77	61.3 Å²	61.3	54%	0.538	36%	0.355	S	S	.	.	H	α-helix	trans	-66.8	-21.1	175.4	-56.1	0	0	0	0	113.5	R102 E103 L104 G108 Y140	R102-S106 WeakPolarHBondContact O-CB 3.46Å; R102-S106 PolarHBondContact O-N 3.34Å; R102-S106 PolarHBondContact O-OG 3.45Å; E103-S106 CarbonylContact O-C 3.56Å; E103-S106 PolarHBondContact O-N 3.48Å; L104-S106 VanDerWaalsContact C-N 3.33Å; L104-S106 PolarHBondContact O-N 3.4Å; S106-G108 VanDerWaalsContact C-N 3.3Å; S106-Y140 PolarHBondContact OG-OH 3.48Å
107	S	95.1	Very high	96.3	Very high	82 Å²	82	64.1 Å²	64.1	57%	0.573	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.7	173.1	80.6	0	0	0	0	114	E103 L104 L105	E103-S107 WeakPolarHBondContact O-CB 3.43Å; E103-S107 PolarHBondContact O-N 3.25Å; L104-S107 WeakPolarHBondContact O-CB 3.22Å; L104-S107 PolarHBondContact O-N 2.76Å; L104-S107 VanDerWaalsContact O-N 3.09Å; L104-S107 PolarHBondContact O-OG 3.32Å; L105-S107 PolarHBondContact O-N 3.21Å
108	G	94.3	Very high	96.2	Very high	67 Å²	67	62 Å²	62	69%	0.691	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	21.1	-179.9	0	0	0	0	0	114.9	L104 L105 S106	L104-G108 PolarHBondContact O-N 3.34Å; L105-G108 PolarHBondContact O-N 3.48Å; S106-G108 VanDerWaalsContact C-N 3.3Å
109	V	95.6	Very high	96.2	Very high	19 Å²	19	61.5 Å²	61.5	12%	0.115	35%	0.354	C	S	.	.			trans	-69.2	133	167.1	-179.6	0	0	0	0	109.1	Q85 F89 L104	Q85-V109 HydrophobicContact CB-CG2 4.41Å; Q85-V109 HydrophobicContact CG-CG2 3.52Å; F89-V109 HydrophobicContact CB-CG1 3.89Å; F89-V109 HydrophobicContact CD1-CG1 4.32Å; F89-V109 HydrophobicContact CD2-CG1 4.1Å; F89-V109 HydrophobicContact CG-CG1 3.85Å; L104-V109 HydrophobicContact CB-CG2 4.19Å; L104-V109 WeakPolarHBondContact O-CB 3.4Å; L104-V109 WeakPolarHBondContact O-CG2 3.28Å; L104-V109 PolarHBondContact O-N 2.93Å
110	C	95.8	Very high	96.2	Very high	70 Å²	70	56.8 Å²	56.8	47%	0.473	33%	0.329	S	S	.	.			trans	-66.7	130.5	175.9	-177	0	0	0	0	110.2	D112 V113	C110-D112 VanDerWaalsContact C-N 3.26Å; C110-D112 PolarHBondContact O-N 2.83Å; C110-V113 HydrophobicContact CB-CG2 4.36Å; C110-V113 WeakPolarHBondContact O-CG2 3.43Å
111	P	96.7	Very high	96.2	Very high	15 Å²	15	54.1 Å²	54.1	10%	0.097	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.8	177.6	26.1	-33.9	0	0	0	113.1	F89 L105 V113 A142	F89-P111 WeakPolarHBondContact CE1-O 3.47Å; L105-P111 HydrophobicContact CD2-CB 3.84Å; P111-V113 PolarHBondContact O-N 3.2Å; P111-A142 HydrophobicContact CB-CB 3.76Å; P111-A142 HydrophobicContact CG-CB 4.21Å
112	D	97.1	Very high	96.2	Very high	57 Å²	57	54.1 Å²	54.1	31%	0.305	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	24.8	-176.9	-56	-37.9	0	0	0	113	C110 A142 N143	C110-D112 VanDerWaalsContact C-N 3.26Å; C110-D112 PolarHBondContact O-N 2.83Å; D112-A142 WeakPolarHBondContact OD1-CA 3.37Å; D112-N143 PolarHBondContact OD1-N 3.23Å; D112-N143 WeakPolarHBondContact OD2-CB 3.43Å; D112-N143 PolarHBondContact OD2-N 3.36Å
113	V	95.9	Very high	96.2	Very high	27 Å²	27	49.5 Å²	49.5	16%	0.164	30%	0.3	C	S	.	.			trans	-64.9	132.9	166.3	164.6	0	0	0	0	109.1	S86 F89 L90 C110 P111 T120	S86-V113 VanDerWaalsContact CB-CG1 3.48Å; F89-V113 HydrophobicContact CD1-CB 4.01Å; F89-V113 HydrophobicContact CD1-CG1 4.3Å; F89-V113 HydrophobicContact CE1-CB 4.19Å; L90-V113 HydrophobicContact CD1-CG1 3.96Å; L90-V113 HydrophobicContact CD2-CG1 4.23Å; L90-V113 HydrophobicContact CG-CG1 3.88Å; C110-V113 HydrophobicContact CB-CG2 4.36Å; C110-V113 WeakPolarHBondContact O-CG2 3.43Å; P111-V113 PolarHBondContact O-N 3.2Å; V113-T120 WeakPolarHBondContact O-CA 3.33Å
114	A	96.2	Very high	96.2	Very high	43 Å²	43	45.3 Å²	45.3	36%	0.355	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-117.3	164.6	179.5	0	0	0	0	0	112.9	G118 L119 T120	A114-G118 WeakPolarHBondContact CB-O 3.42Å; A114-L119 VanDerWaalsContact CA-O 3.3Å; A114-L119 WeakPolarHBondContact CA-O 3.33Å; A114-T120 HydrophobicContact CB-CG2 4.17Å
115	N	94.8	Very high	96.2	Very high	65 Å²	65	44.8 Å²	44.8	35%	0.348	28%	0.277	S	S	.	.			trans	-86	-166.6	169.6	77.9	-14.7	0	0	0	112	L90 D117 G118 L119	L90-N115 HydrophobicContact CD1-CB 4.31Å; N115-D117 PolarHBondContact ND2-OD2 3.15Å; N115-D117 PolarHBondContact O-N 3.1Å; N115-D117 WeakPolarHBondContact OD1-CA 3.44Å; N115-D117 PolarHBondContact OD1-N 3.2Å; N115-G118 PolarHBondContact O-N 3.02Å; N115-G118 PolarHBondContact OD1-N 2.89Å; N115-G118 VanDerWaalsContact OD1-N 3.15Å; N115-L119 PolarHBondContact N-O 3.04Å; N115-L119 VanDerWaalsContact N-O 3.08Å; N115-L119 WeakPolarHBondContact OD1-CB 3.46Å; N115-L119 PolarHBondContact OD1-N 2.87Å
116	E	94.7	Very high	96.3	Very high	181 Å²	181	44.2 Å²	44.2	85%	0.846	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-22	177.5	-64.7	-170.6	179.7	0	0	113.4
117	D	93.2	Very high	96.2	Very high	87 Å²	87	44 Å²	44	47%	0.465	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	6.8	179	-36.4	-68.7	0	0	0	112.4	N115 L119 D148 T149	N115-D117 PolarHBondContact ND2-OD2 3.15Å; N115-D117 PolarHBondContact O-N 3.1Å; N115-D117 WeakPolarHBondContact OD1-CA 3.44Å; N115-D117 PolarHBondContact OD1-N 3.2Å; D117-L119 HydrophobicContact CB-CD1 4.37Å; D117-L119 HydrophobicContact CB-CG 4.42Å; D117-L119 PolarHBondContact O-N 3.44Å; D117-D148 WeakPolarHBondContact O-CB 3.41Å; D117-T149 PolarHBondContact O-N 3.47Å; D117-T149 PolarHBondContact O-OG1 2.99Å
118	G	95	Very high	96.3	Very high	17 Å²	17	44.2 Å²	44.2	18%	0.175	26%	0.261	C	S	.	.			trans	78.2	-3.7	-177.7	0	0	0	0	0	115.4	A114 N115 T120	A114-G118 WeakPolarHBondContact CB-O 3.42Å; N115-G118 PolarHBondContact O-N 3.02Å; N115-G118 PolarHBondContact OD1-N 2.89Å; N115-G118 VanDerWaalsContact OD1-N 3.15Å; G118-T120 PolarHBondContact O-N 2.99Å
119	L	96.5	Very high	96.4	Very high	42 Å²	42	44.3 Å²	44.3	22%	0.22	25%	0.246	C	C	.	.			trans	-68.5	118.3	-179.9	-65.4	168.5	0	0	0	111.4	A114 N115 D117 H123 D148	A114-L119 VanDerWaalsContact CA-O 3.3Å; A114-L119 WeakPolarHBondContact CA-O 3.33Å; N115-L119 PolarHBondContact N-O 3.04Å; N115-L119 VanDerWaalsContact N-O 3.08Å; N115-L119 WeakPolarHBondContact OD1-CB 3.46Å; N115-L119 PolarHBondContact OD1-N 2.87Å; D117-L119 HydrophobicContact CB-CD1 4.37Å; D117-L119 HydrophobicContact CB-CG 4.42Å; D117-L119 PolarHBondContact O-N 3.44Å; L119-H123 HydrophobicContact CB-CB 4.44Å; L119-H123 HydrophobicContact CD2-CB 3.83Å; L119-D148 HydrophobicContact CD2-CB 3.94Å; L119-D148 WeakPolarHBondContact CD2-OD2 3.39Å; L119-D148 HydrophobicContact CG-CB 4.33Å
120	T	98	Very high	96.5	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.037	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-83.5	165.5	173.6	67.3	0	0	0	0	112.1	V113 A114 G118 L122 H123 Q124	V113-T120 WeakPolarHBondContact O-CA 3.33Å; A114-T120 HydrophobicContact CB-CG2 4.17Å; G118-T120 PolarHBondContact O-N 2.99Å; T120-L122 PolarHBondContact O-N 3.28Å; T120-L122 VanDerWaalsContact O-N 3.08Å; T120-L122 PolarHBondContact OG1-N 3Å; T120-H123 PolarHBondContact N-ND1 3.09Å; T120-H123 WeakPolarHBondContact O-CB 3.49Å; T120-H123 PolarHBondContact O-N 2.82Å; T120-H123 PolarHBondContact OG1-N 3Å; T120-H123 PolarHBondContact OG1-ND1 3.15Å; T120-Q124 PolarHBondContact O-N 2.99Å
121	A	97.8	Very high	96.6	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-53.6	-28.4	171	0	0	0	0	0	113.3	F89 L90 A93 C125 L137	F89-A121 HydrophobicContact CE1-CB 3.74Å; F89-A121 HydrophobicContact CZ-CB 3.89Å; L90-A121 HydrophobicContact CD2-CB 4.46Å; A93-A121 HydrophobicContact CB-CB 3.7Å; A121-C125 PolarHBondContact O-N 2.97Å; A121-C125 VanDerWaalsContact O-N 3.15Å; A121-L137 HydrophobicContact CB-CD1 3.88Å; A121-L137 HydrophobicContact CB-CD2 4.03Å; A121-L137 WeakPolarHBondContact O-CD1 3.45Å
122	L	98.2	Very high	96.7	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-74.3	-35.7	177.2	-171.6	62.4	0	0	0	112.2	T120 C125 C126 C134 L137 L138 A142 N143 P154 L170	T120-L122 PolarHBondContact O-N 3.28Å; T120-L122 VanDerWaalsContact O-N 3.08Å; T120-L122 PolarHBondContact OG1-N 3Å; L122-C125 PolarHBondContact O-SG 3.04Å; L122-C126 PolarHBondContact O-N 2.94Å; L122-C126 PolarHBondContact O-SG 3.37Å; L122-C134 HydrophobicContact CD1-CB 4.4Å; L122-L137 HydrophobicContact CB-CD1 4.27Å; L122-L137 HydrophobicContact CD1-CB 4.27Å; L122-L137 HydrophobicContact CD1-CD1 4.32Å; L122-L138 HydrophobicContact CD1-CD2 4.37Å; L122-L138 HydrophobicContact CD1-CG 4.17Å; L122-L138 HydrophobicContact CD2-CD2 3.91Å; L122-A142 HydrophobicContact CD2-CB 4.09Å; L122-N143 WeakPolarHBondContact CD2-O 3.33Å; L122-P154 HydrophobicContact CB-CG 4.36Å; L122-P154 HydrophobicContact CD2-CB 4.29Å; L122-P154 HydrophobicContact CD2-CG 3.87Å; L122-P154 HydrophobicContact CG-CB 4.05Å; L122-P154 HydrophobicContact CG-CG 3.89Å; L122-L170 HydrophobicContact CD1-CD2 4.4Å; L122-L170 HydrophobicContact CD2-CD2 4.37Å
123	H	98.2	Very high	96.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-50.3	171.3	-70.2	79.3	0	0	0	110.5	L119 T120 C125 C126 I127 W152 P154	L119-H123 HydrophobicContact CB-CB 4.44Å; L119-H123 HydrophobicContact CD2-CB 3.83Å; T120-H123 PolarHBondContact N-ND1 3.09Å; T120-H123 WeakPolarHBondContact O-CB 3.49Å; T120-H123 PolarHBondContact O-N 2.82Å; T120-H123 PolarHBondContact OG1-N 3Å; T120-H123 PolarHBondContact OG1-ND1 3.15Å; H123-C125 PolarHBondContact O-N 3.5Å; H123-C126 WeakPolarHBondContact O-CB 3.47Å; H123-C126 PolarHBondContact O-N 3.48Å; H123-I127 WeakPolarHBondContact O-CG1 3.19Å; H123-I127 PolarHBondContact O-N 3.4Å; H123-I127 VanDerWaalsContact O-N 3.09Å; H123-W152 PolarHBondContact NE2-O 2.63Å; H123-P154 WeakPolarHBondContact NE2-CD 3.45Å
124	Q	96.7	Very high	96.8	Very high	65 Å²	65	45.5 Å²	45.5	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-57.6	-46.8	-178.4	-172.3	59.6	54	0	0	111.9	T120 C126 I127 D128	T120-Q124 PolarHBondContact O-N 2.99Å; Q124-C126 PolarHBondContact O-N 3.29Å; Q124-I127 PolarHBondContact O-N 3.38Å; Q124-D128 WeakPolarHBondContact CG-OD2 3.36Å; Q124-D128 VanDerWaalsContact NE2-CG 3.25Å; Q124-D128 PolarHBondContact NE2-OD1 2.95Å; Q124-D128 VanDerWaalsContact NE2-OD1 3.15Å; Q124-D128 PolarHBondContact NE2-OD2 3.29Å; Q124-D128 PolarHBondContact O-N 3.09Å
125	C	96.8	Very high	96.9	Very high	4 Å²	4	48 Å²	48	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-22.1	178.4	71.9	0	0	0	0	114	A121 L122 H123 N129 N130 M133 M166	A121-C125 PolarHBondContact O-N 2.97Å; A121-C125 VanDerWaalsContact O-N 3.15Å; L122-C125 PolarHBondContact O-SG 3.04Å; H123-C125 PolarHBondContact O-N 3.5Å; C125-N129 CarbonylContact O-C 3.5Å; C125-N129 PolarHBondContact O-N 2.92Å; C125-N130 HydrophobicContact CB-CB 4.08Å; C125-N130 PolarHBondContact O-N 3.4Å; C125-M133 HydrophobicContact CB-CB 3.88Å; C125-M133 HydrophobicContact CB-CG 3.88Å; C125-M166 WeakPolarHBondContact O-CE 3.33Å
126	C	97.8	Very high	97.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.7	-37.2	173.5	-68.5	0	0	0	0	112.4	L122 H123 Q124 A157 H163 M166	L122-C126 PolarHBondContact O-N 2.94Å; L122-C126 PolarHBondContact O-SG 3.37Å; H123-C126 WeakPolarHBondContact O-CB 3.47Å; H123-C126 PolarHBondContact O-N 3.48Å; Q124-C126 PolarHBondContact O-N 3.29Å; C126-A157 HydrophobicContact CB-CB 4.31Å; C126-H163 PolarHBondContact O-ND1 2.83Å; C126-M166 HydrophobicContact CB-CG 4.15Å
127	I	96.3	Very high	97.3	Very high	71 Å²	71	37.2 Å²	37.2	36%	0.364	19%	0.189	S	C	.	.	H	α-helix	trans	-67.6	-42.9	172.1	-60.8	166.9	0	0	0	110.4	H123 Q124 N129 A157 H163	H123-I127 WeakPolarHBondContact O-CG1 3.19Å; H123-I127 PolarHBondContact O-N 3.4Å; H123-I127 VanDerWaalsContact O-N 3.09Å; Q124-I127 PolarHBondContact O-N 3.38Å; I127-N129 VanDerWaalsContact C-N 3.28Å; I127-N129 PolarHBondContact O-N 2.82Å; I127-A157 HydrophobicContact CG1-CB 4.07Å; I127-H163 PolarHBondContact O-CE1 3.45Å; I127-H163 VanDerWaalsContact O-CE1 3.31Å
128	D	95.9	Very high	97.5	Very high	87 Å²	87	33.8 Å²	33.8	47%	0.465	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	1	-178.7	-62.7	-33.4	0	0	0	114.5	Q124 N130	Q124-D128 WeakPolarHBondContact CG-OD2 3.36Å; Q124-D128 VanDerWaalsContact NE2-CG 3.25Å; Q124-D128 PolarHBondContact NE2-OD1 2.95Å; Q124-D128 VanDerWaalsContact NE2-OD1 3.15Å; Q124-D128 PolarHBondContact NE2-OD2 3.29Å; Q124-D128 PolarHBondContact O-N 3.09Å; D128-N130 PolarHBondContact O-N 3.26Å
129	N	97.3	Very high	97.6	Very high	70 Å²	70	43.1 Å²	43.1	37%	0.374	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	28.1	-172.7	-151.9	-3.1	0	0	0	114.8	C125 I127 L131 H163 M166	C125-N129 CarbonylContact O-C 3.5Å; C125-N129 PolarHBondContact O-N 2.92Å; I127-N129 VanDerWaalsContact C-N 3.28Å; I127-N129 PolarHBondContact O-N 2.82Å; N129-L131 VanDerWaalsContact C-N 3.34Å; N129-L131 PolarHBondContact O-N 3.11Å; N129-H163 PolarHBondContact ND2-CD2 3.09Å; N129-H163 VanDerWaalsContact ND2-CD2 3.26Å; N129-M166 VanDerWaalsContact C-CE 3.46Å
130	N	97.6	Very high	97.7	Very high	45 Å²	45	45.3 Å²	45.3	24%	0.241	21%	0.207	C	C	.	.			trans	-83.2	77.4	-176.8	-171	-16.4	0	0	0	111.1	C125 D128 E132 M133 C134	C125-N130 HydrophobicContact CB-CB 4.08Å; C125-N130 PolarHBondContact O-N 3.4Å; D128-N130 PolarHBondContact O-N 3.26Å; N130-E132 PolarHBondContact O-N 2.88Å; N130-M133 HydrophobicContact CB-CB 4.07Å; N130-M133 VanDerWaalsContact CG-CB 3.43Å; N130-M133 PolarHBondContact O-N 3.04Å; N130-M133 VanDerWaalsContact O-N 3.11Å; N130-M133 WeakPolarHBondContact OD1-CB 3.37Å; N130-M133 PolarHBondContact OD1-N 2.89Å; N130-M133 VanDerWaalsContact OD1-N 3.1Å; N130-C134 PolarHBondContact O-N 3.37Å
131	L	98	Very high	97.6	Very high	52 Å²	52	47.4 Å²	47.4	27%	0.272	23%	0.23	S	C	.	.	H	α-helix	trans	-53.6	-37.5	-177	-59.7	170	0	0	0	112.9	N129 C134 R135 E165 M166 I169	N129-L131 VanDerWaalsContact C-N 3.34Å; N129-L131 PolarHBondContact O-N 3.11Å; L131-C134 PolarHBondContact O-N 3.03Å; L131-R135 WeakPolarHBondContact O-CB 3.27Å; L131-R135 VanDerWaalsContact O-CG 3.28Å; L131-R135 WeakPolarHBondContact O-CG 3.3Å; L131-R135 PolarHBondContact O-N 2.84Å; L131-E165 HydrophobicContact CD1-CG 4.31Å; L131-E165 HydrophobicContact CD2-CB 4.45Å; L131-E165 HydrophobicContact CD2-CG 4.24Å; L131-M166 HydrophobicContact CD2-CB 4.02Å; L131-M166 HydrophobicContact CD2-CE 3.71Å; L131-M166 HydrophobicContact CD2-SD 4.02Å; L131-M166 HydrophobicContact CG-CE 4.26Å; L131-I169 HydrophobicContact CB-CD1 4.29Å; L131-I169 HydrophobicContact CD2-CD1 3.6Å; L131-I169 HydrophobicContact CG-CD1 4.5Å
132	E	97.9	Very high	97.6	Very high	114 Å²	114	47.6 Å²	47.6	53%	0.533	23%	0.231	S	C	.	.	H	α-helix	trans	-73.1	-35.7	-179.5	-64.6	-56.3	115.9	0	0	112.2	L98 N130 R135 L136	L98-E132 HydrophobicContact CD1-CB 3.92Å; L98-E132 HydrophobicContact CD2-CB 4.32Å; N130-E132 PolarHBondContact O-N 2.88Å; E132-R135 IonicContact OE1-NE 3.7Å; E132-L136 WeakPolarHBondContact O-CB 3.33Å; E132-L136 PolarHBondContact O-N 3.06Å
133	M	98.3	Very high	97.6	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-67.4	-41.8	172	-172.3	65.4	73.2	0	0	110.9	L98 V101 C125 N130 L136 L137	L98-M133 HydrophobicContact CD2-CB 3.99Å; L98-M133 HydrophobicContact CD2-CE 3.72Å; L98-M133 HydrophobicContact CD2-SD 3.93Å; L98-M133 HydrophobicContact CG-CE 4.29Å; V101-M133 HydrophobicContact CB-CE 4.42Å; V101-M133 HydrophobicContact CB-SD 4.2Å; V101-M133 HydrophobicContact CG1-SD 3.87Å; V101-M133 HydrophobicContact CG2-CE 3.94Å; V101-M133 HydrophobicContact CG2-SD 4.06Å; C125-M133 HydrophobicContact CB-CB 3.88Å; C125-M133 HydrophobicContact CB-CG 3.88Å; N130-M133 HydrophobicContact CB-CB 4.07Å; N130-M133 VanDerWaalsContact CG-CB 3.43Å; N130-M133 PolarHBondContact O-N 3.04Å; N130-M133 VanDerWaalsContact O-N 3.11Å; N130-M133 WeakPolarHBondContact OD1-CB 3.37Å; N130-M133 PolarHBondContact OD1-N 2.89Å; N130-M133 VanDerWaalsContact OD1-N 3.1Å; M133-L136 WeakPolarHBondContact O-CB 3.37Å; M133-L136 PolarHBondContact O-N 2.96Å; M133-L136 HydrophobicContact SD-CD2 4.3Å; M133-L137 HydrophobicContact CG-CD1 3.91Å; M133-L137 HydrophobicContact CG-CG 4.37Å; M133-L137 WeakPolarHBondContact O-CB 3.39Å; M133-L137 VanDerWaalsContact O-CG 3.28Å; M133-L137 WeakPolarHBondContact O-CG 3.4Å; M133-L137 PolarHBondContact O-N 3.18Å; M133-L137 HydrophobicContact SD-CG 4.46Å
134	C	98.3	Very high	97.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-51.4	173.9	-179.5	0	0	0	0	111.6	L122 N130 L131 L136 L137 L138 M166	L122-C134 HydrophobicContact CD1-CB 4.4Å; N130-C134 PolarHBondContact O-N 3.37Å; L131-C134 PolarHBondContact O-N 3.03Å; C134-L136 VanDerWaalsContact C-N 3.29Å; C134-L136 PolarHBondContact O-N 3.27Å; C134-L137 PolarHBondContact O-N 3.37Å; C134-L138 WeakPolarHBondContact O-CB 3.29Å; C134-L138 WeakPolarHBondContact O-CG 3.41Å; C134-L138 PolarHBondContact O-N 2.94Å; C134-L138 VanDerWaalsContact SG-CD1 3.56Å; C134-M166 HydrophobicContact CB-CE 4.22Å; C134-M166 HydrophobicContact CB-SD 3.5Å; C134-M166 WeakPolarHBondContact CB-SD 3.49Å
135	R	98.3	Very high	97.6	Very high	97 Å²	97	50.9 Å²	50.9	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-34.4	175.8	-69.7	178.3	-163.8	-70.9	1.7	112.7	L131 E132 R139 E165 I169	L131-R135 WeakPolarHBondContact O-CB 3.27Å; L131-R135 VanDerWaalsContact O-CG 3.28Å; L131-R135 WeakPolarHBondContact O-CG 3.3Å; L131-R135 PolarHBondContact O-N 2.84Å; E132-R135 IonicContact OE1-NE 3.7Å; R135-R139 WeakPolarHBondContact O-CB 3.37Å; R135-R139 PolarHBondContact O-N 3.19Å; R135-E165 IonicContact NH2-OE1 3.17Å; R135-E165 PolarHBondContact NH2-OE1 3.5Å; R135-I169 HydrophobicContact CG-CD1 4.32Å; R135-I169 HydrophobicContact CG-CG2 4.46Å; R135-I169 VanDerWaalsContact CZ-CD1 3.42Å; R135-I169 VanDerWaalsContact NH2-CD1 3.34Å
136	L	98.3	Very high	97.7	Very high	18 Å²	18	51.1 Å²	51.1	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-49.8	175.4	179.2	62.4	0	0	0	111.6	L98 V101 R102 L105 E132 M133 C134 R139 Y140	L98-L136 HydrophobicContact CB-CD2 4.39Å; L98-L136 HydrophobicContact CD2-CB 4.46Å; L98-L136 HydrophobicContact CD2-CD2 3.89Å; L98-L136 WeakPolarHBondContact O-CD2 3.09Å; V101-L136 HydrophobicContact CB-CD2 4.19Å; V101-L136 HydrophobicContact CG1-CD2 3.81Å; R102-L136 HydrophobicContact CB-CD1 4.27Å; R102-L136 HydrophobicContact CB-CD2 4.37Å; R102-L136 HydrophobicContact CG-CD1 4.15Å; L105-L136 HydrophobicContact CD1-CG 4.36Å; E132-L136 WeakPolarHBondContact O-CB 3.33Å; E132-L136 PolarHBondContact O-N 3.06Å; M133-L136 WeakPolarHBondContact O-CB 3.37Å; M133-L136 PolarHBondContact O-N 2.96Å; M133-L136 HydrophobicContact SD-CD2 4.3Å; C134-L136 VanDerWaalsContact C-N 3.29Å; C134-L136 PolarHBondContact O-N 3.27Å; L136-R139 PolarHBondContact O-N 2.8Å; L136-Y140 HydrophobicContact CD1-CD2 4Å; L136-Y140 HydrophobicContact CD1-CE2 3.76Å; L136-Y140 WeakPolarHBondContact O-CD2 3.22Å; L136-Y140 PolarHBondContact O-N 3.34Å
137	L	98.3	Very high	97.6	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-50.9	-178.8	-71.9	167.8	0	0	0	111.6	F89 V101 L105 A121 L122 M133 C134 R139 Y140 G141 A142	F89-L137 HydrophobicContact CE2-CD2 4.18Å; F89-L137 HydrophobicContact CZ-CD2 3.7Å; V101-L137 HydrophobicContact CG1-CD2 4.47Å; L105-L137 HydrophobicContact CD1-CD2 4.33Å; A121-L137 HydrophobicContact CB-CD1 3.88Å; A121-L137 HydrophobicContact CB-CD2 4.03Å; A121-L137 WeakPolarHBondContact O-CD1 3.45Å; L122-L137 HydrophobicContact CB-CD1 4.27Å; L122-L137 HydrophobicContact CD1-CB 4.27Å; L122-L137 HydrophobicContact CD1-CD1 4.32Å; M133-L137 HydrophobicContact CG-CD1 3.91Å; M133-L137 HydrophobicContact CG-CG 4.37Å; M133-L137 WeakPolarHBondContact O-CB 3.39Å; M133-L137 VanDerWaalsContact O-CG 3.28Å; M133-L137 WeakPolarHBondContact O-CG 3.4Å; M133-L137 PolarHBondContact O-N 3.18Å; M133-L137 HydrophobicContact SD-CG 4.46Å; C134-L137 PolarHBondContact O-N 3.37Å; L137-R139 VanDerWaalsContact C-N 3.28Å; L137-R139 PolarHBondContact O-N 2.93Å; L137-Y140 CarbonylContact O-C 3.6Å; L137-Y140 PolarHBondContact O-N 3.1Å; L137-G141 PolarHBondContact O-N 2.95Å; L137-A142 VanDerWaalsContact C-CB 3.48Å; L137-A142 HydrophobicContact CB-CB 3.85Å; L137-A142 VanDerWaalsContact O-CB 3.3Å; L137-A142 WeakPolarHBondContact O-CB 3.47Å; L137-A142 PolarHBondContact O-N 3.43Å; L137-A142 VanDerWaalsContact O-N 3.07Å
138	L	98	Very high	97.6	Very high	15 Å²	15	51.9 Å²	51.9	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-38.5	178	-68.3	168.7	0	0	0	112	L122 C134 Y140 G141 P144 I169 L170 H173	L122-L138 HydrophobicContact CD1-CD2 4.37Å; L122-L138 HydrophobicContact CD1-CG 4.17Å; L122-L138 HydrophobicContact CD2-CD2 3.91Å; C134-L138 WeakPolarHBondContact O-CB 3.29Å; C134-L138 WeakPolarHBondContact O-CG 3.41Å; C134-L138 PolarHBondContact O-N 2.94Å; C134-L138 VanDerWaalsContact SG-CD1 3.56Å; L138-Y140 VanDerWaalsContact C-N 3.26Å; L138-Y140 PolarHBondContact O-N 3.02Å; L138-G141 PolarHBondContact O-N 3.1Å; L138-P144 HydrophobicContact CD2-CB 4.09Å; L138-I169 HydrophobicContact CD1-CG2 3.68Å; L138-L170 HydrophobicContact CD1-CD2 4.41Å; L138-H173 HydrophobicContact CD1-CB 4.21Å; L138-H173 HydrophobicContact CD2-CB 4.22Å
139	R	97.5	Very high	97.5	Very high	214 Å²	214	50.7 Å²	50.7	81%	0.808	25%	0.25	S	S	*	.	H	α-helix	trans	-64.1	-26.7	176.4	178.3	175.5	177	-177.4	-0	113.8	R135 L136 L137	R135-R139 WeakPolarHBondContact O-CB 3.37Å; R135-R139 PolarHBondContact O-N 3.19Å; L136-R139 PolarHBondContact O-N 2.8Å; L137-R139 VanDerWaalsContact C-N 3.28Å; L137-R139 PolarHBondContact O-N 2.93Å
140	Y	97.8	Very high	97.2	Very high	87 Å²	87	51 Å²	51	34%	0.341	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	10.2	173.7	-80.7	-97.6	0	0	0	113	R102 L105 S106 L136 L137 L138	R102-Y140 HydrophobicContact CG-CE2 4.2Å; R102-Y140 WeakPolarHBondContact CG-OH 3.33Å; L105-Y140 HydrophobicContact CB-CD1 3.51Å; L105-Y140 HydrophobicContact CB-CD2 4.32Å; L105-Y140 HydrophobicContact CB-CE1 3.84Å; L105-Y140 HydrophobicContact CB-CG 3.75Å; L105-Y140 HydrophobicContact CD1-CD2 3.98Å; L105-Y140 HydrophobicContact CD1-CG 3.92Å; L105-Y140 HydrophobicContact CG-CG 4.32Å; S106-Y140 PolarHBondContact OG-OH 3.48Å; L136-Y140 HydrophobicContact CD1-CD2 4Å; L136-Y140 HydrophobicContact CD1-CE2 3.76Å; L136-Y140 WeakPolarHBondContact O-CD2 3.22Å; L136-Y140 PolarHBondContact O-N 3.34Å; L137-Y140 CarbonylContact O-C 3.6Å; L137-Y140 PolarHBondContact O-N 3.1Å; L138-Y140 VanDerWaalsContact C-N 3.26Å; L138-Y140 PolarHBondContact O-N 3.02Å
141	G	96.6	Very high	97	Very high	51 Å²	51	49.8 Å²	49.8	53%	0.526	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	25.1	172.8	0	0	0	0	0	115.1	L137 L138	L137-G141 PolarHBondContact O-N 2.95Å; L138-G141 PolarHBondContact O-N 3.1Å
142	A	98	Very high	96.9	Very high	6 Å²	6	50.2 Å²	50.2	5%	0.05	24%	0.241	C	C	.	.			trans	-57.4	137	167.8	0	0	0	0	0	111	P111 D112 L122 L137 P144	P111-A142 HydrophobicContact CB-CB 3.76Å; P111-A142 HydrophobicContact CG-CB 4.21Å; D112-A142 WeakPolarHBondContact OD1-CA 3.37Å; L122-A142 HydrophobicContact CD2-CB 4.09Å; L137-A142 VanDerWaalsContact C-CB 3.48Å; L137-A142 HydrophobicContact CB-CB 3.85Å; L137-A142 VanDerWaalsContact O-CB 3.3Å; L137-A142 WeakPolarHBondContact O-CB 3.47Å; L137-A142 PolarHBondContact O-N 3.43Å; L137-A142 VanDerWaalsContact O-N 3.07Å; A142-P144 VanDerWaalsContact O-CD 3.28Å; A142-P144 WeakPolarHBondContact O-CD 3.35Å
143	N	98	Very high	96.9	Very high	65 Å²	65	44.9 Å²	44.9	35%	0.348	22%	0.216	S	C	.	.			trans	-76.5	112.1	179.3	179.9	10.4	0	0	0	110.7	D112 L122 N145 S146	D112-N143 PolarHBondContact OD1-N 3.23Å; D112-N143 WeakPolarHBondContact OD2-CB 3.43Å; D112-N143 PolarHBondContact OD2-N 3.36Å; L122-N143 WeakPolarHBondContact CD2-O 3.33Å; N143-N145 PolarHBondContact ND2-O 2.95Å; N143-N145 PolarHBondContact O-N 3.44Å; N143-N145 VanDerWaalsContact O-N 3.16Å; N143-N145 WeakPolarHBondContact OD1-CA 3.21Å; N143-N145 PolarHBondContact OD1-N 3.41Å; N143-S146 PolarHBondContact ND2-N 2.69Å; N143-S146 WeakPolarHBondContact O-CB 3.34Å; N143-S146 PolarHBondContact O-N 2.99Å; N143-S146 VanDerWaalsContact O-N 3.08Å; N143-S146 PolarHBondContact O-OG 2.85Å
144	P	97.7	Very high	96.9	Very high	17 Å²	17	44.8 Å²	44.8	11%	0.11	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.5	176.4	30.8	-36.4	0	0	0	112.9	L138 A142 P154 L170 A175	L138-P144 HydrophobicContact CD2-CB 4.09Å; A142-P144 VanDerWaalsContact O-CD 3.28Å; A142-P144 WeakPolarHBondContact O-CD 3.35Å; P144-P154 WeakPolarHBondContact O-CD 3.49Å; P144-L170 HydrophobicContact CB-CD2 4.38Å; P144-A175 HydrophobicContact CB-CB 4.37Å
145	N	98.1	Very high	97	Very high	54 Å²	54	44.8 Å²	44.8	29%	0.289	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	31.2	176	-55.8	-47.9	0	0	0	111	N143 G174 A175 D176	N143-N145 PolarHBondContact ND2-O 2.95Å; N143-N145 PolarHBondContact O-N 3.44Å; N143-N145 VanDerWaalsContact O-N 3.16Å; N143-N145 WeakPolarHBondContact OD1-CA 3.21Å; N143-N145 PolarHBondContact OD1-N 3.41Å; N145-G174 PolarHBondContact ND2-O 3.3Å; N145-A175 WeakPolarHBondContact OD1-CA 3.34Å; N145-D176 WeakPolarHBondContact OD1-CB 3.46Å; N145-D176 PolarHBondContact OD1-N 2.69Å
146	S	97.2	Very high	96.9	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.063	20%	0.198	C	C	.	.			trans	-62.5	149.6	161.3	41.2	0	0	0	0	109	N143 T153 P154	N143-S146 PolarHBondContact ND2-N 2.69Å; N143-S146 WeakPolarHBondContact O-CB 3.34Å; N143-S146 PolarHBondContact O-N 2.99Å; N143-S146 VanDerWaalsContact O-N 3.08Å; N143-S146 PolarHBondContact O-OG 2.85Å; S146-T153 WeakPolarHBondContact O-CA 3.5Å; S146-P154 WeakPolarHBondContact O-CD 3.32Å
147	R	96.5	Very high	96.9	Very high	61 Å²	61	39.7 Å²	39.7	23%	0.23	20%	0.196	C	C	.	.			trans	-125.3	141	178.4	-75.4	-175.6	-177.2	154.6	0.8	110.5	W152 T153 L689 S691	R147-W152 VanDerWaalsContact CA-O 3.24Å; R147-W152 WeakPolarHBondContact CA-O 3.44Å; R147-T153 HydrophobicContact CG-CG2 3.96Å; R147-L689 PolarHBondContact NH1-O 2.91Å; R147-L689 VanDerWaalsContact NH1-O 3.16Å; R147-S691 PolarHBondContact NH1-OG 3Å
148	D	95.6	Very high	96.9	Very high	26 Å²	26	39.7 Å²	39.7	14%	0.139	20%	0.196	C	C	.	.			trans	-86.6	-170.4	171.4	75.7	2.1	0	0	0	112.2	D117 L119 E150 L151 W152	D117-D148 WeakPolarHBondContact O-CB 3.41Å; L119-D148 HydrophobicContact CD2-CB 3.94Å; L119-D148 WeakPolarHBondContact CD2-OD2 3.39Å; L119-D148 HydrophobicContact CG-CB 4.33Å; D148-E150 PolarHBondContact O-N 2.91Å; D148-E150 WeakPolarHBondContact OD1-CA 3.22Å; D148-E150 PolarHBondContact OD1-N 3.21Å; D148-L151 PolarHBondContact O-N 2.76Å; D148-L151 PolarHBondContact OD1-N 3.25Å; D148-L151 VanDerWaalsContact OD1-N 3.14Å; D148-W152 PolarHBondContact N-O 3.41Å; D148-W152 VanDerWaalsContact N-O 3.08Å; D148-W152 WeakPolarHBondContact OD1-CB 3.34Å; D148-W152 PolarHBondContact OD1-N 3.49Å
149	T	93.7	Very high	96.8	Very high	63 Å²	63	39 Å²	39	39%	0.387	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.7	179.3	53.5	0	0	0	0	113.5	D117 L151	D117-T149 PolarHBondContact O-N 3.47Å; D117-T149 PolarHBondContact O-OG1 2.99Å; T149-L151 VanDerWaalsContact C-N 3.25Å; T149-L151 PolarHBondContact O-N 3.18Å
150	E	90.7	Very high	96.8	Very high	77 Å²	77	31.3 Å²	31.3	36%	0.36	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	13.1	179.9	-47.9	-44.6	119.8	0	0	111.8	D148 W152 V182	D148-E150 PolarHBondContact O-N 2.91Å; D148-E150 WeakPolarHBondContact OD1-CA 3.22Å; D148-E150 PolarHBondContact OD1-N 3.21Å; E150-W152 PolarHBondContact O-N 2.69Å; E150-W152 VanDerWaalsContact O-N 3.14Å; E150-V182 WeakPolarHBondContact O-CB 3.36Å; E150-V182 WeakPolarHBondContact O-CG2 3.23Å; E150-V182 PolarHBondContact O-N 3.42Å
151	L	94.4	Very high	96.7	Very high	19 Å²	19	29.3 Å²	29.3	10%	0.099	17%	0.168	C	C	.	.			trans	60.2	12.3	-176	-55.9	173	0	0	0	114.8	D148 T149 V182 C687 V688	D148-L151 PolarHBondContact O-N 2.76Å; D148-L151 PolarHBondContact OD1-N 3.25Å; D148-L151 VanDerWaalsContact OD1-N 3.14Å; T149-L151 VanDerWaalsContact C-N 3.25Å; T149-L151 PolarHBondContact O-N 3.18Å; L151-V182 HydrophobicContact CB-CG2 4.28Å; L151-V182 HydrophobicContact CD1-CG2 3.87Å; L151-V182 HydrophobicContact CG-CG2 3.87Å; L151-C687 HydrophobicContact CD1-CB 4.34Å; L151-V688 HydrophobicContact CD1-CG2 3.82Å; L151-V688 HydrophobicContact CD2-CG2 4.22Å
152	W	96.6	Very high	96.7	Very high	61 Å²	61	30.5 Å²	30.5	23%	0.231	16%	0.16	C	C	.	.			trans	-63.8	147.3	173.3	-77.6	56.9	0	0	0	109.8	H123 R147 D148 E150 H156 T160 N181	H123-W152 PolarHBondContact NE2-O 2.63Å; R147-W152 VanDerWaalsContact CA-O 3.24Å; R147-W152 WeakPolarHBondContact CA-O 3.44Å; D148-W152 PolarHBondContact N-O 3.41Å; D148-W152 VanDerWaalsContact N-O 3.08Å; D148-W152 WeakPolarHBondContact OD1-CB 3.34Å; D148-W152 PolarHBondContact OD1-N 3.49Å; E150-W152 PolarHBondContact O-N 2.69Å; E150-W152 VanDerWaalsContact O-N 3.14Å; W152-H156 HydrophobicContact CB-CB 4.32Å; W152-H156 HydrophobicContact CD2-CB 3.95Å; W152-H156 HydrophobicContact CE3-CB 3.48Å; W152-H156 VanDerWaalsContact CE3-CB 3.48Å; W152-H156 HydrophobicContact CG-CB 4.34Å; W152-H156 HydrophobicContact CZ3-CB 4.05Å; W152-T160 HydrophobicContact CH2-CG2 4.02Å; W152-T160 VanDerWaalsContact CH2-OG1 3.22Å; W152-T160 WeakPolarHBondContact CH2-OG1 3.11Å; W152-T160 HydrophobicContact CZ3-CG2 4.27Å; W152-T160 WeakPolarHBondContact CZ3-OG1 3.4Å; W152-N181 HydrophobicContact CG-CB 4.29Å; W152-N181 PolarHBondContact NE1-ND2 3.29Å
153	T	98.1	Very high	96.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.166	C	C	.	.			trans	-110.4	165.7	174.1	67.8	0	0	0	0	109.9	S146 R147 L155 H156 A157 A179	S146-T153 WeakPolarHBondContact O-CA 3.5Å; R147-T153 HydrophobicContact CG-CG2 3.96Å; T153-L155 PolarHBondContact O-N 3.17Å; T153-L155 VanDerWaalsContact O-N 3.08Å; T153-L155 PolarHBondContact OG1-N 3.06Å; T153-H156 PolarHBondContact N-ND1 2.98Å; T153-H156 VanDerWaalsContact N-ND1 3.2Å; T153-H156 WeakPolarHBondContact O-CB 3.28Å; T153-H156 PolarHBondContact O-N 3.3Å; T153-H156 PolarHBondContact OG1-N 2.94Å; T153-H156 PolarHBondContact OG1-ND1 3.1Å; T153-A157 PolarHBondContact O-N 3.21Å; T153-A179 HydrophobicContact CG2-CB 4.12Å
154	P	98.4	Very high	96.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-52.8	-30.9	170.3	-27.4	35.9	0	0	0	112.9	L122 H123 P144 S146 S158 L170	L122-P154 HydrophobicContact CB-CG 4.36Å; L122-P154 HydrophobicContact CD2-CB 4.29Å; L122-P154 HydrophobicContact CD2-CG 3.87Å; L122-P154 HydrophobicContact CG-CB 4.05Å; L122-P154 HydrophobicContact CG-CG 3.89Å; H123-P154 WeakPolarHBondContact NE2-CD 3.45Å; P144-P154 WeakPolarHBondContact O-CD 3.49Å; S146-P154 WeakPolarHBondContact O-CD 3.32Å; P154-S158 WeakPolarHBondContact O-CB 3.19Å; P154-S158 PolarHBondContact O-N 2.89Å; P154-S158 PolarHBondContact O-OG 2.83Å; P154-L170 VanDerWaalsContact C-CD1 3.46Å; P154-L170 HydrophobicContact CB-CD1 3.93Å; P154-L170 HydrophobicContact CB-CD2 3.95Å; P154-L170 WeakPolarHBondContact O-CD1 3.44Å
155	L	98.4	Very high	96.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.1	-46.8	176.5	-170.9	59.9	0	0	0	111.5	T153 A157 S158 A159 C167 L170 I171 A175 L177 P187	T153-L155 PolarHBondContact O-N 3.17Å; T153-L155 VanDerWaalsContact O-N 3.08Å; T153-L155 PolarHBondContact OG1-N 3.06Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.42Å; L155-S158 PolarHBondContact O-N 3.41Å; L155-S158 PolarHBondContact O-OG 3.17Å; L155-A159 VanDerWaalsContact O-CB 3.24Å; L155-A159 WeakPolarHBondContact O-CB 3.49Å; L155-A159 PolarHBondContact O-N 3.37Å; L155-C167 HydrophobicContact CD1-CB 3.91Å; L155-L170 HydrophobicContact CB-CD1 4.33Å; L155-L170 HydrophobicContact CD1-CB 4.28Å; L155-L170 HydrophobicContact CD1-CD1 4.28Å; L155-I171 HydrophobicContact CD1-CD1 4.27Å; L155-I171 HydrophobicContact CD1-CG1 4.02Å; L155-I171 HydrophobicContact CD2-CG1 4.17Å; L155-A175 HydrophobicContact CB-CB 4.25Å; L155-A175 HydrophobicContact CD2-CB 3.99Å; L155-L177 HydrophobicContact CD2-CD2 3.61Å; L155-P187 HydrophobicContact CB-CB 4.39Å; L155-P187 HydrophobicContact CB-CG 4.36Å; L155-P187 HydrophobicContact CD2-CB 3.99Å; L155-P187 HydrophobicContact CD2-CG 4.02Å; L155-P187 HydrophobicContact CG-CB 3.79Å; L155-P187 HydrophobicContact CG-CG 4.12Å
156	H	98.1	Very high	96.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-54.7	-48.1	171.9	-67.7	94.1	0	0	0	111.5	W152 T153 S158 A159 T160 A179 N185	W152-H156 HydrophobicContact CB-CB 4.32Å; W152-H156 HydrophobicContact CD2-CB 3.95Å; W152-H156 HydrophobicContact CE3-CB 3.48Å; W152-H156 VanDerWaalsContact CE3-CB 3.48Å; W152-H156 HydrophobicContact CG-CB 4.34Å; W152-H156 HydrophobicContact CZ3-CB 4.05Å; T153-H156 PolarHBondContact N-ND1 2.98Å; T153-H156 VanDerWaalsContact N-ND1 3.2Å; T153-H156 WeakPolarHBondContact O-CB 3.28Å; T153-H156 PolarHBondContact O-N 3.3Å; T153-H156 PolarHBondContact OG1-N 2.94Å; T153-H156 PolarHBondContact OG1-ND1 3.1Å; H156-S158 PolarHBondContact O-N 2.91Å; H156-A159 WeakPolarHBondContact O-CB 3.2Å; H156-A159 PolarHBondContact O-N 2.96Å; H156-T160 PolarHBondContact O-N 3.16Å; H156-T160 PolarHBondContact O-OG1 3.32Å; H156-T160 VanDerWaalsContact O-OG1 3.06Å; H156-A179 PolarHBondContact CE1-O 3.09Å; H156-A179 PolarHBondContact NE2-O 3.4Å; H156-N185 PolarHBondContact NE2-O 2.78Å
157	A	97.1	Very high	96.7	Very high	7 Å²	7	31 Å²	31	6%	0.058	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-45.9	179.3	0	0	0	0	0	112.1	C126 I127 T153 L155 C161	C126-A157 HydrophobicContact CB-CB 4.31Å; I127-A157 HydrophobicContact CG1-CB 4.07Å; T153-A157 PolarHBondContact O-N 3.21Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.42Å; A157-C161 WeakPolarHBondContact O-CB 3.49Å; A157-C161 PolarHBondContact O-N 3.41Å; A157-C161 VanDerWaalsContact O-N 3.16Å; A157-C161 PolarHBondContact O-SG 3.07Å
158	S	97.6	Very high	96.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-33.6	177.1	68.3	0	0	0	0	113.7	P154 L155 H156 H162 H163 C167	P154-S158 WeakPolarHBondContact O-CB 3.19Å; P154-S158 PolarHBondContact O-N 2.89Å; P154-S158 PolarHBondContact O-OG 2.83Å; L155-S158 PolarHBondContact O-N 3.41Å; L155-S158 PolarHBondContact O-OG 3.17Å; H156-S158 PolarHBondContact O-N 2.91Å; S158-H162 PolarHBondContact O-N 3.08Å; S158-H162 VanDerWaalsContact O-N 3.16Å; S158-H163 PolarHBondContact O-N 2.87Å; S158-C167 VanDerWaalsContact C-SG 3.52Å; S158-C167 PolarHBondContact OG-SG 3.33Å
159	A	97.3	Very high	96.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-51.4	177.8	0	0	0	0	0	111.8	L155 H156 C161 H162 P187 C191	L155-A159 VanDerWaalsContact O-CB 3.24Å; L155-A159 WeakPolarHBondContact O-CB 3.49Å; L155-A159 PolarHBondContact O-N 3.37Å; H156-A159 WeakPolarHBondContact O-CB 3.2Å; H156-A159 PolarHBondContact O-N 2.96Å; A159-C161 VanDerWaalsContact C-N 3.29Å; A159-C161 PolarHBondContact O-N 2.87Å; A159-H162 VanDerWaalsContact O-CA 3.3Å; A159-H162 WeakPolarHBondContact O-CA 3.28Å; A159-H162 PolarHBondContact O-CD2 3.34Å; A159-H162 PolarHBondContact O-N 2.94Å; A159-P187 HydrophobicContact CB-CB 4.47Å; A159-P187 WeakPolarHBondContact CB-O 3.35Å; A159-C191 VanDerWaalsContact CB-SG 3.59Å
160	T	96.5	Very high	97.1	Very high	54 Å²	54	27.8 Å²	27.8	33%	0.331	14%	0.139	S	C	.	.	H	α-helix	trans	-64.6	-31	177.7	-53.5	0	0	0	0	112.9	W152 H156 H162 C190	W152-T160 HydrophobicContact CH2-CG2 4.02Å; W152-T160 VanDerWaalsContact CH2-OG1 3.22Å; W152-T160 WeakPolarHBondContact CH2-OG1 3.11Å; W152-T160 HydrophobicContact CZ3-CG2 4.27Å; W152-T160 WeakPolarHBondContact CZ3-OG1 3.4Å; H156-T160 PolarHBondContact O-N 3.16Å; H156-T160 PolarHBondContact O-OG1 3.32Å; H156-T160 VanDerWaalsContact O-OG1 3.06Å; T160-H162 PolarHBondContact O-CE1 3.48Å; T160-H162 PolarHBondContact O-N 3.28Å; T160-H162 PolarHBondContact O-ND1 3.03Å; T160-C190 WeakPolarHBondContact OG1-CB 2.8Å
161	C	96.3	Very high	97.5	Very high	45 Å²	45	24.4 Å²	24.4	30%	0.304	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	0.3	171.1	-58.5	0	0	0	0	113.1	A157 A159 H163	A157-C161 WeakPolarHBondContact O-CB 3.49Å; A157-C161 PolarHBondContact O-N 3.41Å; A157-C161 VanDerWaalsContact O-N 3.16Å; A157-C161 PolarHBondContact O-SG 3.07Å; A159-C161 VanDerWaalsContact C-N 3.29Å; A159-C161 PolarHBondContact O-N 2.87Å; C161-H163 WeakPolarHBondContact CB-CE1 3.41Å; C161-H163 WeakPolarHBondContact CB-ND1 3.38Å; C161-H163 PolarHBondContact O-CD2 3.02Å; C161-H163 PolarHBondContact O-N 3.37Å; C161-H163 PolarHBondContact O-NE2 2.88Å
162	H	95.7	Very high	97.6	Very high	76 Å²	76	29 Å²	29	35%	0.352	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	25.5	-179.3	-47.3	99.9	0	0	0	114.9	S158 A159 T160 T164 M192 T196	S158-H162 PolarHBondContact O-N 3.08Å; S158-H162 VanDerWaalsContact O-N 3.16Å; A159-H162 VanDerWaalsContact O-CA 3.3Å; A159-H162 WeakPolarHBondContact O-CA 3.28Å; A159-H162 PolarHBondContact O-CD2 3.34Å; A159-H162 PolarHBondContact O-N 2.94Å; T160-H162 PolarHBondContact O-CE1 3.48Å; T160-H162 PolarHBondContact O-N 3.28Å; T160-H162 PolarHBondContact O-ND1 3.03Å; H162-T164 PolarHBondContact O-N 3.15Å; H162-T164 PolarHBondContact O-OG1 3.25Å; H162-M192 VanDerWaalsContact NE2-CB 3.31Å; H162-M192 WeakPolarHBondContact NE2-CB 3.38Å; H162-M192 VanDerWaalsContact NE2-CG 3.29Å; H162-M192 WeakPolarHBondContact NE2-CG 3.41Å; H162-M192 PolarHBondContact NE2-N 3.3Å; H162-M192 VanDerWaalsContact NE2-N 3.15Å; H162-T196 PolarHBondContact O-OG1 3.15Å
163	H	97.3	Very high	97.7	Very high	39 Å²	39	30.8 Å²	30.8	18%	0.181	16%	0.159	C	C	.	.			trans	-79.9	72.9	-174.6	-66.6	156.2	0	0	0	112.6	C126 I127 N129 S158 C161 E165 M166 C167	C126-H163 PolarHBondContact O-ND1 2.83Å; I127-H163 PolarHBondContact O-CE1 3.45Å; I127-H163 VanDerWaalsContact O-CE1 3.31Å; N129-H163 PolarHBondContact ND2-CD2 3.09Å; N129-H163 VanDerWaalsContact ND2-CD2 3.26Å; S158-H163 PolarHBondContact O-N 2.87Å; C161-H163 WeakPolarHBondContact CB-CE1 3.41Å; C161-H163 WeakPolarHBondContact CB-ND1 3.38Å; C161-H163 PolarHBondContact O-CD2 3.02Å; C161-H163 PolarHBondContact O-N 3.37Å; C161-H163 PolarHBondContact O-NE2 2.88Å; H163-E165 PolarHBondContact O-N 3.42Å; H163-E165 VanDerWaalsContact O-N 3.16Å; H163-M166 HydrophobicContact CB-CB 3.73Å; H163-M166 WeakPolarHBondContact O-CA 3.37Å; H163-M166 VanDerWaalsContact O-CB 3.23Å; H163-M166 WeakPolarHBondContact O-CB 3.3Å; H163-M166 PolarHBondContact O-N 2.93Å; H163-C167 PolarHBondContact O-N 2.93Å; H163-C167 PolarHBondContact O-SG 3.3Å; H163-C167 VanDerWaalsContact O-SG 3.34Å
164	T	97.7	Very high	97.6	Very high	49 Å²	49	32.7 Å²	32.7	30%	0.301	18%	0.179	S	C	.	.	H	α-helix	trans	-48.2	-46.2	-170	-39.3	0	0	0	0	115.4	H162 K168 P195 T196 L199	H162-T164 PolarHBondContact O-N 3.15Å; H162-T164 PolarHBondContact O-OG1 3.25Å; T164-K168 PolarHBondContact O-N 3.29Å; T164-K168 VanDerWaalsContact O-N 3.07Å; T164-P195 HydrophobicContact CG2-CB 4.35Å; T164-T196 PolarHBondContact OG1-OG1 2.7Å; T164-L199 HydrophobicContact CG2-CB 4.23Å; T164-L199 HydrophobicContact CG2-CD2 3.75Å; T164-L199 WeakPolarHBondContact O-CD2 3.34Å
165	E	97.9	Very high	97.6	Very high	74 Å²	74	32.7 Å²	32.7	35%	0.346	18%	0.179	S	C	.	.	H	α-helix	trans	-73.5	-26.7	177.9	179.5	66.1	-165.2	0	0	112.2	L131 R135 H163 K168 I169	L131-E165 HydrophobicContact CD1-CG 4.31Å; L131-E165 HydrophobicContact CD2-CB 4.45Å; L131-E165 HydrophobicContact CD2-CG 4.24Å; R135-E165 IonicContact NH2-OE1 3.17Å; R135-E165 PolarHBondContact NH2-OE1 3.5Å; H163-E165 PolarHBondContact O-N 3.42Å; H163-E165 VanDerWaalsContact O-N 3.16Å; E165-K168 IonicContact OE1-NZ 3.48Å; E165-K168 PolarHBondContact OE1-NZ 2.76Å; E165-K168 IonicContact OE2-NZ 3.87Å; E165-K168 PolarHBondContact OE2-NZ 3.14Å; E165-I169 HydrophobicContact CG-CD1 4.43Å; E165-I169 WeakPolarHBondContact O-CD1 3.46Å; E165-I169 WeakPolarHBondContact O-CG1 3.05Å; E165-I169 PolarHBondContact O-N 2.97Å
166	M	98.2	Very high	97.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-47.6	171.6	-170.6	71.5	73.3	0	0	110.8	C125 C126 N129 L131 C134 H163 K168 I169 L170	C125-M166 WeakPolarHBondContact O-CE 3.33Å; C126-M166 HydrophobicContact CB-CG 4.15Å; N129-M166 VanDerWaalsContact C-CE 3.46Å; L131-M166 HydrophobicContact CD2-CB 4.02Å; L131-M166 HydrophobicContact CD2-CE 3.71Å; L131-M166 HydrophobicContact CD2-SD 4.02Å; L131-M166 HydrophobicContact CG-CE 4.26Å; C134-M166 HydrophobicContact CB-CE 4.22Å; C134-M166 HydrophobicContact CB-SD 3.5Å; C134-M166 WeakPolarHBondContact CB-SD 3.49Å; H163-M166 HydrophobicContact CB-CB 3.73Å; H163-M166 WeakPolarHBondContact O-CA 3.37Å; H163-M166 VanDerWaalsContact O-CB 3.23Å; H163-M166 WeakPolarHBondContact O-CB 3.3Å; H163-M166 PolarHBondContact O-N 2.93Å; M166-K168 VanDerWaalsContact C-N 3.27Å; M166-K168 PolarHBondContact O-N 3.05Å; M166-I169 PolarHBondContact O-N 3.02Å; M166-I169 VanDerWaalsContact O-N 3.16Å; M166-L170 HydrophobicContact CG-CD1 4.49Å; M166-L170 WeakPolarHBondContact O-CG 3.41Å; M166-L170 PolarHBondContact O-N 3.17Å
167	C	98.3	Very high	97.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-54.2	-47.4	174.4	-54.3	0	0	0	0	110.3	L155 S158 H163 I169 L170 I171 T196 L199	L155-C167 HydrophobicContact CD1-CB 3.91Å; S158-C167 VanDerWaalsContact C-SG 3.52Å; S158-C167 PolarHBondContact OG-SG 3.33Å; H163-C167 PolarHBondContact O-N 2.93Å; H163-C167 PolarHBondContact O-SG 3.3Å; H163-C167 VanDerWaalsContact O-SG 3.34Å; C167-I169 PolarHBondContact O-N 2.81Å; C167-L170 PolarHBondContact O-N 3.5Å; C167-I171 WeakPolarHBondContact O-CB 3.32Å; C167-I171 WeakPolarHBondContact O-CG1 3.39Å; C167-I171 PolarHBondContact O-N 2.92Å; C167-T196 HydrophobicContact CB-CG2 4.44Å; C167-T196 VanDerWaalsContact SG-CG2 3.5Å; C167-L199 HydrophobicContact CB-CD2 4.17Å
168	K	98.1	Very high	97.4	Very high	81 Å²	81	36.2 Å²	36.2	35%	0.352	20%	0.196	S	C	.	.	H	α-helix	trans	-58.1	-46.6	176.8	-174.9	175.9	140.7	-133.8	0	113	T164 E165 M166 L170 I171 D172 L199	T164-K168 PolarHBondContact O-N 3.29Å; T164-K168 VanDerWaalsContact O-N 3.07Å; E165-K168 IonicContact OE1-NZ 3.48Å; E165-K168 PolarHBondContact OE1-NZ 2.76Å; E165-K168 IonicContact OE2-NZ 3.87Å; E165-K168 PolarHBondContact OE2-NZ 3.14Å; M166-K168 VanDerWaalsContact C-N 3.27Å; M166-K168 PolarHBondContact O-N 3.05Å; K168-L170 VanDerWaalsContact C-N 3.31Å; K168-L170 PolarHBondContact O-N 3.35Å; K168-I171 PolarHBondContact O-N 2.89Å; K168-D172 WeakPolarHBondContact O-CB 3.21Å; K168-D172 VanDerWaalsContact O-CG 3.32Å; K168-D172 PolarHBondContact O-N 3.1Å; K168-L199 HydrophobicContact CB-CD2 3.89Å
169	I	98.5	Very high	97.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-44.5	176.8	-68.2	162.7	0	0	0	110.9	L131 R135 L138 E165 M166 C167 H173	L131-I169 HydrophobicContact CB-CD1 4.29Å; L131-I169 HydrophobicContact CD2-CD1 3.6Å; L131-I169 HydrophobicContact CG-CD1 4.5Å; R135-I169 HydrophobicContact CG-CD1 4.32Å; R135-I169 HydrophobicContact CG-CG2 4.46Å; R135-I169 VanDerWaalsContact CZ-CD1 3.42Å; R135-I169 VanDerWaalsContact NH2-CD1 3.34Å; L138-I169 HydrophobicContact CD1-CG2 3.68Å; E165-I169 HydrophobicContact CG-CD1 4.43Å; E165-I169 WeakPolarHBondContact O-CD1 3.46Å; E165-I169 WeakPolarHBondContact O-CG1 3.05Å; E165-I169 PolarHBondContact O-N 2.97Å; M166-I169 PolarHBondContact O-N 3.02Å; M166-I169 VanDerWaalsContact O-N 3.16Å; C167-I169 PolarHBondContact O-N 2.81Å; I169-H173 PolarHBondContact O-N 2.89Å; I169-H173 PolarHBondContact O-ND1 3.1Å
170	L	98.5	Very high	97	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-45.3	179	-67.8	170.3	0	0	0	111.6	L122 L138 P144 P154 L155 M166 C167 K168 D172 H173 G174 A175	L122-L170 HydrophobicContact CD1-CD2 4.4Å; L122-L170 HydrophobicContact CD2-CD2 4.37Å; L138-L170 HydrophobicContact CD1-CD2 4.41Å; P144-L170 HydrophobicContact CB-CD2 4.38Å; P154-L170 VanDerWaalsContact C-CD1 3.46Å; P154-L170 HydrophobicContact CB-CD1 3.93Å; P154-L170 HydrophobicContact CB-CD2 3.95Å; P154-L170 WeakPolarHBondContact O-CD1 3.44Å; L155-L170 HydrophobicContact CB-CD1 4.33Å; L155-L170 HydrophobicContact CD1-CB 4.28Å; L155-L170 HydrophobicContact CD1-CD1 4.28Å; M166-L170 HydrophobicContact CG-CD1 4.49Å; M166-L170 WeakPolarHBondContact O-CG 3.41Å; M166-L170 PolarHBondContact O-N 3.17Å; C167-L170 PolarHBondContact O-N 3.5Å; K168-L170 VanDerWaalsContact C-N 3.31Å; K168-L170 PolarHBondContact O-N 3.35Å; L170-D172 PolarHBondContact O-N 2.78Å; L170-H173 CarbonylContact O-C 3.53Å; L170-H173 PolarHBondContact O-N 3.46Å; L170-H173 VanDerWaalsContact O-N 3.07Å; L170-G174 PolarHBondContact O-N 2.95Å; L170-A175 VanDerWaalsContact C-CB 3.48Å; L170-A175 HydrophobicContact CB-CB 3.89Å; L170-A175 VanDerWaalsContact O-CB 3.23Å; L170-A175 WeakPolarHBondContact O-CB 3.36Å; L170-A175 PolarHBondContact O-N 2.98Å
171	I	98.1	Very high	96.7	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-44.3	177.5	-67.9	170.4	0	0	0	110.9	L155 C167 K168 H173 G174 L177 V200 E203 R207	L155-I171 HydrophobicContact CD1-CD1 4.27Å; L155-I171 HydrophobicContact CD1-CG1 4.02Å; L155-I171 HydrophobicContact CD2-CG1 4.17Å; C167-I171 WeakPolarHBondContact O-CB 3.32Å; C167-I171 WeakPolarHBondContact O-CG1 3.39Å; C167-I171 PolarHBondContact O-N 2.92Å; K168-I171 PolarHBondContact O-N 2.89Å; I171-H173 PolarHBondContact O-N 3.28Å; I171-G174 PolarHBondContact O-N 3.48Å; I171-G174 VanDerWaalsContact O-N 3.09Å; I171-L177 HydrophobicContact CD1-CD2 4.12Å; I171-L177 HydrophobicContact CG1-CD2 3.92Å; I171-V200 HydrophobicContact CD1-CG2 4.33Å; I171-E203 HydrophobicContact CD1-CB 4.48Å; I171-E203 HydrophobicContact CD1-CG 4.38Å; I171-E203 HydrophobicContact CG2-CB 4.11Å; I171-E203 HydrophobicContact CG2-CG 3.98Å; I171-R207 PolarHBondContact O-NH2 3.27Å; I171-R207 VanDerWaalsContact O-NH2 3.09Å
172	D	97.4	Very high	96.2	Very high	116 Å²	116	32.7 Å²	32.7	62%	0.62	17%	0.173	S	C	*	.	H	α-helix	trans	-60.2	-27.4	174.8	-77.6	-23.4	0	0	0	112.6	K168 L170	K168-D172 WeakPolarHBondContact O-CB 3.21Å; K168-D172 VanDerWaalsContact O-CG 3.32Å; K168-D172 PolarHBondContact O-N 3.1Å; L170-D172 PolarHBondContact O-N 2.78Å
173	H	97.8	Very high	95.6	Very high	97 Å²	97	31.3 Å²	31.3	45%	0.449	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	9.4	177.7	-70.2	74.6	0	0	0	113.8	L138 I169 L170 I171	L138-H173 HydrophobicContact CD1-CB 4.21Å; L138-H173 HydrophobicContact CD2-CB 4.22Å; I169-H173 PolarHBondContact O-N 2.89Å; I169-H173 PolarHBondContact O-ND1 3.1Å; L170-H173 CarbonylContact O-C 3.53Å; L170-H173 PolarHBondContact O-N 3.46Å; L170-H173 VanDerWaalsContact O-N 3.07Å; I171-H173 PolarHBondContact O-N 3.28Å
174	G	96.7	Very high	95.1	Very high	41 Å²	41	30.4 Å²	30.4	42%	0.423	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	29.3	176	0	0	0	0	0	114.6	N145 L170 I171	N145-G174 PolarHBondContact ND2-O 3.3Å; L170-G174 PolarHBondContact O-N 2.95Å; I171-G174 PolarHBondContact O-N 3.48Å; I171-G174 VanDerWaalsContact O-N 3.09Å
175	A	98.1	Very high	94.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.			trans	-58.2	140.1	164.4	0	0	0	0	0	111.4	P144 N145 L155 L170 R207	P144-A175 HydrophobicContact CB-CB 4.37Å; N145-A175 WeakPolarHBondContact OD1-CA 3.34Å; L155-A175 HydrophobicContact CB-CB 4.25Å; L155-A175 HydrophobicContact CD2-CB 3.99Å; L170-A175 VanDerWaalsContact C-CB 3.48Å; L170-A175 HydrophobicContact CB-CB 3.89Å; L170-A175 VanDerWaalsContact O-CB 3.23Å; L170-A175 WeakPolarHBondContact O-CB 3.36Å; L170-A175 PolarHBondContact O-N 2.98Å; A175-R207 PolarHBondContact O-NH1 2.99Å
176	D	96.8	Very high	94.7	Very high	65 Å²	65	25.9 Å²	25.9	35%	0.348	15%	0.146	S	C	.	.			trans	-79.8	130.3	178	-170.2	-1.6	0	0	0	110.1	N145 L178 A179	N145-D176 WeakPolarHBondContact OD1-CB 3.46Å; N145-D176 PolarHBondContact OD1-N 2.69Å; D176-L178 PolarHBondContact OD1-N 3.07Å; D176-A179 HydrophobicContact CB-CB 4.12Å
177	L	96.7	Very high	94.6	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	15%	0.146	C	C	.	.	S	Bend	trans	-92	-12.2	179.4	-52.6	-175.6	0	0	0	112.1	L155 I171 V200 E203 M204 I209	L155-L177 HydrophobicContact CD2-CD2 3.61Å; I171-L177 HydrophobicContact CD1-CD2 4.12Å; I171-L177 HydrophobicContact CG1-CD2 3.92Å; L177-V200 HydrophobicContact CD2-CG1 4.41Å; L177-E203 HydrophobicContact CD1-CB 4.2Å; L177-M204 HydrophobicContact CB-CG 4.03Å; L177-M204 HydrophobicContact CD1-CB 4.34Å; L177-M204 HydrophobicContact CD1-CG 3.54Å; L177-M204 HydrophobicContact CG-CG 4.37Å; L177-I209 HydrophobicContact CB-CD1 4.07Å; L177-I209 HydrophobicContact CD1-CD1 4.19Å
178	L	95.5	Very high	94.5	Very high	15 Å²	15	27.3 Å²	27.3	8%	0.079	15%	0.152	C	C	.	.	S	Bend	trans	-113.4	5.1	-174.1	-61.7	172.8	0	0	0	112.5	D176 M180 M186 M204 I209 E213 I214	D176-L178 PolarHBondContact OD1-N 3.07Å; L178-M180 PolarHBondContact O-N 2.74Å; L178-M186 HydrophobicContact CD2-CE 3.99Å; L178-M186 HydrophobicContact CD2-SD 3.63Å; L178-M204 HydrophobicContact CD2-CE 4.36Å; L178-I209 HydrophobicContact CD1-CD1 3.94Å; L178-I209 HydrophobicContact CD1-CG1 4.2Å; L178-I209 HydrophobicContact CD1-CG2 4.41Å; L178-I209 HydrophobicContact CD2-CD1 4.18Å; L178-I209 HydrophobicContact CD2-CG2 3.85Å; L178-I209 HydrophobicContact CG-CD1 3.94Å; L178-E213 HydrophobicContact CD1-CG 4.19Å; L178-I214 HydrophobicContact CD2-CG1 4.12Å
179	A	94.8	Very high	94.4	Very high	3 Å²	3	25.6 Å²	25.6	3%	0.025	15%	0.145	C	C	.	.			trans	-66.9	121.4	171.6	0	0	0	0	0	109.6	T153 H156 D176 P187	T153-A179 HydrophobicContact CG2-CB 4.12Å; H156-A179 PolarHBondContact CE1-O 3.09Å; H156-A179 PolarHBondContact NE2-O 3.4Å; D176-A179 HydrophobicContact CB-CB 4.12Å; A179-P187 WeakPolarHBondContact O-CD 3.43Å
180	M	92	Very high	94.1	Very high	7 Å²	7	26.8 Å²	26.8	3%	0.034	15%	0.153	C	C	.	.			trans	-87.9	149.8	170.8	-66.9	178.4	-74.7	0	0	111.9	L178 N185 M186 W217 P221 L689	L178-M180 PolarHBondContact O-N 2.74Å; M180-N185 VanDerWaalsContact CA-O 3.31Å; M180-N185 WeakPolarHBondContact CA-O 3.47Å; M180-M186 HydrophobicContact CG-CE 4.35Å; M180-M186 HydrophobicContact CG-CG 4.08Å; M180-W217 VanDerWaalsContact CE-O 3.24Å; M180-W217 WeakPolarHBondContact CE-O 3.22Å; M180-P221 HydrophobicContact CE-CG 4.22Å; M180-L689 HydrophobicContact CE-CD1 3.42Å; M180-L689 VanDerWaalsContact CE-CD1 3.42Å; M180-L689 HydrophobicContact CE-CG 4.2Å
181	N	91	Very high	93.9	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	16%	0.157	C	C	.	.			trans	-90.1	-177.4	165.6	73.8	2.7	0	0	0	112.3	W152 D183 G184 N185	W152-N181 HydrophobicContact CG-CB 4.29Å; W152-N181 PolarHBondContact NE1-ND2 3.29Å; N181-D183 PolarHBondContact O-N 2.88Å; N181-D183 PolarHBondContact OD1-N 3.3Å; N181-G184 WeakPolarHBondContact O-CA 3.41Å; N181-G184 PolarHBondContact O-N 3.45Å; N181-G184 PolarHBondContact OD1-N 3.07Å; N181-G184 VanDerWaalsContact OD1-N 3.16Å; N181-N185 PolarHBondContact N-O 3.37Å; N181-N185 PolarHBondContact OD1-N 3.39Å; N181-N185 PolarHBondContact OD1-O 3.16Å
182	V	84.7	Confident	93.5	Very high	14 Å²	14	31 Å²	31	9%	0.085	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-35.8	179.3	162.4	0	0	0	0	113.6	E150 L151 G184 N684 C687	E150-V182 WeakPolarHBondContact O-CB 3.36Å; E150-V182 WeakPolarHBondContact O-CG2 3.23Å; E150-V182 PolarHBondContact O-N 3.42Å; L151-V182 HydrophobicContact CB-CG2 4.28Å; L151-V182 HydrophobicContact CD1-CG2 3.87Å; L151-V182 HydrophobicContact CG-CG2 3.87Å; V182-G184 PolarHBondContact O-N 2.98Å; V182-N684 WeakPolarHBondContact CG1-OD1 3.45Å; V182-N684 HydrophobicContact CG2-CB 4.43Å; V182-C687 PolarHBondContact O-SG 3.28Å; V182-C687 VanDerWaalsContact O-SG 3.4Å
183	D	82.6	Confident	93.3	Very high	47 Å²	47	31 Å²	31	25%	0.251	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.8	173.6	-73	-79.5	0	0	0	112.8	N181 N185 R753	N181-D183 PolarHBondContact O-N 2.88Å; N181-D183 PolarHBondContact OD1-N 3.3Å; D183-N185 VanDerWaalsContact CB-ND2 3.34Å; D183-N185 WeakPolarHBondContact CB-ND2 3.5Å; D183-R753 IonicContact OD1-CZ 3.07Å; D183-R753 IonicContact OD1-NH1 2.73Å; D183-R753 PolarHBondContact OD1-NH1 2.89Å
184	G	87.9	Confident	93.2	Very high	21 Å²	21	27.4 Å²	27.4	22%	0.216	17%	0.17	C	C	.	.	S	Bend	trans	93.5	8.2	-177.2	0	0	0	0	0	114.6	N181 V182 H218	N181-G184 WeakPolarHBondContact O-CA 3.41Å; N181-G184 PolarHBondContact O-N 3.45Å; N181-G184 PolarHBondContact OD1-N 3.07Å; N181-G184 VanDerWaalsContact OD1-N 3.16Å; V182-G184 PolarHBondContact O-N 2.98Å; G184-H218 PolarHBondContact O-CD2 2.97Å
185	N	92.3	Very high	93.2	Very high	27 Å²	27	30 Å²	30	14%	0.144	18%	0.18	C	C	.	.			trans	-87.5	147.3	-179.1	-64.1	-73.1	0	0	0	111.6	H156 M180 N181 D183 E189	H156-N185 PolarHBondContact NE2-O 2.78Å; M180-N185 VanDerWaalsContact CA-O 3.31Å; M180-N185 WeakPolarHBondContact CA-O 3.47Å; N181-N185 PolarHBondContact N-O 3.37Å; N181-N185 PolarHBondContact OD1-N 3.39Å; N181-N185 PolarHBondContact OD1-O 3.16Å; D183-N185 VanDerWaalsContact CB-ND2 3.34Å; D183-N185 WeakPolarHBondContact CB-ND2 3.5Å; N185-E189 WeakPolarHBondContact CA-OE2 3.33Å; N185-E189 HydrophobicContact CB-CB 4.35Å
186	M	95.7	Very high	93.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.181	C	C	.	.			trans	-91	165.1	166.9	-61.3	-171.8	-176.3	0	0	111.7	L178 M180 Y188 E189 C190 I214 W217	L178-M186 HydrophobicContact CD2-CE 3.99Å; L178-M186 HydrophobicContact CD2-SD 3.63Å; M180-M186 HydrophobicContact CG-CE 4.35Å; M180-M186 HydrophobicContact CG-CG 4.08Å; M186-Y188 HydrophobicContact CB-CD1 3.73Å; M186-Y188 HydrophobicContact CB-CE1 3.85Å; M186-Y188 HydrophobicContact CG-CE1 4.4Å; M186-Y188 PolarHBondContact O-N 3.24Å; M186-Y188 VanDerWaalsContact O-N 3.1Å; M186-Y188 HydrophobicContact SD-CD1 4.5Å; M186-Y188 HydrophobicContact SD-CE1 4.06Å; M186-E189 PolarHBondContact N-OE2 3.28Å; M186-E189 PolarHBondContact O-N 2.92Å; M186-E189 VanDerWaalsContact O-N 3.1Å; M186-C190 PolarHBondContact O-N 2.9Å; M186-I214 HydrophobicContact CE-CG2 4.07Å; M186-I214 HydrophobicContact SD-CG2 4.15Å; M186-W217 HydrophobicContact CE-CB 3.61Å; M186-W217 HydrophobicContact CE-CG 4.34Å
187	P	96.2	Very high	93.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.7	-175.2	-22.2	32.6	0	0	0	115.1	L155 A159 A179 C191	L155-P187 HydrophobicContact CB-CB 4.39Å; L155-P187 HydrophobicContact CB-CG 4.36Å; L155-P187 HydrophobicContact CD2-CB 3.99Å; L155-P187 HydrophobicContact CD2-CG 4.02Å; L155-P187 HydrophobicContact CG-CB 3.79Å; L155-P187 HydrophobicContact CG-CG 4.12Å; A159-P187 HydrophobicContact CB-CB 4.47Å; A159-P187 WeakPolarHBondContact CB-O 3.35Å; A179-P187 WeakPolarHBondContact O-CD 3.43Å; P187-C191 PolarHBondContact O-SG 3Å; P187-C191 VanDerWaalsContact O-SG 3.36Å
188	Y	95.6	Very high	93.2	Very high	31 Å²	31	32.5 Å²	32.5	12%	0.122	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-35	176.9	85.9	-78.3	0	0	0	111.9	M186 C190 C191 L197 M204 I214	M186-Y188 HydrophobicContact CB-CD1 3.73Å; M186-Y188 HydrophobicContact CB-CE1 3.85Å; M186-Y188 HydrophobicContact CG-CE1 4.4Å; M186-Y188 PolarHBondContact O-N 3.24Å; M186-Y188 VanDerWaalsContact O-N 3.1Å; M186-Y188 HydrophobicContact SD-CD1 4.5Å; M186-Y188 HydrophobicContact SD-CE1 4.06Å; Y188-C190 VanDerWaalsContact C-N 3.29Å; Y188-C190 PolarHBondContact O-N 3.42Å; Y188-C191 VanDerWaalsContact O-CB 3.28Å; Y188-C191 WeakPolarHBondContact O-CB 3.42Å; Y188-C191 PolarHBondContact O-N 3.14Å; Y188-C191 VanDerWaalsContact O-N 3.09Å; Y188-L197 HydrophobicContact CD2-CD1 4.34Å; Y188-L197 WeakPolarHBondContact O-CD1 3.31Å; Y188-M204 HydrophobicContact CD1-CE 3.77Å; Y188-M204 HydrophobicContact CD1-SD 3.91Å; Y188-M204 HydrophobicContact CD2-SD 4.46Å; Y188-M204 HydrophobicContact CE1-CE 4.04Å; Y188-M204 HydrophobicContact CG-CE 4.25Å; Y188-M204 HydrophobicContact CG-SD 3.83Å; Y188-I214 HydrophobicContact CE1-CG2 4.49Å
189	E	94.8	Very high	93.3	Very high	45 Å²	45	33.2 Å²	33.2	21%	0.21	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.8	178.3	-71.1	152.1	168.4	0	0	112.2	N185 M186 C191 H218	N185-E189 WeakPolarHBondContact CA-OE2 3.33Å; N185-E189 HydrophobicContact CB-CB 4.35Å; M186-E189 PolarHBondContact N-OE2 3.28Å; M186-E189 PolarHBondContact O-N 2.92Å; M186-E189 VanDerWaalsContact O-N 3.1Å; E189-C191 PolarHBondContact O-N 3.43Å; E189-H218 IonicContact OE1-CE1 2.64Å; E189-H218 PolarHBondContact OE1-CE1 3.03Å; E189-H218 IonicContact OE1-NE2 3.35Å; E189-H218 IonicContact OE2-CE1 2.71Å; E189-H218 IonicContact OE2-NE2 3.24Å
190	C	92.8	Very high	93.4	Very high	25 Å²	25	33.1 Å²	33.1	17%	0.169	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.3	171.2	-58.1	0	0	0	0	114.3	T160 M186 Y188	T160-C190 WeakPolarHBondContact OG1-CB 2.8Å; M186-C190 PolarHBondContact O-N 2.9Å; Y188-C190 VanDerWaalsContact C-N 3.29Å; Y188-C190 PolarHBondContact O-N 3.42Å
191	C	94.6	Very high	93.6	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.074	20%	0.204	C	C	.	.	S	Bend	trans	-88	127.5	179.4	-65.1	0	0	0	0	112.1	A159 P187 Y188 E189 L197	A159-C191 VanDerWaalsContact CB-SG 3.59Å; P187-C191 PolarHBondContact O-SG 3Å; P187-C191 VanDerWaalsContact O-SG 3.36Å; Y188-C191 VanDerWaalsContact O-CB 3.28Å; Y188-C191 WeakPolarHBondContact O-CB 3.42Å; Y188-C191 PolarHBondContact O-N 3.14Å; Y188-C191 VanDerWaalsContact O-N 3.09Å; E189-C191 PolarHBondContact O-N 3.43Å; C191-L197 HydrophobicContact CB-CB 3.72Å; C191-L197 HydrophobicContact CB-CD1 4.06Å; C191-L197 HydrophobicContact CB-CG 4.46Å
192	M	90.3	Very high	93.9	Very high	85 Å²	85	37.9 Å²	37.9	42%	0.419	22%	0.223	S	C	.	.			trans	-64.6	148.7	162.5	-68.2	-65	-73.5	0	0	111.4	H162 G194 L755	H162-M192 VanDerWaalsContact NE2-CB 3.31Å; H162-M192 WeakPolarHBondContact NE2-CB 3.38Å; H162-M192 VanDerWaalsContact NE2-CG 3.29Å; H162-M192 WeakPolarHBondContact NE2-CG 3.41Å; H162-M192 PolarHBondContact NE2-N 3.3Å; H162-M192 VanDerWaalsContact NE2-N 3.15Å; M192-G194 PolarHBondContact O-N 3.16Å; M192-G194 VanDerWaalsContact O-N 3.09Å; M192-L755 HydrophobicContact CE-CD1 4.37Å; M192-L755 HydrophobicContact SD-CD1 3.59Å; M192-L755 VanDerWaalsContact SD-CD1 3.59Å; M192-L755 HydrophobicContact SD-CD2 3.53Å; M192-L755 VanDerWaalsContact SD-CD2 3.53Å; M192-L755 HydrophobicContact SD-CG 4.22Å
193	P	93.2	Very high	94.5	Very high	114 Å²	114	38.9 Å²	38.9	74%	0.74	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	115.1	178.6	-28.6	35.8	0	0	0	113
194	G	94.8	Very high	95.2	Very high	22 Å²	22	36.9 Å²	36.9	23%	0.227	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	165.9	-168.1	-173	0	0	0	0	0	114	M192 T196 L197 N198	M192-G194 PolarHBondContact O-N 3.16Å; M192-G194 VanDerWaalsContact O-N 3.09Å; G194-T196 PolarHBondContact O-N 3.39Å; G194-T196 VanDerWaalsContact O-N 3.12Å; G194-L197 PolarHBondContact O-N 3.11Å; G194-N198 VanDerWaalsContact O-CG 3.3Å; G194-N198 PolarHBondContact O-N 3.01Å; G194-N198 VanDerWaalsContact O-N 3.09Å; G194-N198 PolarHBondContact O-OD1 3.07Å
195	P	96.7	Very high	95.6	Very high	96 Å²	96	39.5 Å²	39.5	62%	0.623	23%	0.225	S	C	*	.	H	α-helix	trans	-58.5	-28.6	-173.5	-26.1	35.6	0	0	0	114.9	T164 L199	T164-P195 HydrophobicContact CG2-CB 4.35Å; P195-L199 WeakPolarHBondContact O-CB 3.47Å; P195-L199 PolarHBondContact O-N 2.86Å; P195-L199 VanDerWaalsContact O-N 3.1Å
196	T	96.8	Very high	95.8	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-76.6	-44.4	-180	-52	0	0	0	0	111.7	H162 T164 C167 G194 L199 V200	H162-T196 PolarHBondContact O-OG1 3.15Å; T164-T196 PolarHBondContact OG1-OG1 2.7Å; C167-T196 HydrophobicContact CB-CG2 4.44Å; C167-T196 VanDerWaalsContact SG-CG2 3.5Å; G194-T196 PolarHBondContact O-N 3.39Å; G194-T196 VanDerWaalsContact O-N 3.12Å; T196-L199 WeakPolarHBondContact O-CB 3.22Å; T196-L199 PolarHBondContact O-N 3.35Å; T196-V200 WeakPolarHBondContact O-CG2 3.22Å; T196-V200 PolarHBondContact O-N 2.94Å; T196-V200 VanDerWaalsContact O-N 3.08Å
197	L	97.2	Very high	95.8	Very high	25 Å²	25	50.2 Å²	50.2	13%	0.131	27%	0.267	C	S	.	.	H	α-helix	trans	-56.9	-55.3	171.2	178.2	62.3	0	0	0	110.3	Y188 C191 G194 L199 V200 E201	Y188-L197 HydrophobicContact CD2-CD1 4.34Å; Y188-L197 WeakPolarHBondContact O-CD1 3.31Å; C191-L197 HydrophobicContact CB-CB 3.72Å; C191-L197 HydrophobicContact CB-CD1 4.06Å; C191-L197 HydrophobicContact CB-CG 4.46Å; G194-L197 PolarHBondContact O-N 3.11Å; L197-L199 PolarHBondContact O-N 3.11Å; L197-L199 VanDerWaalsContact O-N 3.11Å; L197-V200 PolarHBondContact O-N 3.2Å; L197-E201 HydrophobicContact CD1-CG 3.91Å; L197-E201 HydrophobicContact CG-CG 4.17Å; L197-E201 WeakPolarHBondContact O-CG 3.08Å; L197-E201 PolarHBondContact O-N 2.98Å
198	N	97.2	Very high	95.8	Very high	89 Å²	89	52.6 Å²	52.6	48%	0.476	29%	0.291	S	S	.	.	H	α-helix	trans	-54.8	-35.5	179.8	-63.4	8.3	0	0	0	112.7	G194 T202	G194-N198 VanDerWaalsContact O-CG 3.3Å; G194-N198 PolarHBondContact O-N 3.01Å; G194-N198 VanDerWaalsContact O-N 3.09Å; G194-N198 PolarHBondContact O-OD1 3.07Å; N198-T202 WeakPolarHBondContact O-CB 3.45Å; N198-T202 PolarHBondContact O-N 3.12Å; N198-T202 VanDerWaalsContact O-N 3.1Å; N198-T202 PolarHBondContact O-OG1 3.39Å
199	L	97.9	Very high	95.8	Very high	30 Å²	30	52 Å²	52	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-51.7	175.4	170.8	68.5	0	0	0	110.8	T164 C167 K168 P195 T196 L197 T202 E203	T164-L199 HydrophobicContact CG2-CB 4.23Å; T164-L199 HydrophobicContact CG2-CD2 3.75Å; T164-L199 WeakPolarHBondContact O-CD2 3.34Å; C167-L199 HydrophobicContact CB-CD2 4.17Å; K168-L199 HydrophobicContact CB-CD2 3.89Å; P195-L199 WeakPolarHBondContact O-CB 3.47Å; P195-L199 PolarHBondContact O-N 2.86Å; P195-L199 VanDerWaalsContact O-N 3.1Å; T196-L199 WeakPolarHBondContact O-CB 3.22Å; T196-L199 PolarHBondContact O-N 3.35Å; L197-L199 PolarHBondContact O-N 3.11Å; L197-L199 VanDerWaalsContact O-N 3.11Å; L199-T202 PolarHBondContact O-N 3.5Å; L199-E203 HydrophobicContact CD1-CG 4.23Å; L199-E203 WeakPolarHBondContact O-CG 3.3Å; L199-E203 PolarHBondContact O-N 2.85Å
200	V	96.9	Very high	95.7	Very high	1 Å²	1	53 Å²	53	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-47.3	-176.7	-178	0	0	0	0	110.3	I171 L177 T196 L197 T202 E203 M204	I171-V200 HydrophobicContact CD1-CG2 4.33Å; L177-V200 HydrophobicContact CD2-CG1 4.41Å; T196-V200 WeakPolarHBondContact O-CG2 3.22Å; T196-V200 PolarHBondContact O-N 2.94Å; T196-V200 VanDerWaalsContact O-N 3.08Å; L197-V200 PolarHBondContact O-N 3.2Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.02Å; V200-E203 PolarHBondContact O-N 2.86Å; V200-M204 HydrophobicContact CG1-CG 4.44Å; V200-M204 HydrophobicContact CG1-SD 4.07Å; V200-M204 WeakPolarHBondContact O-CG 3.49Å; V200-M204 PolarHBondContact O-N 3.45Å
201	E	96.6	Very high	95.7	Very high	42 Å²	42	54.4 Å²	54.4	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-53.4	-47.5	173.2	-68.8	173.4	152.1	0	0	111.7	L197 E203 M204 D205 V744	L197-E201 HydrophobicContact CD1-CG 3.91Å; L197-E201 HydrophobicContact CG-CG 4.17Å; L197-E201 WeakPolarHBondContact O-CG 3.08Å; L197-E201 PolarHBondContact O-N 2.98Å; E201-E203 VanDerWaalsContact C-N 3.27Å; E201-E203 PolarHBondContact O-N 3.29Å; E201-M204 WeakPolarHBondContact O-CB 3.44Å; E201-M204 PolarHBondContact O-N 2.77Å; E201-M204 VanDerWaalsContact O-N 3.16Å; E201-D205 PolarHBondContact O-N 2.99Å; E201-V744 HydrophobicContact CB-CG2 4.34Å
202	T	97.3	Very high	95.7	Very high	65 Å²	65	61.1 Å²	61.1	40%	0.399	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-33	178.2	-65.7	0	0	0	0	112.5	N198 L199 V200 K206	N198-T202 WeakPolarHBondContact O-CB 3.45Å; N198-T202 PolarHBondContact O-N 3.12Å; N198-T202 VanDerWaalsContact O-N 3.1Å; N198-T202 PolarHBondContact O-OG1 3.39Å; L199-T202 PolarHBondContact O-N 3.5Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.02Å; T202-K206 HydrophobicContact CG2-CD 4.25Å; T202-K206 WeakPolarHBondContact O-CB 3.25Å; T202-K206 WeakPolarHBondContact O-CD 3.4Å; T202-K206 WeakPolarHBondContact O-CG 3.34Å; T202-K206 PolarHBondContact O-N 3.11Å; T202-K206 VanDerWaalsContact O-N 3.1Å
203	E	97.4	Very high	95.8	Very high	36 Å²	36	60.7 Å²	60.7	17%	0.168	33%	0.331	C	S	.	.	H	α-helix	trans	-80.6	-27.2	176.7	-64.2	-61.5	149.3	0	0	112.6	I171 L177 L199 V200 E201 K206 R207	I171-E203 HydrophobicContact CD1-CB 4.48Å; I171-E203 HydrophobicContact CD1-CG 4.38Å; I171-E203 HydrophobicContact CG2-CB 4.11Å; I171-E203 HydrophobicContact CG2-CG 3.98Å; L177-E203 HydrophobicContact CD1-CB 4.2Å; L199-E203 HydrophobicContact CD1-CG 4.23Å; L199-E203 WeakPolarHBondContact O-CG 3.3Å; L199-E203 PolarHBondContact O-N 2.85Å; V200-E203 PolarHBondContact O-N 2.86Å; E201-E203 VanDerWaalsContact C-N 3.27Å; E201-E203 PolarHBondContact O-N 3.29Å; E203-K206 IonicContact OE1-NZ 3.96Å; E203-K206 PolarHBondContact OE1-NZ 3.44Å; E203-K206 WeakPolarHBondContact OE2-CD 3.4Å; E203-K206 IonicContact OE2-NZ 2.63Å; E203-R207 WeakPolarHBondContact O-CB 3.36Å; E203-R207 VanDerWaalsContact O-CG 3.28Å; E203-R207 WeakPolarHBondContact O-CG 3.48Å; E203-R207 PolarHBondContact O-N 2.8Å; E203-R207 VanDerWaalsContact O-N 3.11Å
204	M	97.1	Very high	95.8	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.02	30%	0.296	C	S	.	.	H	α-helix	trans	-67	-50.1	168.6	-64.9	170.9	79.6	0	0	110.7	L177 L178 Y188 V200 E201 K206 R207 G208 I209 I214	L177-M204 HydrophobicContact CB-CG 4.03Å; L177-M204 HydrophobicContact CD1-CB 4.34Å; L177-M204 HydrophobicContact CD1-CG 3.54Å; L177-M204 HydrophobicContact CG-CG 4.37Å; L178-M204 HydrophobicContact CD2-CE 4.36Å; Y188-M204 HydrophobicContact CD1-CE 3.77Å; Y188-M204 HydrophobicContact CD1-SD 3.91Å; Y188-M204 HydrophobicContact CD2-SD 4.46Å; Y188-M204 HydrophobicContact CE1-CE 4.04Å; Y188-M204 HydrophobicContact CG-CE 4.25Å; Y188-M204 HydrophobicContact CG-SD 3.83Å; V200-M204 HydrophobicContact CG1-CG 4.44Å; V200-M204 HydrophobicContact CG1-SD 4.07Å; V200-M204 WeakPolarHBondContact O-CG 3.49Å; V200-M204 PolarHBondContact O-N 3.45Å; E201-M204 WeakPolarHBondContact O-CB 3.44Å; E201-M204 PolarHBondContact O-N 2.77Å; E201-M204 VanDerWaalsContact O-N 3.16Å; M204-K206 VanDerWaalsContact C-N 3.32Å; M204-K206 PolarHBondContact O-N 3.28Å; M204-R207 CarbonylContact O-C 3.51Å; M204-R207 PolarHBondContact O-N 3.02Å; M204-R207 VanDerWaalsContact O-N 3.09Å; M204-G208 PolarHBondContact O-N 2.6Å; M204-I209 HydrophobicContact CB-CB 4.22Å; M204-I209 HydrophobicContact CB-CD1 4.19Å; M204-I209 HydrophobicContact CE-CG2 4.07Å; M204-I209 HydrophobicContact CG-CD1 4.11Å; M204-I209 PolarHBondContact O-N 2.93Å; M204-I209 VanDerWaalsContact O-N 3.15Å; M204-I214 HydrophobicContact CE-CD1 3.61Å; M204-I214 HydrophobicContact CE-CG1 4.12Å
205	D	96.2	Very high	95.7	Very high	76 Å²	76	58.3 Å²	58.3	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-53.9	-45.2	173.4	-97	-8.3	0	0	0	111.6	E201 R207 G208	E201-D205 PolarHBondContact O-N 2.99Å; D205-R207 VanDerWaalsContact C-N 3.35Å; D205-R207 PolarHBondContact O-N 2.94Å; D205-G208 PolarHBondContact O-N 3.33Å; D205-G208 VanDerWaalsContact O-N 3.14Å
206	K	96.6	Very high	95.5	Very high	137 Å²	137	58 Å²	58	60%	0.596	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-34.3	177.5	-78.9	165.9	-175.9	172.5	0	113.7	T202 E203 M204 G208	T202-K206 HydrophobicContact CG2-CD 4.25Å; T202-K206 WeakPolarHBondContact O-CB 3.25Å; T202-K206 WeakPolarHBondContact O-CD 3.4Å; T202-K206 WeakPolarHBondContact O-CG 3.34Å; T202-K206 PolarHBondContact O-N 3.11Å; T202-K206 VanDerWaalsContact O-N 3.1Å; E203-K206 IonicContact OE1-NZ 3.96Å; E203-K206 PolarHBondContact OE1-NZ 3.44Å; E203-K206 WeakPolarHBondContact OE2-CD 3.4Å; E203-K206 IonicContact OE2-NZ 2.63Å; M204-K206 VanDerWaalsContact C-N 3.32Å; M204-K206 PolarHBondContact O-N 3.28Å; K206-G208 VanDerWaalsContact C-N 3.27Å
207	R	95.7	Very high	95.1	Very high	116 Å²	116	61.8 Å²	61.8	44%	0.438	31%	0.313	S	S	.	.	H	α-helix	trans	-78.3	-14.4	175.6	-71.1	176.5	-171.7	-163.6	-0.8	112.1	I171 A175 E203 M204 D205 I209	I171-R207 PolarHBondContact O-NH2 3.27Å; I171-R207 VanDerWaalsContact O-NH2 3.09Å; A175-R207 PolarHBondContact O-NH1 2.99Å; E203-R207 WeakPolarHBondContact O-CB 3.36Å; E203-R207 VanDerWaalsContact O-CG 3.28Å; E203-R207 WeakPolarHBondContact O-CG 3.48Å; E203-R207 PolarHBondContact O-N 2.8Å; E203-R207 VanDerWaalsContact O-N 3.11Å; M204-R207 CarbonylContact O-C 3.51Å; M204-R207 PolarHBondContact O-N 3.02Å; M204-R207 VanDerWaalsContact O-N 3.09Å; D205-R207 VanDerWaalsContact C-N 3.35Å; D205-R207 PolarHBondContact O-N 2.94Å; R207-I209 HydrophobicContact CB-CD1 4.36Å; R207-I209 HydrophobicContact CB-CG1 4.23Å
208	G	95.3	Very high	94.7	Very high	49 Å²	49	63.4 Å²	63.4	51%	0.505	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	19.6	179.4	0	0	0	0	0	113.8	M204 D205 K206 T210	M204-G208 PolarHBondContact O-N 2.6Å; D205-G208 PolarHBondContact O-N 3.33Å; D205-G208 VanDerWaalsContact O-N 3.14Å; K206-G208 VanDerWaalsContact C-N 3.27Å; G208-T210 PolarHBondContact O-N 3.14Å
209	I	95.7	Very high	94.4	Very high	18 Å²	18	64.1 Å²	64.1	9%	0.092	32%	0.316	C	S	.	.			trans	-63.3	130.5	175.1	-65.6	173.9	0	0	0	108.2	L177 L178 M204 R207 I214	L177-I209 HydrophobicContact CB-CD1 4.07Å; L177-I209 HydrophobicContact CD1-CD1 4.19Å; L178-I209 HydrophobicContact CD1-CD1 3.94Å; L178-I209 HydrophobicContact CD1-CG1 4.2Å; L178-I209 HydrophobicContact CD1-CG2 4.41Å; L178-I209 HydrophobicContact CD2-CD1 4.18Å; L178-I209 HydrophobicContact CD2-CG2 3.85Å; L178-I209 HydrophobicContact CG-CD1 3.94Å; M204-I209 HydrophobicContact CB-CB 4.22Å; M204-I209 HydrophobicContact CB-CD1 4.19Å; M204-I209 HydrophobicContact CE-CG2 4.07Å; M204-I209 HydrophobicContact CG-CD1 4.11Å; M204-I209 PolarHBondContact O-N 2.93Å; M204-I209 VanDerWaalsContact O-N 3.15Å; R207-I209 HydrophobicContact CB-CD1 4.36Å; R207-I209 HydrophobicContact CB-CG1 4.23Å; I209-I214 HydrophobicContact CG2-CD1 4.13Å; I209-I214 HydrophobicContact CG2-CG1 3.88Å
210	T	94.3	Very high	94.1	Very high	66 Å²	66	64.5 Å²	64.5	41%	0.405	32%	0.32	S	S	.	.			trans	-104.6	159.6	179.8	68.5	0	0	0	0	111.4	G208 E212 E213 I214	G208-T210 PolarHBondContact O-N 3.14Å; T210-E212 PolarHBondContact O-N 3.28Å; T210-E212 PolarHBondContact OG1-N 3.16Å; T210-E213 PolarHBondContact O-N 3.03Å; T210-E213 VanDerWaalsContact O-N 3.11Å; T210-E213 PolarHBondContact OG1-N 3.21Å; T210-I214 WeakPolarHBondContact O-CG1 3.2Å; T210-I214 PolarHBondContact O-N 3.09Å
211	Q	92.4	Very high	93.7	Very high	55 Å²	55	65 Å²	65	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-58.5	-35.4	169.2	-170.1	64.5	54.4	0	0	111.5	E213 I214 D215	Q211-E213 VanDerWaalsContact C-N 3.3Å; Q211-E213 PolarHBondContact O-N 3.33Å; Q211-I214 PolarHBondContact O-N 3.33Å; Q211-D215 PolarHBondContact NE2-OD1 3.14Å; Q211-D215 WeakPolarHBondContact O-CB 3.28Å; Q211-D215 PolarHBondContact O-N 3.18Å
212	E	93.5	Very high	93.5	Very high	153 Å²	153	64.1 Å²	64.1	72%	0.715	32%	0.319	S	S	*	.	H	α-helix	trans	-61.8	-37.2	175.9	-59.8	179.3	158.1	0	0	111.7	T210 D216	T210-E212 PolarHBondContact O-N 3.28Å; T210-E212 PolarHBondContact OG1-N 3.16Å; E212-D216 WeakPolarHBondContact O-CB 3.44Å; E212-D216 PolarHBondContact O-N 3.4Å
213	E	92.8	Very high	93.3	Very high	76 Å²	76	63.1 Å²	63.1	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-41.9	174.3	-179.4	171	-157.9	0	0	111.9	L178 T210 Q211 D216 W217	L178-E213 HydrophobicContact CD1-CG 4.19Å; T210-E213 PolarHBondContact O-N 3.03Å; T210-E213 VanDerWaalsContact O-N 3.11Å; T210-E213 PolarHBondContact OG1-N 3.21Å; Q211-E213 VanDerWaalsContact C-N 3.3Å; Q211-E213 PolarHBondContact O-N 3.33Å; E213-D216 PolarHBondContact O-N 3.44Å; E213-W217 PolarHBondContact O-N 3.45Å
214	I	93.5	Very high	93.1	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-46.9	175.4	-64.3	166.7	0	0	0	110.7	L178 M186 Y188 M204 I209 T210 Q211 W217 H218	L178-I214 HydrophobicContact CD2-CG1 4.12Å; M186-I214 HydrophobicContact CE-CG2 4.07Å; M186-I214 HydrophobicContact SD-CG2 4.15Å; Y188-I214 HydrophobicContact CE1-CG2 4.49Å; M204-I214 HydrophobicContact CE-CD1 3.61Å; M204-I214 HydrophobicContact CE-CG1 4.12Å; I209-I214 HydrophobicContact CG2-CD1 4.13Å; I209-I214 HydrophobicContact CG2-CG1 3.88Å; T210-I214 WeakPolarHBondContact O-CG1 3.2Å; T210-I214 PolarHBondContact O-N 3.09Å; Q211-I214 PolarHBondContact O-N 3.33Å; I214-W217 PolarHBondContact O-N 3.24Å; I214-H218 VanDerWaalsContact CG2-CE1 3.42Å; I214-H218 WeakPolarHBondContact CG2-CE1 3.46Å; I214-H218 PolarHBondContact O-N 2.81Å; I214-H218 PolarHBondContact O-ND1 3.3Å
215	D	92	Very high	92.9	Very high	83 Å²	83	65 Å²	65	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-41.3	178.3	-66.5	-5.7	0	0	0	111.4	Q211 R219	Q211-D215 PolarHBondContact NE2-OD1 3.14Å; Q211-D215 WeakPolarHBondContact O-CB 3.28Å; Q211-D215 PolarHBondContact O-N 3.18Å; D215-R219 VanDerWaalsContact O-CB 3.31Å; D215-R219 WeakPolarHBondContact O-CB 3.41Å; D215-R219 PolarHBondContact O-N 2.87Å; D215-R219 VanDerWaalsContact O-N 3.15Å
216	D	92.1	Very high	92.8	Very high	90 Å²	90	63 Å²	63	48%	0.481	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-41.2	174	-94.1	-12.8	0	0	0	111.7	E212 E213 R219 V220	E212-D216 WeakPolarHBondContact O-CB 3.44Å; E212-D216 PolarHBondContact O-N 3.4Å; E213-D216 PolarHBondContact O-N 3.44Å; D216-R219 PolarHBondContact O-N 3.48Å; D216-V220 WeakPolarHBondContact O-CG2 3.42Å; D216-V220 PolarHBondContact O-N 2.71Å
217	W	89.9	Confident	92.7	Very high	85 Å²	85	58.7 Å²	58.7	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-64.9	-49.1	176.6	-81.9	113.4	0	0	0	112.5	M180 M186 E213 I214 R219 V220 L689	M180-W217 VanDerWaalsContact CE-O 3.24Å; M180-W217 WeakPolarHBondContact CE-O 3.22Å; M186-W217 HydrophobicContact CE-CB 3.61Å; M186-W217 HydrophobicContact CE-CG 4.34Å; E213-W217 PolarHBondContact O-N 3.45Å; I214-W217 PolarHBondContact O-N 3.24Å; W217-R219 PolarHBondContact O-N 3.06Å; W217-R219 VanDerWaalsContact O-N 3.12Å; W217-V220 HydrophobicContact CE3-CG2 4.36Å; W217-V220 PolarHBondContact O-N 3.15Å; W217-V220 VanDerWaalsContact O-N 3.08Å; W217-L689 HydrophobicContact CE3-CD1 3.63Å; W217-L689 HydrophobicContact CE3-CD2 4.45Å; W217-L689 HydrophobicContact CZ3-CD1 3.64Å; W217-L689 HydrophobicContact CZ3-CD2 4.13Å; W217-L689 HydrophobicContact CZ3-CG 4.49Å
218	H	88.1	Confident	92.5	Very high	59 Å²	59	54.5 Å²	54.5	27%	0.273	29%	0.288	S	S	.	.	H	α-helix	trans	-57.9	-26.1	175.2	-70.4	139.5	0	0	0	112.9	G184 E189 I214	G184-H218 PolarHBondContact O-CD2 2.97Å; E189-H218 IonicContact OE1-CE1 2.64Å; E189-H218 PolarHBondContact OE1-CE1 3.03Å; E189-H218 IonicContact OE1-NE2 3.35Å; E189-H218 IonicContact OE2-CE1 2.71Å; E189-H218 IonicContact OE2-NE2 3.24Å; I214-H218 VanDerWaalsContact CG2-CE1 3.42Å; I214-H218 WeakPolarHBondContact CG2-CE1 3.46Å; I214-H218 PolarHBondContact O-N 2.81Å; I214-H218 PolarHBondContact O-ND1 3.3Å
219	R	91.1	Very high	92.4	Very high	103 Å²	103	52.3 Å²	52.3	39%	0.389	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12	-179.8	-163.8	168.1	-179.5	-75.8	-28	114.3	D215 D216 W217 E222 C223	D215-R219 VanDerWaalsContact O-CB 3.31Å; D215-R219 WeakPolarHBondContact O-CB 3.41Å; D215-R219 PolarHBondContact O-N 2.87Å; D215-R219 VanDerWaalsContact O-N 3.15Å; D216-R219 PolarHBondContact O-N 3.48Å; W217-R219 PolarHBondContact O-N 3.06Å; W217-R219 VanDerWaalsContact O-N 3.12Å; R219-E222 IonicContact NE-OE2 3.16Å; R219-E222 IonicContact NH2-OE2 3.6Å; R219-E222 PolarHBondContact NH2-OE2 3.31Å; R219-E222 PolarHBondContact O-N 3.33Å; R219-C223 VanDerWaalsContact CZ-SG 3.56Å; R219-C223 PolarHBondContact NH1-SG 3.01Å; R219-C223 PolarHBondContact O-N 2.89Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.49Å
220	V	90.6	Very high	92.3	Very high	39 Å²	39	54.6 Å²	54.6	24%	0.236	28%	0.275	C	S	.	.	H	α-helix	trans	-62.1	-47.7	-179.3	-175.2	0	0	0	0	112.8	D216 W217 E222 C223 E224 L689	D216-V220 WeakPolarHBondContact O-CG2 3.42Å; D216-V220 PolarHBondContact O-N 2.71Å; W217-V220 HydrophobicContact CE3-CG2 4.36Å; W217-V220 PolarHBondContact O-N 3.15Å; W217-V220 VanDerWaalsContact O-N 3.08Å; V220-E222 VanDerWaalsContact C-N 3.33Å; V220-E222 PolarHBondContact O-N 3.3Å; V220-C223 WeakPolarHBondContact O-CA 3.41Å; V220-C223 WeakPolarHBondContact O-CB 3.49Å; V220-C223 PolarHBondContact O-N 3.04Å; V220-E224 HydrophobicContact CG1-CG 3.97Å; V220-E224 PolarHBondContact O-N 3.39Å; V220-L689 HydrophobicContact CB-CD2 4.03Å; V220-L689 HydrophobicContact CG1-CD2 3.6Å
221	P	88.5	Confident	92.3	Very high	10 Å²	10	52.5 Å²	52.5	7%	0.065	26%	0.264	C	S	.	.	H	α-helix	trans	-54	-43	176.8	-31.8	39.6	0	0	0	114.5	M180 M225 F258 Y686	M180-P221 HydrophobicContact CE-CG 4.22Å; P221-M225 WeakPolarHBondContact O-CB 3.45Å; P221-M225 PolarHBondContact O-N 3.37Å; P221-M225 VanDerWaalsContact O-N 3.12Å; P221-F258 HydrophobicContact CB-CE1 4.21Å; P221-F258 HydrophobicContact CB-CE2 4.29Å; P221-F258 HydrophobicContact CB-CZ 3.53Å; P221-Y686 WeakPolarHBondContact CA-O 3.24Å; P221-Y686 WeakPolarHBondContact CB-O 3.31Å
222	E	92.4	Very high	92.3	Very high	24 Å²	24	52.3 Å²	52.3	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-44.9	174.2	-179.6	-179.1	-123.4	0	0	111	R219 V220 M225 L226 F258 E259 E260 V261	R219-E222 IonicContact NE-OE2 3.16Å; R219-E222 IonicContact NH2-OE2 3.6Å; R219-E222 PolarHBondContact NH2-OE2 3.31Å; R219-E222 PolarHBondContact O-N 3.33Å; V220-E222 VanDerWaalsContact C-N 3.33Å; V220-E222 PolarHBondContact O-N 3.3Å; E222-M225 PolarHBondContact O-N 3.46Å; E222-L226 VanDerWaalsContact O-CB 3.23Å; E222-L226 WeakPolarHBondContact O-CB 3.5Å; E222-L226 PolarHBondContact O-N 3.04Å; E222-F258 HydrophobicContact CB-CB 4.39Å; E222-F258 HydrophobicContact CB-CD1 3.83Å; E222-F258 HydrophobicContact CB-CD2 4.41Å; E222-F258 HydrophobicContact CB-CE1 4.2Å; E222-F258 HydrophobicContact CB-CG 3.96Å; E222-F258 HydrophobicContact CG-CB 3.98Å; E222-F258 HydrophobicContact CG-CD1 4.34Å; E222-F258 HydrophobicContact CG-CG 4.11Å; E222-F258 VanDerWaalsContact OE1-C 3.3Å; E222-F258 WeakPolarHBondContact OE1-CA 3.39Å; E222-E259 PolarHBondContact OE1-N 3.06Å; E222-E259 VanDerWaalsContact OE1-N 3.16Å; E222-E260 PolarHBondContact OE1-N 2.92Å; E222-V261 HydrophobicContact CG-CG2 4.01Å
223	C	93.2	Very high	92.2	Very high	44 Å²	44	50 Å²	50	30%	0.297	25%	0.25	S	S	.	.	H	α-helix	trans	-65.2	-40.8	-177.6	-70.6	0	0	0	0	112.9	R219 V220 L226 A227	R219-C223 VanDerWaalsContact CZ-SG 3.56Å; R219-C223 PolarHBondContact NH1-SG 3.01Å; R219-C223 PolarHBondContact O-N 2.89Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.49Å; V220-C223 WeakPolarHBondContact O-CA 3.41Å; V220-C223 WeakPolarHBondContact O-CB 3.49Å; V220-C223 PolarHBondContact O-N 3.04Å; C223-L226 PolarHBondContact O-N 3.48Å; C223-A227 VanDerWaalsContact O-CB 3.25Å; C223-A227 WeakPolarHBondContact O-CB 3.33Å; C223-A227 PolarHBondContact O-N 2.95Å
224	E	93.2	Very high	92.3	Very high	80 Å²	80	53.3 Å²	53.3	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-69.7	-43.5	178.2	-66.7	-164.1	141	0	0	111.1	V220 L226 A227 D228 Y686	V220-E224 HydrophobicContact CG1-CG 3.97Å; V220-E224 PolarHBondContact O-N 3.39Å; E224-L226 PolarHBondContact O-N 3.12Å; E224-A227 PolarHBondContact O-N 2.94Å; E224-D228 PolarHBondContact O-N 2.9Å; E224-Y686 HydrophobicContact CB-CD1 4.21Å
225	M	92.7	Very high	92.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-44.3	173.1	-169.4	175.9	-176.5	0	0	111.5	P221 E222 D228 M229 M249 I252 A253 F258 V261 Y686	P221-M225 WeakPolarHBondContact O-CB 3.45Å; P221-M225 PolarHBondContact O-N 3.37Å; P221-M225 VanDerWaalsContact O-N 3.12Å; E222-M225 PolarHBondContact O-N 3.46Å; M225-D228 PolarHBondContact O-N 3.15Å; M225-M229 HydrophobicContact CE-CE 4.3Å; M225-M229 HydrophobicContact CG-CE 4.03Å; M225-M229 HydrophobicContact CG-CG 4.48Å; M225-M229 VanDerWaalsContact O-CG 3.28Å; M225-M229 WeakPolarHBondContact O-CG 3.49Å; M225-M229 PolarHBondContact O-N 2.94Å; M225-M249 HydrophobicContact CE-CB 4.21Å; M225-M249 WeakPolarHBondContact CE-O 3.3Å; M225-I252 HydrophobicContact CE-CB 4.18Å; M225-I252 HydrophobicContact CE-CG2 4.03Å; M225-I252 HydrophobicContact SD-CG2 4.44Å; M225-A253 HydrophobicContact CE-CB 4.16Å; M225-A253 HydrophobicContact SD-CB 4.38Å; M225-F258 HydrophobicContact CB-CD2 4.32Å; M225-F258 HydrophobicContact CB-CE2 4.36Å; M225-F258 HydrophobicContact SD-CD2 3.69Å; M225-F258 HydrophobicContact SD-CE2 4.04Å; M225-V261 HydrophobicContact CB-CG2 4.14Å; M225-V261 HydrophobicContact CE-CG1 4.05Å; M225-V261 HydrophobicContact CG-CG1 4.06Å; M225-V261 HydrophobicContact CG-CG2 4.21Å; M225-V261 HydrophobicContact SD-CG1 3.96Å; M225-V261 HydrophobicContact SD-CG2 4.47Å; M225-Y686 HydrophobicContact CB-CD1 3.82Å; M225-Y686 HydrophobicContact CB-CD2 3.9Å; M225-Y686 HydrophobicContact CB-CE1 4.09Å; M225-Y686 HydrophobicContact CB-CE2 4.15Å; M225-Y686 HydrophobicContact CB-CG 3.74Å; M225-Y686 HydrophobicContact CG-CD1 4.47Å; M225-Y686 HydrophobicContact CG-CD2 3.77Å; M225-Y686 HydrophobicContact CG-CE1 4.47Å; M225-Y686 HydrophobicContact CG-CE2 3.74Å; M225-Y686 HydrophobicContact CG-CG 4.16Å; M225-Y686 HydrophobicContact SD-CD2 4.06Å; M225-Y686 HydrophobicContact SD-CE2 4.38Å
226	L	94.7	Very high	92.3	Very high	34 Å²	34	56.6 Å²	56.6	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-42.3	177.1	-177	62.2	0	0	0	112.2	E222 C223 E224 D228 M229 E230 E260 V261 F264	E222-L226 VanDerWaalsContact O-CB 3.23Å; E222-L226 WeakPolarHBondContact O-CB 3.5Å; E222-L226 PolarHBondContact O-N 3.04Å; C223-L226 PolarHBondContact O-N 3.48Å; E224-L226 PolarHBondContact O-N 3.12Å; L226-D228 VanDerWaalsContact C-N 3.3Å; L226-D228 PolarHBondContact O-N 3Å; L226-M229 PolarHBondContact O-N 2.87Å; L226-E230 WeakPolarHBondContact O-CB 3.25Å; L226-E230 WeakPolarHBondContact O-CG 3.4Å; L226-E230 PolarHBondContact O-N 3.33Å; L226-E260 HydrophobicContact CD2-CB 4.16Å; L226-V261 HydrophobicContact CB-CG2 3.9Å; L226-F264 HydrophobicContact CD1-CB 3.66Å; L226-F264 HydrophobicContact CD1-CD2 4.1Å; L226-F264 HydrophobicContact CD1-CG 3.89Å
227	A	95.7	Very high	92.2	Very high	47 Å²	47	54.4 Å²	54.4	39%	0.388	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-33.4	178.7	0	0	0	0	0	112.6	C223 E224 A231	C223-A227 VanDerWaalsContact O-CB 3.25Å; C223-A227 WeakPolarHBondContact O-CB 3.33Å; C223-A227 PolarHBondContact O-N 2.95Å; E224-A227 PolarHBondContact O-N 2.94Å; A227-A231 WeakPolarHBondContact O-CB 3.25Å; A227-A231 PolarHBondContact O-N 3.39Å; A227-A231 VanDerWaalsContact O-N 3.11Å
228	D	91.4	Very high	92.3	Very high	28 Å²	28	55.3 Å²	55.3	15%	0.15	32%	0.315	C	S	.	.	H	α-helix	trans	-76.2	-39.9	171.7	-88.3	-4.9	0	0	0	112.6	E224 M225 L226 E230 A231 L232 Y686 R715	E224-D228 PolarHBondContact O-N 2.9Å; M225-D228 PolarHBondContact O-N 3.15Å; L226-D228 VanDerWaalsContact C-N 3.3Å; L226-D228 PolarHBondContact O-N 3Å; D228-E230 VanDerWaalsContact C-N 3.29Å; D228-E230 PolarHBondContact O-N 3.09Å; D228-A231 CarbonylContact O-C 3.56Å; D228-A231 WeakPolarHBondContact O-CA 3.1Å; D228-A231 WeakPolarHBondContact O-CB 3.29Å; D228-A231 PolarHBondContact O-N 2.98Å; D228-L232 WeakPolarHBondContact O-CB 3.16Å; D228-L232 WeakPolarHBondContact O-CG 3.22Å; D228-L232 PolarHBondContact O-N 2.9Å; D228-Y686 HydrophobicContact CB-CE1 4.35Å; D228-Y686 WeakPolarHBondContact CB-OH 3.34Å; D228-Y686 PolarHBondContact OD2-OH 3.09Å; D228-R715 WeakPolarHBondContact OD1-CD 3.34Å; D228-R715 IonicContact OD1-CZ 3.52Å; D228-R715 IonicContact OD1-NE 2.99Å; D228-R715 IonicContact OD1-NH1 3.61Å; D228-R715 PolarHBondContact OD1-NH1 3.3Å
229	M	91.8	Very high	92.4	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-41.4	173.1	-68.6	-41.4	103.8	0	0	111.3	M225 L226 A231 L232 Y233 M249 V261 F264 L265	M225-M229 HydrophobicContact CE-CE 4.3Å; M225-M229 HydrophobicContact CG-CE 4.03Å; M225-M229 HydrophobicContact CG-CG 4.48Å; M225-M229 VanDerWaalsContact O-CG 3.28Å; M225-M229 WeakPolarHBondContact O-CG 3.49Å; M225-M229 PolarHBondContact O-N 2.94Å; L226-M229 PolarHBondContact O-N 2.87Å; M229-A231 VanDerWaalsContact C-N 3.34Å; M229-A231 PolarHBondContact O-N 3.06Å; M229-L232 HydrophobicContact CE-CD1 4.02Å; M229-L232 HydrophobicContact SD-CD1 4.36Å; M229-Y233 VanDerWaalsContact O-CB 3.3Å; M229-Y233 WeakPolarHBondContact O-CB 3.13Å; M229-Y233 PolarHBondContact O-N 3.15Å; M229-M249 HydrophobicContact CE-CG 4.46Å; M229-M249 HydrophobicContact CE-SD 3.62Å; M229-M249 HydrophobicContact SD-CB 3.95Å; M229-M249 HydrophobicContact SD-CE 3.78Å; M229-M249 HydrophobicContact SD-CG 4.19Å; M229-M249 HydrophobicContact SD-SD 3.41Å; M229-V261 HydrophobicContact CG-CG1 3.96Å; M229-F264 HydrophobicContact CB-CD1 3.9Å; M229-F264 HydrophobicContact CB-CE1 3.82Å; M229-L265 HydrophobicContact CG-CD2 4.26Å; M229-L265 HydrophobicContact SD-CD2 4.18Å
230	E	94.4	Very high	92.4	Very high	67 Å²	67	49.3 Å²	49.3	31%	0.313	29%	0.292	S	S	.	.	H	α-helix	trans	-58.6	-44.1	170.5	-80.2	-122	121	0	0	111.8	L226 D228 K234 F264	L226-E230 WeakPolarHBondContact O-CB 3.25Å; L226-E230 WeakPolarHBondContact O-CG 3.4Å; L226-E230 PolarHBondContact O-N 3.33Å; D228-E230 VanDerWaalsContact C-N 3.29Å; D228-E230 PolarHBondContact O-N 3.09Å; E230-K234 VanDerWaalsContact O-CB 3.31Å; E230-K234 WeakPolarHBondContact O-CB 3.46Å; E230-K234 WeakPolarHBondContact O-CD 3.42Å; E230-K234 WeakPolarHBondContact O-CG 3.31Å; E230-K234 PolarHBondContact O-N 2.77Å; E230-K234 WeakPolarHBondContact OE2-CE 3.36Å; E230-K234 IonicContact OE2-NZ 2.7Å; E230-K234 PolarHBondContact OE2-NZ 3.1Å; E230-F264 HydrophobicContact CG-CD2 4.43Å; E230-F264 HydrophobicContact CG-CE2 3.81Å; E230-F264 HydrophobicContact CG-CZ 4.2Å
231	A	94.2	Very high	92.4	Very high	22 Å²	22	56.2 Å²	56.2	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-69.1	-43.3	-178.8	0	0	0	0	0	112.8	A227 D228 M229 K234 A235	A227-A231 WeakPolarHBondContact O-CB 3.25Å; A227-A231 PolarHBondContact O-N 3.39Å; A227-A231 VanDerWaalsContact O-N 3.11Å; D228-A231 CarbonylContact O-C 3.56Å; D228-A231 WeakPolarHBondContact O-CA 3.1Å; D228-A231 WeakPolarHBondContact O-CB 3.29Å; D228-A231 PolarHBondContact O-N 2.98Å; M229-A231 VanDerWaalsContact C-N 3.34Å; M229-A231 PolarHBondContact O-N 3.06Å; A231-K234 PolarHBondContact O-N 3.18Å; A231-A235 WeakPolarHBondContact O-CB 3.31Å; A231-A235 PolarHBondContact O-N 2.97Å
232	L	92	Very high	92.5	Very high	51 Å²	51	59.3 Å²	59.3	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-47.1	175.1	-72.2	172.4	0	0	0	110.8	D228 M229 K234 A235 G236 A237 M249	D228-L232 WeakPolarHBondContact O-CB 3.16Å; D228-L232 WeakPolarHBondContact O-CG 3.22Å; D228-L232 PolarHBondContact O-N 2.9Å; M229-L232 HydrophobicContact CE-CD1 4.02Å; M229-L232 HydrophobicContact SD-CD1 4.36Å; L232-K234 PolarHBondContact O-N 3.43Å; L232-A235 CarbonylContact O-C 3.6Å; L232-A235 PolarHBondContact O-N 3.2Å; L232-G236 PolarHBondContact O-N 3.28Å; L232-G236 VanDerWaalsContact O-N 3.14Å; L232-A237 HydrophobicContact CB-CB 4.07Å; L232-A237 HydrophobicContact CD2-CB 4.02Å; L232-A237 WeakPolarHBondContact O-CB 3.41Å; L232-A237 PolarHBondContact O-N 2.82Å; L232-M249 HydrophobicContact CD1-CE 4.34Å; L232-M249 HydrophobicContact CD1-SD 3.95Å
233	Y	92	Very high	92.3	Very high	104 Å²	104	60.3 Å²	60.3	41%	0.408	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175.3	-177.9	-97.5	0	0	0	112.2	M229 A235 G236 L239 F264 R268	M229-Y233 VanDerWaalsContact O-CB 3.3Å; M229-Y233 WeakPolarHBondContact O-CB 3.13Å; M229-Y233 PolarHBondContact O-N 3.15Å; Y233-A235 VanDerWaalsContact C-N 3.25Å; Y233-A235 PolarHBondContact O-N 3.03Å; Y233-G236 PolarHBondContact O-N 2.8Å; Y233-L239 HydrophobicContact CD2-CD1 3.84Å; Y233-F264 HydrophobicContact CD1-CZ 4.45Å; Y233-F264 HydrophobicContact CG-CZ 4.22Å; Y233-R268 HydrophobicContact CD2-CB 4.11Å; Y233-R268 HydrophobicContact CD2-CG 3.9Å; Y233-R268 HydrophobicContact CE2-CB 3.93Å; Y233-R268 HydrophobicContact CE2-CG 3.86Å; Y233-R268 HydrophobicContact CG-CG 4.28Å
234	K	94.2	Very high	92.1	Very high	146 Å²	146	61.5 Å²	61.5	64%	0.635	35%	0.349	S	S	*	.	H	α-helix	trans	-64.6	-27.4	175.2	-72	161.6	-164.7	170.6	0	112.9	E230 A231 L232 G236	E230-K234 VanDerWaalsContact O-CB 3.31Å; E230-K234 WeakPolarHBondContact O-CB 3.46Å; E230-K234 WeakPolarHBondContact O-CD 3.42Å; E230-K234 WeakPolarHBondContact O-CG 3.31Å; E230-K234 PolarHBondContact O-N 2.77Å; E230-K234 WeakPolarHBondContact OE2-CE 3.36Å; E230-K234 IonicContact OE2-NZ 2.7Å; E230-K234 PolarHBondContact OE2-NZ 3.1Å; A231-K234 PolarHBondContact O-N 3.18Å; L232-K234 PolarHBondContact O-N 3.43Å; K234-G236 VanDerWaalsContact C-N 3.35Å
235	A	95.1	Very high	91.4	Very high	85 Å²	85	61.4 Å²	61.4	70%	0.702	35%	0.348	S	S	*	.	H	α-helix	trans	-82.4	-8.6	173.5	0	0	0	0	0	113.8	A231 L232 Y233	A231-A235 WeakPolarHBondContact O-CB 3.31Å; A231-A235 PolarHBondContact O-N 2.97Å; L232-A235 CarbonylContact O-C 3.6Å; L232-A235 PolarHBondContact O-N 3.2Å; Y233-A235 VanDerWaalsContact C-N 3.25Å; Y233-A235 PolarHBondContact O-N 3.03Å
236	G	91.7	Very high	91.2	Very high	69 Å²	69	61.9 Å²	61.9	71%	0.711	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	25.1	-175.3	0	0	0	0	0	114	L232 Y233 K234	L232-G236 PolarHBondContact O-N 3.28Å; L232-G236 VanDerWaalsContact O-N 3.14Å; Y233-G236 PolarHBondContact O-N 2.8Å; K234-G236 VanDerWaalsContact C-N 3.35Å
237	A	90.5	Very high	91.1	Very high	44 Å²	44	61 Å²	61	36%	0.364	35%	0.351	S	S	.	.			trans	-71.8	154	173.1	0	0	0	0	0	111.6	L232 L239	L232-A237 HydrophobicContact CB-CB 4.07Å; L232-A237 HydrophobicContact CD2-CB 4.02Å; L232-A237 WeakPolarHBondContact O-CB 3.41Å; L232-A237 PolarHBondContact O-N 2.82Å; A237-L239 PolarHBondContact O-N 3.18Å
238	D	90.2	Very high	90.9	Very high	104 Å²	104	58.8 Å²	58.8	56%	0.556	33%	0.332	S	S	*	.			trans	-74	118.2	175.1	-170.7	-0.4	0	0	0	110.6	D240 R241	D238-D240 VanDerWaalsContact C-N 3.25Å; D238-D240 WeakPolarHBondContact OD1-CB 3.46Å; D238-D240 PolarHBondContact OD1-N 2.82Å; D238-R241 WeakPolarHBondContact O-CB 3.37Å; D238-R241 PolarHBondContact O-N 3.08Å
239	L	90.2	Very high	91	Very high	13 Å²	13	58.6 Å²	58.6	7%	0.068	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.4	177.1	-65.6	179.6	0	0	0	112.8	Y233 A237 R241 M249 F264 L265 R268	Y233-L239 HydrophobicContact CD2-CD1 3.84Å; A237-L239 PolarHBondContact O-N 3.18Å; L239-R241 VanDerWaalsContact C-N 3.27Å; L239-M249 HydrophobicContact CB-CE 4.33Å; L239-M249 HydrophobicContact CD2-CE 3.91Å; L239-M249 WeakPolarHBondContact O-CE 3.24Å; L239-F264 HydrophobicContact CD1-CE1 4.45Å; L239-L265 HydrophobicContact CB-CD2 4.19Å; L239-L265 HydrophobicContact CD1-CD2 4.12Å; L239-L265 HydrophobicContact CD2-CD2 4.08Å; L239-L265 HydrophobicContact CG-CD2 4.36Å; L239-R268 HydrophobicContact CD1-CB 3.66Å; L239-R268 HydrophobicContact CD1-CG 4.22Å
240	D	92.4	Very high	91.1	Very high	23 Å²	23	58.6 Å²	58.6	12%	0.123	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	7.7	176.3	-62.3	-42.7	0	0	0	112.7	D238 L242 A270 K271 L274	D238-D240 VanDerWaalsContact C-N 3.25Å; D238-D240 WeakPolarHBondContact OD1-CB 3.46Å; D238-D240 PolarHBondContact OD1-N 2.82Å; D240-L242 WeakPolarHBondContact O-CD2 3.26Å; D240-L242 PolarHBondContact O-N 2.95Å; D240-A270 WeakPolarHBondContact OD1-CA 3.24Å; D240-K271 PolarHBondContact OD1-N 2.68Å; D240-K271 WeakPolarHBondContact OD2-CG 3.44Å; D240-K271 IonicContact OD2-NZ 2.64Å; D240-K271 PolarHBondContact OD2-NZ 3.47Å; D240-L274 HydrophobicContact CB-CD1 3.94Å
241	R	90.4	Very high	91.1	Very high	184 Å²	184	55.5 Å²	55.5	69%	0.694	32%	0.317	S	S	*	.			trans	-58.7	130.1	177.5	-179.4	175.6	178.8	176.5	-0.1	110.4	D238 L239	D238-R241 WeakPolarHBondContact O-CB 3.37Å; D238-R241 PolarHBondContact O-N 3.08Å; L239-R241 VanDerWaalsContact C-N 3.27Å
242	L	91.3	Very high	90.9	Very high	74 Å²	74	55.1 Å²	55.1	39%	0.387	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-91.4	148	174.8	-47.5	-177.5	0	0	0	111	D240 A247 L274	D240-L242 WeakPolarHBondContact O-CD2 3.26Å; D240-L242 PolarHBondContact O-N 2.95Å; L242-A247 CarbonylContact C-O 3.58Å; L242-A247 VanDerWaalsContact CA-O 3.3Å; L242-A247 WeakPolarHBondContact CA-O 3.29Å; L242-L274 HydrophobicContact CD2-CD1 4.44Å; L242-L274 HydrophobicContact CD2-CD2 4.49Å
243	D	87.4	Confident	91	Very high	45 Å²	45	52.7 Å²	52.7	24%	0.241	30%	0.299	C	S	.	.			trans	-83.2	-166.6	175.8	71	1.9	0	0	0	113	Q245 G246 A247 V682	D243-Q245 PolarHBondContact O-N 3.14Å; D243-Q245 VanDerWaalsContact OD1-C 3.29Å; D243-Q245 VanDerWaalsContact OD1-CA 3.27Å; D243-Q245 WeakPolarHBondContact OD1-CA 3.37Å; D243-Q245 WeakPolarHBondContact OD1-CB 3.29Å; D243-Q245 PolarHBondContact OD1-N 2.88Å; D243-G246 PolarHBondContact O-N 3.08Å; D243-G246 PolarHBondContact OD1-N 3.4Å; D243-A247 PolarHBondContact N-O 3.2Å; D243-A247 PolarHBondContact OD1-N 3.09Å; D243-V682 HydrophobicContact CB-CG2 4.35Å
244	A	87.8	Confident	91.1	Very high	69 Å²	69	47.8 Å²	47.8	57%	0.57	28%	0.279	S	S	*	.	S	Bend	trans	-70	-15.1	177	0	0	0	0	0	113.4	K277	A244-K277 WeakPolarHBondContact O-CE 3.36Å; A244-K277 PolarHBondContact O-NZ 3.15Å
245	Q	79.4	Confident	91	Very high	78 Å²	78	41 Å²	41	36%	0.364	25%	0.25	S	S	.	.	S	Bend	trans	-99	-13.6	-179.6	-82.1	62.4	18.5	0	0	111.5	D243 K277	D243-Q245 PolarHBondContact O-N 3.14Å; D243-Q245 VanDerWaalsContact OD1-C 3.29Å; D243-Q245 VanDerWaalsContact OD1-CA 3.27Å; D243-Q245 WeakPolarHBondContact OD1-CA 3.37Å; D243-Q245 WeakPolarHBondContact OD1-CB 3.29Å; D243-Q245 PolarHBondContact OD1-N 2.88Å; Q245-K277 WeakPolarHBondContact O-CB 3.34Å; Q245-K277 WeakPolarHBondContact O-CD 3.46Å; Q245-K277 VanDerWaalsContact O-CE 3.31Å; Q245-K277 WeakPolarHBondContact O-CE 3.36Å; Q245-K277 WeakPolarHBondContact O-CG 3.46Å
246	G	89	Confident	90.6	Very high	10 Å²	10	37.1 Å²	37.1	10%	0.103	22%	0.218	C	C	.	.	S	Bend	trans	90.9	1.9	-175.3	0	0	0	0	0	113.5	D243 D276	D243-G246 PolarHBondContact O-N 3.08Å; D243-G246 PolarHBondContact OD1-N 3.4Å; G246-D276 WeakPolarHBondContact O-CA 3.45Å
247	A	91.6	Very high	90.6	Very high	15 Å²	15	35 Å²	35	12%	0.124	20%	0.196	C	C	.	.			trans	-76.4	142	176.2	0	0	0	0	0	110.2	L242 D243 H251 I252	L242-A247 CarbonylContact C-O 3.58Å; L242-A247 VanDerWaalsContact CA-O 3.3Å; L242-A247 WeakPolarHBondContact CA-O 3.29Å; D243-A247 PolarHBondContact N-O 3.2Å; D243-A247 PolarHBondContact OD1-N 3.09Å; A247-H251 HydrophobicContact CB-CB 4Å; A247-I252 HydrophobicContact CB-CG1 4.5Å
248	S	92.8	Very high	90.8	Very high	1 Å²	1	34 Å²	34	1%	0.007	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-92	167.4	168.2	75.7	0	0	0	0	111	L250 H251 I252	S248-L250 PolarHBondContact O-N 3.12Å; S248-L250 VanDerWaalsContact O-N 3.1Å; S248-L250 PolarHBondContact OG-N 3.3Å; S248-H251 PolarHBondContact N-ND1 2.84Å; S248-H251 WeakPolarHBondContact O-CA 3.34Å; S248-H251 WeakPolarHBondContact O-CB 3.41Å; S248-H251 PolarHBondContact O-N 3.41Å; S248-H251 PolarHBondContact OG-ND1 3.01Å; S248-I252 PolarHBondContact O-N 3.44Å; S248-I252 VanDerWaalsContact O-N 3.15Å
249	M	92.1	Very high	91	Very high	24 Å²	24	33.4 Å²	33.4	12%	0.118	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-21.6	177.6	-59.8	178.6	-60.2	0	0	112.7	M225 M229 L232 L239 A253 L265	M225-M249 HydrophobicContact CE-CB 4.21Å; M225-M249 WeakPolarHBondContact CE-O 3.3Å; M229-M249 HydrophobicContact CE-CG 4.46Å; M229-M249 HydrophobicContact CE-SD 3.62Å; M229-M249 HydrophobicContact SD-CB 3.95Å; M229-M249 HydrophobicContact SD-CE 3.78Å; M229-M249 HydrophobicContact SD-CG 4.19Å; M229-M249 HydrophobicContact SD-SD 3.41Å; L232-M249 HydrophobicContact CD1-CE 4.34Å; L232-M249 HydrophobicContact CD1-SD 3.95Å; L239-M249 HydrophobicContact CB-CE 4.33Å; L239-M249 HydrophobicContact CD2-CE 3.91Å; L239-M249 WeakPolarHBondContact O-CE 3.24Å; M249-A253 VanDerWaalsContact O-CB 3.32Å; M249-A253 WeakPolarHBondContact O-CB 3.49Å; M249-A253 PolarHBondContact O-N 3.08Å; M249-L265 HydrophobicContact CB-CD1 4.25Å
250	L	95.4	Very high	91.2	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-72.7	-33.9	170.5	-170.8	68.7	0	0	0	112.8	S248 A254 V262 L265 L266 A282 L298	S248-L250 PolarHBondContact O-N 3.12Å; S248-L250 VanDerWaalsContact O-N 3.1Å; S248-L250 PolarHBondContact OG-N 3.3Å; L250-A254 WeakPolarHBondContact O-CB 3.47Å; L250-A254 PolarHBondContact O-N 3.2Å; L250-V262 HydrophobicContact CD1-CB 4.41Å; L250-V262 HydrophobicContact CD1-CG1 3.97Å; L250-V262 HydrophobicContact CD1-CG2 4.33Å; L250-L265 HydrophobicContact CB-CD1 4.18Å; L250-L265 HydrophobicContact CD1-CB 4.16Å; L250-L265 HydrophobicContact CD1-CD1 4.18Å; L250-L266 HydrophobicContact CD1-CD2 4.23Å; L250-L266 HydrophobicContact CD1-CG 4.18Å; L250-L266 HydrophobicContact CD2-CD2 4.22Å; L250-A282 HydrophobicContact CD2-CB 4.06Å; L250-A282 HydrophobicContact CG-CB 3.85Å; L250-L298 HydrophobicContact CD1-CD2 4.44Å; L250-L298 HydrophobicContact CD2-CD2 4.3Å
251	H	93.5	Very high	91.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-43.2	174.2	-69.8	79	0	0	0	111	A247 S248 A254 A255 L274 W280 Q281 A282 I285	A247-H251 HydrophobicContact CB-CB 4Å; S248-H251 PolarHBondContact N-ND1 2.84Å; S248-H251 WeakPolarHBondContact O-CA 3.34Å; S248-H251 WeakPolarHBondContact O-CB 3.41Å; S248-H251 PolarHBondContact O-N 3.41Å; S248-H251 PolarHBondContact OG-ND1 3.01Å; H251-A254 PolarHBondContact O-N 3.15Å; H251-A255 PolarHBondContact O-N 3.27Å; H251-L274 PolarHBondContact CE1-O 2.99Å; H251-L274 PolarHBondContact NE2-O 3.27Å; H251-W280 PolarHBondContact NE2-O 3.37Å; H251-Q281 WeakPolarHBondContact NE2-CA 3.43Å; H251-A282 PolarHBondContact NE2-N 2.87Å; H251-I285 HydrophobicContact CB-CD1 3.81Å
252	I	90.8	Very high	91.7	Very high	14 Å²	14	27 Å²	27	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-51	178.3	-61.6	158.7	0	0	0	109.9	M225 A247 S248 A254 A255 S256 V682 H683	M225-I252 HydrophobicContact CE-CB 4.18Å; M225-I252 HydrophobicContact CE-CG2 4.03Å; M225-I252 HydrophobicContact SD-CG2 4.44Å; A247-I252 HydrophobicContact CB-CG1 4.5Å; S248-I252 PolarHBondContact O-N 3.44Å; S248-I252 VanDerWaalsContact O-N 3.15Å; I252-A254 PolarHBondContact O-N 3.08Å; I252-A255 WeakPolarHBondContact O-CB 3.33Å; I252-A255 PolarHBondContact O-N 3.16Å; I252-A255 VanDerWaalsContact O-N 3.08Å; I252-S256 WeakPolarHBondContact O-CB 3.38Å; I252-S256 PolarHBondContact O-N 2.91Å; I252-S256 PolarHBondContact O-OG 3.2Å; I252-V682 HydrophobicContact CD1-CB 3.72Å; I252-V682 HydrophobicContact CD1-CG1 3.8Å; I252-H683 HydrophobicContact CG2-CB 4.38Å
253	A	93.7	Very high	92	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-31.7	177.8	0	0	0	0	0	112.9	M225 M249 S256 G257 F258 V261 V262	M225-A253 HydrophobicContact CE-CB 4.16Å; M225-A253 HydrophobicContact SD-CB 4.38Å; M249-A253 VanDerWaalsContact O-CB 3.32Å; M249-A253 WeakPolarHBondContact O-CB 3.49Å; M249-A253 PolarHBondContact O-N 3.08Å; A253-S256 PolarHBondContact O-N 2.82Å; A253-G257 PolarHBondContact O-N 3.15Å; A253-F258 HydrophobicContact CB-CB 4.39Å; A253-F258 PolarHBondContact O-N 3.42Å; A253-V261 HydrophobicContact CB-CB 4.01Å; A253-V261 HydrophobicContact CB-CG1 3.64Å; A253-V262 HydrophobicContact CB-CG2 3.61Å
254	A	93.9	Very high	92.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-73.3	-32.8	173.7	0	0	0	0	0	113.9	L250 H251 I252 A282 I285 A286 I294	L250-A254 WeakPolarHBondContact O-CB 3.47Å; L250-A254 PolarHBondContact O-N 3.2Å; H251-A254 PolarHBondContact O-N 3.15Å; I252-A254 PolarHBondContact O-N 3.08Å; A254-A282 HydrophobicContact CB-CB 4.08Å; A254-I285 HydrophobicContact CB-CG2 4.45Å; A254-A286 HydrophobicContact CB-CB 4.33Å; A254-I294 HydrophobicContact CB-CG2 3.96Å
255	A	91	Very high	92.8	Very high	3 Å²	3	20.2 Å²	20.2	3%	0.025	11%	0.108	C	C	.	.	H	α-helix	trans	-70.3	-34.8	169.2	0	0	0	0	0	111.9	H251 I252 I285 R752 I773	H251-A255 PolarHBondContact O-N 3.27Å; I252-A255 WeakPolarHBondContact O-CB 3.33Å; I252-A255 PolarHBondContact O-N 3.16Å; I252-A255 VanDerWaalsContact O-N 3.08Å; A255-I285 HydrophobicContact CB-CG2 3.64Å; A255-R752 PolarHBondContact O-NH1 3.01Å; A255-R752 PolarHBondContact O-NH2 2.84Å; A255-I773 HydrophobicContact CB-CD1 3.75Å
256	S	87.9	Confident	93.5	Very high	5 Å²	5	16.6 Å²	16.6	4%	0.035	9%	0.091	C	C	.	.	H	α-helix	trans	-84.4	-10.3	-178.7	-61	0	0	0	0	114.9	I252 A253 F258 H683 R752	I252-S256 WeakPolarHBondContact O-CB 3.38Å; I252-S256 PolarHBondContact O-N 2.91Å; I252-S256 PolarHBondContact O-OG 3.2Å; A253-S256 PolarHBondContact O-N 2.82Å; S256-F258 VanDerWaalsContact C-N 3.26Å; S256-F258 WeakPolarHBondContact O-CD1 3.41Å; S256-F258 WeakPolarHBondContact O-CE1 3.48Å; S256-F258 PolarHBondContact O-N 3.2Å; S256-H683 PolarHBondContact OG-CE1 2.94Å; S256-H683 PolarHBondContact OG-ND1 3.48Å; S256-R752 VanDerWaalsContact C-CZ 3.45Å; S256-R752 PolarHBondContact O-NE 3.49Å; S256-R752 PolarHBondContact O-NH2 3.06Å; S256-R752 VanDerWaalsContact O-NH2 3.07Å
257	G	91.2	Very high	93.8	Very high	23 Å²	23	21.6 Å²	21.6	24%	0.237	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	15	-179.7	0	0	0	0	0	114.8	A253 E259	A253-G257 PolarHBondContact O-N 3.15Å; G257-E259 PolarHBondContact O-N 3.43Å
258	F	94.2	Very high	93.9	Very high	23 Å²	23	26.4 Å²	26.4	10%	0.101	13%	0.125	C	C	.	.			trans	-79.7	84.3	-171.4	-66.3	-11.9	0	0	0	110.7	P221 E222 M225 A253 S256 E260 V261 V262	P221-F258 HydrophobicContact CB-CE1 4.21Å; P221-F258 HydrophobicContact CB-CE2 4.29Å; P221-F258 HydrophobicContact CB-CZ 3.53Å; E222-F258 HydrophobicContact CB-CB 4.39Å; E222-F258 HydrophobicContact CB-CD1 3.83Å; E222-F258 HydrophobicContact CB-CD2 4.41Å; E222-F258 HydrophobicContact CB-CE1 4.2Å; E222-F258 HydrophobicContact CB-CG 3.96Å; E222-F258 HydrophobicContact CG-CB 3.98Å; E222-F258 HydrophobicContact CG-CD1 4.34Å; E222-F258 HydrophobicContact CG-CG 4.11Å; E222-F258 VanDerWaalsContact OE1-C 3.3Å; E222-F258 WeakPolarHBondContact OE1-CA 3.39Å; M225-F258 HydrophobicContact CB-CD2 4.32Å; M225-F258 HydrophobicContact CB-CE2 4.36Å; M225-F258 HydrophobicContact SD-CD2 3.69Å; M225-F258 HydrophobicContact SD-CE2 4.04Å; A253-F258 HydrophobicContact CB-CB 4.39Å; A253-F258 PolarHBondContact O-N 3.42Å; S256-F258 VanDerWaalsContact C-N 3.26Å; S256-F258 WeakPolarHBondContact O-CD1 3.41Å; S256-F258 WeakPolarHBondContact O-CE1 3.48Å; S256-F258 PolarHBondContact O-N 3.2Å; F258-E260 PolarHBondContact O-N 3.46Å; F258-V261 HydrophobicContact CB-CB 3.86Å; F258-V261 HydrophobicContact CB-CG2 3.87Å; F258-V261 HydrophobicContact CD2-CG2 4.31Å; F258-V261 PolarHBondContact O-N 3Å; F258-V261 VanDerWaalsContact O-N 3.16Å; F258-V262 WeakPolarHBondContact O-CG2 3.39Å; F258-V262 PolarHBondContact O-N 3.15Å
259	E	94.8	Very high	93.8	Very high	93 Å²	93	28.4 Å²	28.4	44%	0.435	15%	0.146	S	C	.	.	H	α-helix	trans	-56.1	-45.7	-175.2	-163.8	-165.3	154.3	0	0	111.9	E222 G257 V261 V262 L263 I294 L297	E222-E259 PolarHBondContact OE1-N 3.06Å; E222-E259 VanDerWaalsContact OE1-N 3.16Å; G257-E259 PolarHBondContact O-N 3.43Å; E259-V261 VanDerWaalsContact C-N 3.31Å; E259-V261 PolarHBondContact O-N 3.14Å; E259-V262 PolarHBondContact O-N 3.24Å; E259-L263 WeakPolarHBondContact O-CB 3.49Å; E259-L263 PolarHBondContact O-N 3.07Å; E259-I294 HydrophobicContact CB-CD1 4.12Å; E259-I294 HydrophobicContact CG-CD1 4.42Å; E259-L297 HydrophobicContact CG-CD2 3.83Å
260	E	95.5	Very high	93.9	Very high	86 Å²	86	27.7 Å²	27.7	40%	0.402	14%	0.144	S	C	.	.	H	α-helix	trans	-68.4	-31.6	-179	-77.4	-73.4	-172.6	0	0	112	E222 L226 F258 F264	E222-E260 PolarHBondContact OE1-N 2.92Å; L226-E260 HydrophobicContact CD2-CB 4.16Å; F258-E260 PolarHBondContact O-N 3.46Å; E260-F264 WeakPolarHBondContact O-CB 3.29Å; E260-F264 PolarHBondContact O-N 3.06Å
261	V	95.6	Very high	93.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-47.2	175.1	-179.7	0	0	0	0	110.7	E222 M225 L226 M229 A253 F258 E259 L263 F264 L265	E222-V261 HydrophobicContact CG-CG2 4.01Å; M225-V261 HydrophobicContact CB-CG2 4.14Å; M225-V261 HydrophobicContact CE-CG1 4.05Å; M225-V261 HydrophobicContact CG-CG1 4.06Å; M225-V261 HydrophobicContact CG-CG2 4.21Å; M225-V261 HydrophobicContact SD-CG1 3.96Å; M225-V261 HydrophobicContact SD-CG2 4.47Å; L226-V261 HydrophobicContact CB-CG2 3.9Å; M229-V261 HydrophobicContact CG-CG1 3.96Å; A253-V261 HydrophobicContact CB-CB 4.01Å; A253-V261 HydrophobicContact CB-CG1 3.64Å; F258-V261 HydrophobicContact CB-CB 3.86Å; F258-V261 HydrophobicContact CB-CG2 3.87Å; F258-V261 HydrophobicContact CD2-CG2 4.31Å; F258-V261 PolarHBondContact O-N 3Å; F258-V261 VanDerWaalsContact O-N 3.16Å; E259-V261 VanDerWaalsContact C-N 3.31Å; E259-V261 PolarHBondContact O-N 3.14Å; V261-L263 VanDerWaalsContact C-N 3.34Å; V261-L263 PolarHBondContact O-N 3.42Å; V261-F264 PolarHBondContact O-N 2.97Å; V261-L265 HydrophobicContact CG1-CD1 4.03Å; V261-L265 HydrophobicContact CG1-CG 4.43Å; V261-L265 WeakPolarHBondContact O-CB 3.47Å; V261-L265 VanDerWaalsContact O-CG 3.28Å; V261-L265 WeakPolarHBondContact O-CG 3.31Å; V261-L265 PolarHBondContact O-N 3.39Å
262	V	96.8	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-47.2	174.6	171.5	0	0	0	0	110	L250 A253 F258 E259 F264 L265 L266 I294 L297 L298	L250-V262 HydrophobicContact CD1-CB 4.41Å; L250-V262 HydrophobicContact CD1-CG1 3.97Å; L250-V262 HydrophobicContact CD1-CG2 4.33Å; A253-V262 HydrophobicContact CB-CG2 3.61Å; F258-V262 WeakPolarHBondContact O-CG2 3.39Å; F258-V262 PolarHBondContact O-N 3.15Å; E259-V262 PolarHBondContact O-N 3.24Å; V262-F264 VanDerWaalsContact C-N 3.34Å; V262-F264 PolarHBondContact O-N 3.11Å; V262-L265 PolarHBondContact O-N 3.41Å; V262-L266 HydrophobicContact CG1-CD1 3.58Å; V262-L266 HydrophobicContact CG1-CG 4.24Å; V262-L266 WeakPolarHBondContact O-CB 3.3Å; V262-L266 WeakPolarHBondContact O-CG 3.5Å; V262-L266 PolarHBondContact O-N 2.78Å; V262-I294 HydrophobicContact CB-CD1 4.32Å; V262-I294 HydrophobicContact CG1-CG2 4.43Å; V262-I294 HydrophobicContact CG2-CD1 4.07Å; V262-I294 HydrophobicContact CG2-CG2 4.26Å; V262-L297 HydrophobicContact CB-CD2 4.05Å; V262-L297 HydrophobicContact CG1-CD2 3.6Å; V262-L297 HydrophobicContact CG1-CG 4.11Å; V262-L298 HydrophobicContact CG1-CD2 4.43Å
263	L	96.7	Very high	94.1	Very high	27 Å²	27	38.3 Å²	38.3	14%	0.141	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-39.6	178.4	-175.9	63	0	0	0	111.9	E259 V261 K267 L297 F301	E259-L263 WeakPolarHBondContact O-CB 3.49Å; E259-L263 PolarHBondContact O-N 3.07Å; V261-L263 VanDerWaalsContact C-N 3.34Å; V261-L263 PolarHBondContact O-N 3.42Å; L263-K267 HydrophobicContact CD1-CD 4.27Å; L263-K267 HydrophobicContact CD1-CG 4.48Å; L263-K267 HydrophobicContact CG-CD 4.04Å; L263-K267 VanDerWaalsContact CG-CE 3.49Å; L263-K267 VanDerWaalsContact CG-NZ 3.3Å; L263-K267 WeakPolarHBondContact O-CB 3.24Å; L263-K267 WeakPolarHBondContact O-CD 3.43Å; L263-K267 WeakPolarHBondContact O-CG 3.39Å; L263-K267 PolarHBondContact O-N 3.23Å; L263-L297 HydrophobicContact CB-CD2 4.02Å; L263-L297 HydrophobicContact CD1-CD1 3.71Å; L263-F301 HydrophobicContact CD1-CE2 4.01Å; L263-F301 HydrophobicContact CD1-CZ 4.36Å
264	F	96.8	Very high	94.1	Very high	17 Å²	17	39.7 Å²	39.7	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-54.3	172.8	176.7	-88	0	0	0	111.5	L226 M229 E230 Y233 L239 E260 V261 V262 L266 K267 R268	L226-F264 HydrophobicContact CD1-CB 3.66Å; L226-F264 HydrophobicContact CD1-CD2 4.1Å; L226-F264 HydrophobicContact CD1-CG 3.89Å; M229-F264 HydrophobicContact CB-CD1 3.9Å; M229-F264 HydrophobicContact CB-CE1 3.82Å; E230-F264 HydrophobicContact CG-CD2 4.43Å; E230-F264 HydrophobicContact CG-CE2 3.81Å; E230-F264 HydrophobicContact CG-CZ 4.2Å; Y233-F264 HydrophobicContact CD1-CZ 4.45Å; Y233-F264 HydrophobicContact CG-CZ 4.22Å; L239-F264 HydrophobicContact CD1-CE1 4.45Å; E260-F264 WeakPolarHBondContact O-CB 3.29Å; E260-F264 PolarHBondContact O-N 3.06Å; V261-F264 PolarHBondContact O-N 2.97Å; V262-F264 VanDerWaalsContact C-N 3.34Å; V262-F264 PolarHBondContact O-N 3.11Å; F264-L266 VanDerWaalsContact C-N 3.33Å; F264-L266 PolarHBondContact O-N 2.77Å; F264-K267 PolarHBondContact O-N 3.39Å; F264-R268 HydrophobicContact CD1-CG 4.18Å; F264-R268 HydrophobicContact CE1-CG 3.78Å; F264-R268 HydrophobicContact CE2-CG 4.22Å; F264-R268 HydrophobicContact CZ-CG 3.81Å; F264-R268 WeakPolarHBondContact O-CG 3.17Å; F264-R268 PolarHBondContact O-N 3.15Å
265	L	95.7	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.3	-46	-177.9	-70.5	171.4	0	0	0	111.3	M229 L239 M249 L250 V261 V262 R268 G269 A270	M229-L265 HydrophobicContact CG-CD2 4.26Å; M229-L265 HydrophobicContact SD-CD2 4.18Å; L239-L265 HydrophobicContact CB-CD2 4.19Å; L239-L265 HydrophobicContact CD1-CD2 4.12Å; L239-L265 HydrophobicContact CD2-CD2 4.08Å; L239-L265 HydrophobicContact CG-CD2 4.36Å; M249-L265 HydrophobicContact CB-CD1 4.25Å; L250-L265 HydrophobicContact CB-CD1 4.18Å; L250-L265 HydrophobicContact CD1-CB 4.16Å; L250-L265 HydrophobicContact CD1-CD1 4.18Å; V261-L265 HydrophobicContact CG1-CD1 4.03Å; V261-L265 HydrophobicContact CG1-CG 4.43Å; V261-L265 WeakPolarHBondContact O-CB 3.47Å; V261-L265 VanDerWaalsContact O-CG 3.28Å; V261-L265 WeakPolarHBondContact O-CG 3.31Å; V261-L265 PolarHBondContact O-N 3.39Å; V262-L265 PolarHBondContact O-N 3.41Å; L265-R268 CarbonylContact O-C 3.6Å; L265-R268 PolarHBondContact O-N 3.03Å; L265-G269 PolarHBondContact O-N 3.28Å; L265-G269 VanDerWaalsContact O-N 3.1Å; L265-A270 HydrophobicContact CB-CB 4.02Å; L265-A270 WeakPolarHBondContact O-CB 3.28Å; L265-A270 PolarHBondContact O-N 3.4Å
266	L	95.2	Very high	94.2	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-65.3	-43.3	176.7	-65.8	173	0	0	0	112.2	L250 V262 F264 R268 G269 I272 L297 L298 F301	L250-L266 HydrophobicContact CD1-CD2 4.23Å; L250-L266 HydrophobicContact CD1-CG 4.18Å; L250-L266 HydrophobicContact CD2-CD2 4.22Å; V262-L266 HydrophobicContact CG1-CD1 3.58Å; V262-L266 HydrophobicContact CG1-CG 4.24Å; V262-L266 WeakPolarHBondContact O-CB 3.3Å; V262-L266 WeakPolarHBondContact O-CG 3.5Å; V262-L266 PolarHBondContact O-N 2.78Å; F264-L266 VanDerWaalsContact C-N 3.33Å; F264-L266 PolarHBondContact O-N 2.77Å; L266-R268 PolarHBondContact O-N 3.03Å; L266-G269 PolarHBondContact O-N 2.93Å; L266-I272 HydrophobicContact CD2-CD1 3.94Å; L266-I272 HydrophobicContact CD2-CG1 3.69Å; L266-L297 HydrophobicContact CD1-CD1 4.4Å; L266-L297 HydrophobicContact CD1-CG 4.02Å; L266-L298 HydrophobicContact CD1-CD2 4.15Å; L266-L298 HydrophobicContact CD2-CD2 4.31Å; L266-F301 HydrophobicContact CB-CD1 3.69Å; L266-F301 HydrophobicContact CB-CD2 4.04Å; L266-F301 HydrophobicContact CB-CE1 3.76Å; L266-F301 HydrophobicContact CB-CE2 4.11Å; L266-F301 HydrophobicContact CB-CG 3.82Å; L266-F301 HydrophobicContact CB-CZ 3.97Å; L266-F301 HydrophobicContact CD1-CB 4.07Å; L266-F301 HydrophobicContact CD1-CD2 3.72Å; L266-F301 HydrophobicContact CD1-CE2 4.31Å; L266-F301 HydrophobicContact CD1-CG 3.88Å; L266-F301 HydrophobicContact CD2-CB 4.26Å; L266-F301 HydrophobicContact CD2-CG 4.43Å; L266-F301 HydrophobicContact CG-CD2 4.47Å; L266-F301 HydrophobicContact CG-CG 4.27Å
267	K	94.5	Very high	94.3	Very high	116 Å²	116	50.8 Å²	50.8	50%	0.504	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-26.5	172.8	-77.7	167.5	179.8	163.8	0	112.9	L263 F264 F301	L263-K267 HydrophobicContact CD1-CD 4.27Å; L263-K267 HydrophobicContact CD1-CG 4.48Å; L263-K267 HydrophobicContact CG-CD 4.04Å; L263-K267 VanDerWaalsContact CG-CE 3.49Å; L263-K267 VanDerWaalsContact CG-NZ 3.3Å; L263-K267 WeakPolarHBondContact O-CB 3.24Å; L263-K267 WeakPolarHBondContact O-CD 3.43Å; L263-K267 WeakPolarHBondContact O-CG 3.39Å; L263-K267 PolarHBondContact O-N 3.23Å; F264-K267 PolarHBondContact O-N 3.39Å; K267-F301 HydrophobicContact CG-CZ 4.18Å
268	R	94.2	Very high	94.2	Very high	115 Å²	115	52 Å²	52	43%	0.434	26%	0.256	S	S	.	.	H	α-helix	trans	-88.6	-6	174.3	-61.4	-44.6	179.6	-177.2	-5.2	114.1	Y233 L239 F264 L265 L266	Y233-R268 HydrophobicContact CD2-CB 4.11Å; Y233-R268 HydrophobicContact CD2-CG 3.9Å; Y233-R268 HydrophobicContact CE2-CB 3.93Å; Y233-R268 HydrophobicContact CE2-CG 3.86Å; Y233-R268 HydrophobicContact CG-CG 4.28Å; L239-R268 HydrophobicContact CD1-CB 3.66Å; L239-R268 HydrophobicContact CD1-CG 4.22Å; F264-R268 HydrophobicContact CD1-CG 4.18Å; F264-R268 HydrophobicContact CE1-CG 3.78Å; F264-R268 HydrophobicContact CE2-CG 4.22Å; F264-R268 HydrophobicContact CZ-CG 3.81Å; F264-R268 WeakPolarHBondContact O-CG 3.17Å; F264-R268 PolarHBondContact O-N 3.15Å; L265-R268 CarbonylContact O-C 3.6Å; L265-R268 PolarHBondContact O-N 3.03Å; L266-R268 PolarHBondContact O-N 3.03Å
269	G	90.9	Very high	94.1	Very high	44 Å²	44	51.1 Å²	51.1	45%	0.454	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	27.1	175.5	0	0	0	0	0	114.7	L265 L266	L265-G269 PolarHBondContact O-N 3.28Å; L265-G269 VanDerWaalsContact O-N 3.1Å; L266-G269 PolarHBondContact O-N 2.93Å
270	A	93.4	Very high	94	Very high	8 Å²	8	48.2 Å²	48.2	7%	0.066	24%	0.239	C	C	.	.			trans	-55.6	146.5	165.5	0	0	0	0	0	110.9	D240 L265 I272	D240-A270 WeakPolarHBondContact OD1-CA 3.24Å; L265-A270 HydrophobicContact CB-CB 4.02Å; L265-A270 WeakPolarHBondContact O-CB 3.28Å; L265-A270 PolarHBondContact O-N 3.4Å; A270-I272 PolarHBondContact O-N 3.31Å
271	K	94.8	Very high	94.1	Very high	100 Å²	100	45.5 Å²	45.5	44%	0.435	23%	0.226	S	C	.	.			trans	-73.4	123.9	-178.5	-68.5	178.7	-160	79.5	0	110.6	D240 L274	D240-K271 PolarHBondContact OD1-N 2.68Å; D240-K271 WeakPolarHBondContact OD2-CG 3.44Å; D240-K271 IonicContact OD2-NZ 2.64Å; D240-K271 PolarHBondContact OD2-NZ 3.47Å; K271-L274 HydrophobicContact CB-CD1 3.82Å; K271-L274 HydrophobicContact CB-CD2 4.41Å; K271-L274 HydrophobicContact CB-CG 3.66Å; K271-L274 HydrophobicContact CD-CD2 4.2Å; K271-L274 HydrophobicContact CD-CG 4.35Å
272	I	95.3	Very high	94.1	Very high	29 Å²	29	45.6 Å²	45.6	15%	0.149	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-31.1	-177.4	-44.8	-176	0	0	0	111	L266 A270 L298 F301 A303	L266-I272 HydrophobicContact CD2-CD1 3.94Å; L266-I272 HydrophobicContact CD2-CG1 3.69Å; A270-I272 PolarHBondContact O-N 3.31Å; I272-L298 HydrophobicContact CG2-CD2 4Å; I272-F301 HydrophobicContact CD1-CB 3.86Å; I272-A303 HydrophobicContact CG2-CB 3.61Å
273	D	94	Very high	94	Very high	114 Å²	114	45.7 Å²	45.7	61%	0.61	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	16.8	-172	57.6	-32.7	0	0	0	113.7
274	L	94.7	Very high	94	Very high	29 Å²	29	44.4 Å²	44.4	15%	0.152	22%	0.22	C	C	.	.			trans	-63.4	145.4	171.1	-77.3	165.2	0	0	0	110.7	D240 L242 H251 K271	D240-L274 HydrophobicContact CB-CD1 3.94Å; L242-L274 HydrophobicContact CD2-CD1 4.44Å; L242-L274 HydrophobicContact CD2-CD2 4.49Å; H251-L274 PolarHBondContact CE1-O 2.99Å; H251-L274 PolarHBondContact NE2-O 3.27Å; K271-L274 HydrophobicContact CB-CD1 3.82Å; K271-L274 HydrophobicContact CB-CD2 4.41Å; K271-L274 HydrophobicContact CB-CG 3.66Å; K271-L274 HydrophobicContact CD-CD2 4.2Å; K271-L274 HydrophobicContact CD-CG 4.35Å
275	L	94.3	Very high	93.8	Very high	90 Å²	90	44.5 Å²	44.5	47%	0.471	22%	0.221	S	C	.	.			trans	-114.5	134.5	176.3	-62.6	176	0	0	0	110.6	W280 Q281	L275-W280 VanDerWaalsContact CA-O 3.29Å; L275-W280 WeakPolarHBondContact CA-O 3.4Å; L275-Q281 HydrophobicContact CD2-CG 3.53Å
276	D	91.5	Very high	93.7	Very high	27 Å²	27	44.5 Å²	44.5	14%	0.144	22%	0.221	C	C	.	.			trans	-75.4	-172.7	168.3	77.1	4.1	0	0	0	112.7	G246 D278 G279 W280	G246-D276 WeakPolarHBondContact O-CA 3.45Å; D276-D278 PolarHBondContact O-N 2.91Å; D276-D278 PolarHBondContact OD1-N 3.19Å; D276-G279 PolarHBondContact O-N 3.49Å; D276-G279 PolarHBondContact OD1-N 2.85Å; D276-W280 PolarHBondContact N-O 3.16Å; D276-W280 PolarHBondContact OD1-N 3.16Å
277	K	90.6	Very high	93.6	Very high	123 Å²	123	44.4 Å²	44.4	54%	0.535	22%	0.221	S	C	.	.	S	Bend	trans	-64.8	-34.8	178.7	-84.2	179.5	-160.7	172.6	0	114.1	A244 Q245 R310	A244-K277 WeakPolarHBondContact O-CE 3.36Å; A244-K277 PolarHBondContact O-NZ 3.15Å; Q245-K277 WeakPolarHBondContact O-CB 3.34Å; Q245-K277 WeakPolarHBondContact O-CD 3.46Å; Q245-K277 VanDerWaalsContact O-CE 3.31Å; Q245-K277 WeakPolarHBondContact O-CE 3.36Å; Q245-K277 WeakPolarHBondContact O-CG 3.46Å; K277-R310 VanDerWaalsContact O-CZ 3.23Å; K277-R310 PolarHBondContact O-NH1 3Å; K277-R310 PolarHBondContact O-NH2 3.09Å
278	D	87.9	Confident	93.5	Very high	48 Å²	48	40.8 Å²	40.8	26%	0.257	21%	0.21	S	C	.	.	S	Bend	trans	-84.7	-16.6	-178.5	-79.7	-83.2	0	0	0	112	D276 R310 K769	D276-D278 PolarHBondContact O-N 2.91Å; D276-D278 PolarHBondContact OD1-N 3.19Å; D278-R310 VanDerWaalsContact O-CB 3.3Å; D278-R310 WeakPolarHBondContact O-CB 3.13Å; D278-R310 VanDerWaalsContact O-CZ 3.28Å; D278-R310 PolarHBondContact O-NH1 3.24Å; D278-R310 VanDerWaalsContact O-NH1 3.09Å; D278-K769 IonicContact OD1-NZ 3.75Å; D278-K769 PolarHBondContact OD1-NZ 3.14Å
279	G	92.2	Very high	93.2	Very high	5 Å²	5	37.4 Å²	37.4	5%	0.052	20%	0.197	C	C	.	.	S	Bend	trans	104	27.9	173.6	0	0	0	0	0	112.7	D276	D276-G279 PolarHBondContact O-N 3.49Å; D276-G279 PolarHBondContact OD1-N 2.85Å
280	W	94.5	Very high	93.2	Very high	33 Å²	33	38 Å²	38	13%	0.125	19%	0.194	C	C	.	.			trans	-95.2	156.9	178.8	-74.3	43.1	0	0	0	110.7	H251 L275 D276 H284 I285 C288 T309 I318	H251-W280 PolarHBondContact NE2-O 3.37Å; L275-W280 VanDerWaalsContact CA-O 3.29Å; L275-W280 WeakPolarHBondContact CA-O 3.4Å; D276-W280 PolarHBondContact N-O 3.16Å; D276-W280 PolarHBondContact OD1-N 3.16Å; W280-H284 HydrophobicContact CB-CB 4.18Å; W280-H284 HydrophobicContact CD2-CB 4.03Å; W280-H284 HydrophobicContact CE3-CB 3.73Å; W280-H284 HydrophobicContact CG-CB 4.27Å; W280-H284 HydrophobicContact CZ3-CB 4.42Å; W280-I285 HydrophobicContact CE3-CG1 3.95Å; W280-C288 HydrophobicContact CH2-CB 3.94Å; W280-C288 HydrophobicContact CZ3-CB 3.54Å; W280-T309 HydrophobicContact CD2-CG2 4.48Å; W280-T309 HydrophobicContact CG-CG2 4.34Å; W280-I318 HydrophobicContact CH2-CD1 4.39Å; W280-I318 HydrophobicContact CH2-CG2 3.92Å; W280-I318 HydrophobicContact CZ2-CD1 4.4Å; W280-I318 HydrophobicContact CZ3-CG2 4.27Å
281	Q	95.8	Very high	93.1	Very high	29 Å²	29	39.3 Å²	39.3	14%	0.136	20%	0.199	C	C	.	.			trans	-112.3	166.4	173	-66.5	-177.4	19	0	0	108.5	H251 L275 I283 H284 I285	H251-Q281 WeakPolarHBondContact NE2-CA 3.43Å; L275-Q281 HydrophobicContact CD2-CG 3.53Å; Q281-I283 HydrophobicContact CB-CG2 4.15Å; Q281-I283 PolarHBondContact O-N 2.96Å; Q281-I283 VanDerWaalsContact O-N 3.09Å; Q281-H284 PolarHBondContact N-ND1 3.42Å; Q281-H284 VanDerWaalsContact N-ND1 3.19Å; Q281-H284 WeakPolarHBondContact O-CB 3.47Å; Q281-H284 PolarHBondContact O-N 3.09Å; Q281-I285 PolarHBondContact O-N 3.43Å; Q281-I285 VanDerWaalsContact O-N 3.11Å
282	A	95.8	Very high	93	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-52.9	-32.4	173.1	0	0	0	0	0	113.3	L250 H251 A254 A286 L298	L250-A282 HydrophobicContact CD2-CB 4.06Å; L250-A282 HydrophobicContact CG-CB 3.85Å; H251-A282 PolarHBondContact NE2-N 2.87Å; A254-A282 HydrophobicContact CB-CB 4.08Å; A282-A286 WeakPolarHBondContact O-CB 3.48Å; A282-A286 PolarHBondContact O-N 3.1Å; A282-L298 HydrophobicContact CB-CD1 4.13Å; A282-L298 HydrophobicContact CB-CD2 4.3Å
283	I	96	Very high	93	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-72.8	-34.3	176.3	-160.3	-178.9	0	0	0	113.2	Q281 A286 A287 V295 L298 V299 A303 V315	Q281-I283 HydrophobicContact CB-CG2 4.15Å; Q281-I283 PolarHBondContact O-N 2.96Å; Q281-I283 VanDerWaalsContact O-N 3.09Å; I283-A286 PolarHBondContact O-N 3.36Å; I283-A287 WeakPolarHBondContact O-CB 3.45Å; I283-A287 PolarHBondContact O-N 3.16Å; I283-V295 HydrophobicContact CD1-CG1 4.26Å; I283-V295 HydrophobicContact CG1-CG1 4.16Å; I283-V295 HydrophobicContact CG1-CG2 4.26Å; I283-L298 HydrophobicContact CB-CD1 4.06Å; I283-L298 HydrophobicContact CG1-CD1 4.42Å; I283-V299 HydrophobicContact CD1-CG2 3.67Å; I283-A303 HydrophobicContact CD1-CB 4.05Å; I283-V315 HydrophobicContact CD1-CG1 4.4Å; I283-V315 HydrophobicContact CG1-CG1 4.11Å; I283-V315 HydrophobicContact CG2-CG1 4.24Å
284	H	95	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-41	173.9	-62.8	138.2	0	0	0	110.9	W280 Q281 C288 A307 I318	W280-H284 HydrophobicContact CB-CB 4.18Å; W280-H284 HydrophobicContact CD2-CB 4.03Å; W280-H284 HydrophobicContact CE3-CB 3.73Å; W280-H284 HydrophobicContact CG-CB 4.27Å; W280-H284 HydrophobicContact CZ3-CB 4.42Å; Q281-H284 PolarHBondContact N-ND1 3.42Å; Q281-H284 VanDerWaalsContact N-ND1 3.19Å; Q281-H284 WeakPolarHBondContact O-CB 3.47Å; Q281-H284 PolarHBondContact O-N 3.09Å; H284-C288 WeakPolarHBondContact O-CB 3.39Å; H284-C288 PolarHBondContact O-N 2.81Å; H284-A307 PolarHBondContact NE2-O 3.28Å; H284-I318 HydrophobicContact CB-CD1 4.09Å
285	I	92.9	Very high	93.1	Very high	19 Å²	19	33.6 Å²	33.6	10%	0.097	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-51.1	173.7	-66.5	-176	0	0	0	110.8	H251 A254 A255 W280 Q281 A287 C288 W289	H251-I285 HydrophobicContact CB-CD1 3.81Å; A254-I285 HydrophobicContact CB-CG2 4.45Å; A255-I285 HydrophobicContact CB-CG2 3.64Å; W280-I285 HydrophobicContact CE3-CG1 3.95Å; Q281-I285 PolarHBondContact O-N 3.43Å; Q281-I285 VanDerWaalsContact O-N 3.11Å; I285-A287 VanDerWaalsContact C-N 3.28Å; I285-A287 PolarHBondContact O-N 2.8Å; I285-C288 PolarHBondContact O-N 3.15Å; I285-C288 VanDerWaalsContact O-N 3.15Å; I285-W289 VanDerWaalsContact O-CD1 3.31Å; I285-W289 PolarHBondContact O-N 2.92Å
286	A	94.1	Very high	93.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-38.4	-179.8	0	0	0	0	0	112.4	A254 A282 I283 C290 Q291 I294 V295 L298	A254-A286 HydrophobicContact CB-CB 4.33Å; A282-A286 WeakPolarHBondContact O-CB 3.48Å; A282-A286 PolarHBondContact O-N 3.1Å; I283-A286 PolarHBondContact O-N 3.36Å; A286-C290 PolarHBondContact O-N 3.09Å; A286-Q291 HydrophobicContact CB-CB 4.34Å; A286-Q291 PolarHBondContact O-N 2.85Å; A286-I294 HydrophobicContact CB-CB 4.05Å; A286-I294 HydrophobicContact CB-CG2 3.69Å; A286-V295 HydrophobicContact CB-CG2 3.52Å; A286-L298 HydrophobicContact CB-CD1 4.28Å
287	A	93.3	Very high	93.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-47.6	173.1	0	0	0	0	0	112.8	I283 I285 W289 C290 V315 M324	I283-A287 WeakPolarHBondContact O-CB 3.45Å; I283-A287 PolarHBondContact O-N 3.16Å; I285-A287 VanDerWaalsContact C-N 3.28Å; I285-A287 PolarHBondContact O-N 2.8Å; A287-W289 PolarHBondContact O-N 3.34Å; A287-C290 PolarHBondContact O-N 3.2Å; A287-V315 HydrophobicContact CB-CB 3.81Å; A287-V315 HydrophobicContact CB-CG1 3.98Å; A287-M324 HydrophobicContact CB-CE 4.46Å
288	C	91.9	Very high	93.6	Very high	40 Å²	40	25.8 Å²	25.8	27%	0.27	13%	0.132	S	C	.	.	H	α-helix	trans	-61.6	-30.4	178.1	-177.3	0	0	0	0	113.6	W280 H284 I285 I318	W280-C288 HydrophobicContact CH2-CB 3.94Å; W280-C288 HydrophobicContact CZ3-CB 3.54Å; H284-C288 WeakPolarHBondContact O-CB 3.39Å; H284-C288 PolarHBondContact O-N 2.81Å; I285-C288 PolarHBondContact O-N 3.15Å; I285-C288 VanDerWaalsContact O-N 3.15Å; C288-I318 HydrophobicContact CB-CG2 3.54Å
289	W	87.5	Confident	93.9	Very high	44 Å²	44	24 Å²	24	17%	0.167	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	11.2	177.7	-70.8	72.6	0	0	0	112.5	I285 A287 Q291 R753 I773	I285-W289 VanDerWaalsContact O-CD1 3.31Å; I285-W289 PolarHBondContact O-N 2.92Å; A287-W289 PolarHBondContact O-N 3.34Å; W289-Q291 HydrophobicContact CB-CG 3.96Å; W289-Q291 PolarHBondContact O-N 3.41Å; W289-Q291 PolarHBondContact O-NE2 2.98Å; W289-R753 VanDerWaalsContact CH2-CZ 3.46Å; W289-R753 VanDerWaalsContact CZ3-CZ 3.42Å; W289-I773 HydrophobicContact CH2-CB 4.41Å; W289-I773 HydrophobicContact CH2-CD1 3.91Å; W289-I773 HydrophobicContact CH2-CG1 4.33Å; W289-I773 HydrophobicContact CZ2-CB 4.24Å; W289-I773 HydrophobicContact CZ2-CD1 3.31Å; W289-I773 HydrophobicContact CZ2-CG1 3.71Å
290	C	91	Very high	93.9	Very high	58 Å²	58	27.2 Å²	27.2	39%	0.392	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	31.7	178.7	-58.8	0	0	0	0	114.6	A286 A287 L292	A286-C290 PolarHBondContact O-N 3.09Å; A287-C290 PolarHBondContact O-N 3.2Å; C290-L292 PolarHBondContact O-N 3.21Å; C290-L292 VanDerWaalsContact O-N 3.1Å
291	Q	92.5	Very high	93.9	Very high	35 Å²	35	26.6 Å²	26.6	16%	0.164	14%	0.137	C	C	.	.			trans	-85.4	76	179.5	-53	-61.8	-83.6	0	0	109.8	A286 W289 E293 I294 V295	A286-Q291 HydrophobicContact CB-CB 4.34Å; A286-Q291 PolarHBondContact O-N 2.85Å; W289-Q291 HydrophobicContact CB-CG 3.96Å; W289-Q291 PolarHBondContact O-N 3.41Å; W289-Q291 PolarHBondContact O-NE2 2.98Å; Q291-E293 PolarHBondContact O-N 3.41Å; Q291-I294 HydrophobicContact CB-CB 3.95Å; Q291-I294 HydrophobicContact CB-CG1 3.81Å; Q291-I294 WeakPolarHBondContact O-CB 3.35Å; Q291-I294 PolarHBondContact O-N 3.26Å; Q291-V295 PolarHBondContact O-N 3.37Å; Q291-V295 VanDerWaalsContact O-N 3.1Å
292	L	92.8	Very high	93.7	Very high	35 Å²	35	26 Å²	26	18%	0.183	14%	0.138	C	C	.	.	H	α-helix	trans	-54.4	-48.7	-173.9	172.2	59.9	0	0	0	113	C290 I294 V295 E296 M324 R327 I331	C290-L292 PolarHBondContact O-N 3.21Å; C290-L292 VanDerWaalsContact O-N 3.1Å; L292-I294 VanDerWaalsContact C-N 3.29Å; L292-I294 PolarHBondContact O-N 3.04Å; L292-V295 PolarHBondContact O-N 2.86Å; L292-V295 VanDerWaalsContact O-N 3.09Å; L292-E296 HydrophobicContact CD1-CG 4.38Å; L292-E296 PolarHBondContact O-N 3.1Å; L292-M324 HydrophobicContact CB-SD 3.83Å; L292-M324 HydrophobicContact CD1-SD 3.69Å; L292-M324 HydrophobicContact CG-SD 4.34Å; L292-R327 HydrophobicContact CD1-CB 3.57Å; L292-R327 HydrophobicContact CD1-CG 4.07Å; L292-R327 HydrophobicContact CD2-CB 4.43Å; L292-R327 HydrophobicContact CD2-CG 3.99Å; L292-I331 HydrophobicContact CD1-CD1 4.25Å
293	E	94.3	Very high	93.7	Very high	113 Å²	113	26.6 Å²	26.6	53%	0.528	14%	0.144	S	C	.	.	H	α-helix	trans	-59.9	-40.7	-179	-69.7	64.3	-146.6	0	0	110.9	Q291 E296 L297	Q291-E293 PolarHBondContact O-N 3.41Å; E293-E296 PolarHBondContact O-N 3.4Å; E293-L297 VanDerWaalsContact O-CB 3.22Å; E293-L297 WeakPolarHBondContact O-CB 3.39Å; E293-L297 PolarHBondContact O-N 2.98Å
294	I	95.5	Very high	93.6	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-39.9	176.2	-56.5	-57.2	0	0	0	110.9	A254 E259 V262 A286 Q291 L292 L297 L298	A254-I294 HydrophobicContact CB-CG2 3.96Å; E259-I294 HydrophobicContact CB-CD1 4.12Å; E259-I294 HydrophobicContact CG-CD1 4.42Å; V262-I294 HydrophobicContact CB-CD1 4.32Å; V262-I294 HydrophobicContact CG1-CG2 4.43Å; V262-I294 HydrophobicContact CG2-CD1 4.07Å; V262-I294 HydrophobicContact CG2-CG2 4.26Å; A286-I294 HydrophobicContact CB-CB 4.05Å; A286-I294 HydrophobicContact CB-CG2 3.69Å; Q291-I294 HydrophobicContact CB-CB 3.95Å; Q291-I294 HydrophobicContact CB-CG1 3.81Å; Q291-I294 WeakPolarHBondContact O-CB 3.35Å; Q291-I294 PolarHBondContact O-N 3.26Å; L292-I294 VanDerWaalsContact C-N 3.29Å; L292-I294 PolarHBondContact O-N 3.04Å; I294-L297 PolarHBondContact O-N 2.85Å; I294-L298 HydrophobicContact CG2-CD1 3.82Å; I294-L298 HydrophobicContact CG2-CG 4.29Å; I294-L298 WeakPolarHBondContact O-CB 3.44Å; I294-L298 WeakPolarHBondContact O-CG 3.42Å; I294-L298 PolarHBondContact O-N 3.05Å
295	V	95.7	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-44.8	175.5	173.2	0	0	0	0	111.4	I283 A286 Q291 L292 L297 L298 V299 M324 L328 I331	I283-V295 HydrophobicContact CD1-CG1 4.26Å; I283-V295 HydrophobicContact CG1-CG1 4.16Å; I283-V295 HydrophobicContact CG1-CG2 4.26Å; A286-V295 HydrophobicContact CB-CG2 3.52Å; Q291-V295 PolarHBondContact O-N 3.37Å; Q291-V295 VanDerWaalsContact O-N 3.1Å; L292-V295 PolarHBondContact O-N 2.86Å; L292-V295 VanDerWaalsContact O-N 3.09Å; V295-L297 VanDerWaalsContact C-N 3.29Å; V295-L297 PolarHBondContact O-N 3.22Å; V295-L298 PolarHBondContact O-N 3.25Å; V295-V299 HydrophobicContact CG1-CG2 4.31Å; V295-V299 WeakPolarHBondContact O-CB 3.43Å; V295-V299 WeakPolarHBondContact O-CG2 3.48Å; V295-V299 PolarHBondContact O-N 3Å; V295-M324 HydrophobicContact CB-CE 3.94Å; V295-M324 HydrophobicContact CG1-CE 4.44Å; V295-M324 HydrophobicContact CG2-CE 3.5Å; V295-M324 VanDerWaalsContact CG2-CE 3.5Å; V295-L328 HydrophobicContact CG1-CD2 3.78Å; V295-I331 HydrophobicContact CG1-CD1 4.47Å
296	E	94.4	Very high	93.6	Very high	59 Å²	59	34.4 Å²	34.4	28%	0.276	19%	0.185	S	C	.	.	H	α-helix	trans	-59.1	-42.2	174.2	-75.5	-163.4	-156.5	0	0	111.7	L292 E293 N300 R327 I331	L292-E296 HydrophobicContact CD1-CG 4.38Å; L292-E296 PolarHBondContact O-N 3.1Å; E293-E296 PolarHBondContact O-N 3.4Å; E296-N300 WeakPolarHBondContact O-CB 3.49Å; E296-N300 PolarHBondContact O-N 3.36Å; E296-N300 PolarHBondContact O-ND2 3.1Å; E296-R327 IonicContact OE1-CZ 2.82Å; E296-R327 IonicContact OE1-NE 2.72Å; E296-R327 IonicContact OE1-NH2 2.7Å; E296-R327 PolarHBondContact OE1-NH2 2.79Å; E296-I331 HydrophobicContact CG-CD1 3.57Å; E296-I331 HydrophobicContact CG-CG1 4.1Å
297	L	95.5	Very high	93.6	Very high	17 Å²	17	34.9 Å²	34.9	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-63.4	-49.5	177.2	177.2	56.2	0	0	0	112	E259 V262 L263 L266 E293 I294 V295 V299 N300 F301	E259-L297 HydrophobicContact CG-CD2 3.83Å; V262-L297 HydrophobicContact CB-CD2 4.05Å; V262-L297 HydrophobicContact CG1-CD2 3.6Å; V262-L297 HydrophobicContact CG1-CG 4.11Å; L263-L297 HydrophobicContact CB-CD2 4.02Å; L263-L297 HydrophobicContact CD1-CD1 3.71Å; L266-L297 HydrophobicContact CD1-CD1 4.4Å; L266-L297 HydrophobicContact CD1-CG 4.02Å; E293-L297 VanDerWaalsContact O-CB 3.22Å; E293-L297 WeakPolarHBondContact O-CB 3.39Å; E293-L297 PolarHBondContact O-N 2.98Å; I294-L297 PolarHBondContact O-N 2.85Å; V295-L297 VanDerWaalsContact C-N 3.29Å; V295-L297 PolarHBondContact O-N 3.22Å; L297-V299 PolarHBondContact O-N 3.25Å; L297-N300 PolarHBondContact O-N 3.49Å; L297-F301 HydrophobicContact CD1-CD2 3.76Å; L297-F301 HydrophobicContact CD1-CE2 3.67Å; L297-F301 WeakPolarHBondContact O-CD2 3.38Å; L297-F301 PolarHBondContact O-N 3.36Å
298	L	96.4	Very high	93.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-45.6	177.6	-75	168.2	0	0	0	111.9	L250 V262 L266 I272 A282 I283 A286 I294 V295 F301 G302 A303	L250-L298 HydrophobicContact CD1-CD2 4.44Å; L250-L298 HydrophobicContact CD2-CD2 4.3Å; V262-L298 HydrophobicContact CG1-CD2 4.43Å; L266-L298 HydrophobicContact CD1-CD2 4.15Å; L266-L298 HydrophobicContact CD2-CD2 4.31Å; I272-L298 HydrophobicContact CG2-CD2 4Å; A282-L298 HydrophobicContact CB-CD1 4.13Å; A282-L298 HydrophobicContact CB-CD2 4.3Å; I283-L298 HydrophobicContact CB-CD1 4.06Å; I283-L298 HydrophobicContact CG1-CD1 4.42Å; A286-L298 HydrophobicContact CB-CD1 4.28Å; I294-L298 HydrophobicContact CG2-CD1 3.82Å; I294-L298 HydrophobicContact CG2-CG 4.29Å; I294-L298 WeakPolarHBondContact O-CB 3.44Å; I294-L298 WeakPolarHBondContact O-CG 3.42Å; I294-L298 PolarHBondContact O-N 3.05Å; V295-L298 PolarHBondContact O-N 3.25Å; L298-F301 PolarHBondContact O-N 3.27Å; L298-G302 PolarHBondContact O-N 3.15Å; L298-A303 HydrophobicContact CB-CB 3.97Å; L298-A303 VanDerWaalsContact O-CB 3.3Å; L298-A303 WeakPolarHBondContact O-CB 3.47Å; L298-A303 PolarHBondContact O-N 3.37Å
299	V	95.2	Very high	93.7	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-39	177.9	173.2	0	0	0	0	111.4	I283 V295 L297 F301 G302 I305 I331 V335	I283-V299 HydrophobicContact CD1-CG2 3.67Å; V295-V299 HydrophobicContact CG1-CG2 4.31Å; V295-V299 WeakPolarHBondContact O-CB 3.43Å; V295-V299 WeakPolarHBondContact O-CG2 3.48Å; V295-V299 PolarHBondContact O-N 3Å; L297-V299 PolarHBondContact O-N 3.25Å; V299-F301 VanDerWaalsContact C-N 3.31Å; V299-F301 PolarHBondContact O-N 3.05Å; V299-G302 WeakPolarHBondContact O-CA 3.33Å; V299-G302 PolarHBondContact O-N 3.41Å; V299-I305 HydrophobicContact CG2-CB 4.29Å; V299-I305 HydrophobicContact CG2-CD1 4.43Å; V299-I331 HydrophobicContact CB-CG2 4.16Å; V299-I331 HydrophobicContact CG1-CG2 3.76Å; V299-I331 HydrophobicContact CG2-CG2 4.18Å; V299-V335 HydrophobicContact CG1-CG2 3.5Å
300	N	92.5	Very high	93.9	Very high	72 Å²	72	45.5 Å²	45.5	39%	0.385	23%	0.23	S	C	.	.	H	α-helix	trans	-64.6	-33.6	175	-79.5	-53.3	0	0	0	112.7	E296 L297 G302 K338 S381 W382	E296-N300 WeakPolarHBondContact O-CB 3.49Å; E296-N300 PolarHBondContact O-N 3.36Å; E296-N300 PolarHBondContact O-ND2 3.1Å; L297-N300 PolarHBondContact O-N 3.49Å; N300-G302 VanDerWaalsContact C-N 3.31Å; N300-K338 PolarHBondContact OD1-NZ 3.09Å; N300-S381 WeakPolarHBondContact O-CA 3.36Å; N300-S381 WeakPolarHBondContact O-CB 3.49Å; N300-S381 PolarHBondContact O-OG 3.14Å; N300-W382 PolarHBondContact O-N 2.91Å; N300-W382 VanDerWaalsContact O-N 3.09Å
301	F	94	Very high	93.9	Very high	20 Å²	20	48 Å²	48	9%	0.088	24%	0.239	C	C	.	.	H	α-helix	trans	-75.8	-16	170.8	-88.1	-93.1	0	0	0	114.4	L263 L266 K267 I272 L297 L298 V299 W382	L263-F301 HydrophobicContact CD1-CE2 4.01Å; L263-F301 HydrophobicContact CD1-CZ 4.36Å; L266-F301 HydrophobicContact CB-CD1 3.69Å; L266-F301 HydrophobicContact CB-CD2 4.04Å; L266-F301 HydrophobicContact CB-CE1 3.76Å; L266-F301 HydrophobicContact CB-CE2 4.11Å; L266-F301 HydrophobicContact CB-CG 3.82Å; L266-F301 HydrophobicContact CB-CZ 3.97Å; L266-F301 HydrophobicContact CD1-CB 4.07Å; L266-F301 HydrophobicContact CD1-CD2 3.72Å; L266-F301 HydrophobicContact CD1-CE2 4.31Å; L266-F301 HydrophobicContact CD1-CG 3.88Å; L266-F301 HydrophobicContact CD2-CB 4.26Å; L266-F301 HydrophobicContact CD2-CG 4.43Å; L266-F301 HydrophobicContact CG-CD2 4.47Å; L266-F301 HydrophobicContact CG-CG 4.27Å; K267-F301 HydrophobicContact CG-CZ 4.18Å; I272-F301 HydrophobicContact CD1-CB 3.86Å; L297-F301 HydrophobicContact CD1-CD2 3.76Å; L297-F301 HydrophobicContact CD1-CE2 3.67Å; L297-F301 WeakPolarHBondContact O-CD2 3.38Å; L297-F301 PolarHBondContact O-N 3.36Å; L298-F301 PolarHBondContact O-N 3.27Å; V299-F301 VanDerWaalsContact C-N 3.31Å; V299-F301 PolarHBondContact O-N 3.05Å; F301-W382 HydrophobicContact CD1-CB 3.63Å; F301-W382 AromaticContact CD1-CD2 3.83Å; F301-W382 HydrophobicContact CD1-CD2 3.83Å; F301-W382 HydrophobicContact CD1-CE3 4.13Å; F301-W382 AromaticContact CD1-CG 3.61Å; F301-W382 HydrophobicContact CD1-CG 3.61Å; F301-W382 HydrophobicContact CE1-CB 3.95Å; F301-W382 AromaticContact CE1-CD1 3.62Å; F301-W382 AromaticContact CE1-CD2 3.83Å; F301-W382 HydrophobicContact CE1-CD2 3.83Å; F301-W382 HydrophobicContact CE1-CE3 4.5Å; F301-W382 AromaticContact CE1-CG 3.54Å; F301-W382 HydrophobicContact CE1-CG 3.54Å; F301-W382 AromaticContact CE1-NE1 3.95Å; F301-W382 HydrophobicContact CG-CB 4.14Å; F301-W382 HydrophobicContact CZ-CG 4.42Å
302	G	92.2	Very high	93.9	Very high	16 Å²	16	48.2 Å²	48.2	17%	0.165	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.1	30.8	171.2	0	0	0	0	0	115.1	L298 V299 N300 K383	L298-G302 PolarHBondContact O-N 3.15Å; V299-G302 WeakPolarHBondContact O-CA 3.33Å; V299-G302 PolarHBondContact O-N 3.41Å; N300-G302 VanDerWaalsContact C-N 3.31Å; G302-K383 PolarHBondContact O-NZ 3.5Å
303	A	94.8	Very high	93.9	Very high	15 Å²	15	49.4 Å²	49.4	12%	0.124	26%	0.256	C	S	.	.			trans	-58.8	152.4	159.4	0	0	0	0	0	111	I272 I283 L298	I272-A303 HydrophobicContact CG2-CB 3.61Å; I283-A303 HydrophobicContact CD1-CB 4.05Å; L298-A303 HydrophobicContact CB-CB 3.97Å; L298-A303 VanDerWaalsContact O-CB 3.3Å; L298-A303 WeakPolarHBondContact O-CB 3.47Å; L298-A303 PolarHBondContact O-N 3.37Å
304	D	94	Very high	93.9	Very high	96 Å²	96	45.1 Å²	45.1	51%	0.513	24%	0.238	S	C	.	.			trans	-92.1	115.5	174	-158.9	-22.2	0	0	0	110.3	L306 A307	D304-L306 PolarHBondContact O-N 3.26Å; D304-L306 PolarHBondContact OD1-N 3.18Å; D304-A307 HydrophobicContact CB-CB 4.44Å; D304-A307 WeakPolarHBondContact O-CB 3.33Å; D304-A307 PolarHBondContact O-N 3.02Å
305	I	93.9	Very high	93.8	Very high	7 Å²	7	45 Å²	45	4%	0.036	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-9.8	175.7	-159.6	169.7	0	0	0	112.3	V299 V315 F316 L328 I331 K332	V299-I305 HydrophobicContact CG2-CB 4.29Å; V299-I305 HydrophobicContact CG2-CD1 4.43Å; I305-V315 HydrophobicContact CG1-CG2 3.79Å; I305-V315 WeakPolarHBondContact O-CG2 3.34Å; I305-F316 HydrophobicContact CD1-CZ 4.16Å; I305-F316 HydrophobicContact CG1-CE2 4.05Å; I305-F316 HydrophobicContact CG1-CZ 4.2Å; I305-L328 HydrophobicContact CD1-CD2 4.1Å; I305-L328 HydrophobicContact CG1-CD2 4.45Å; I305-I331 HydrophobicContact CD1-CB 4.04Å; I305-I331 HydrophobicContact CD1-CG2 3.7Å; I305-K332 HydrophobicContact CD1-CB 4.3Å; I305-K332 HydrophobicContact CG2-CB 4.46Å
306	L	94.5	Very high	93.7	Very high	82 Å²	82	46.4 Å²	46.4	43%	0.429	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	22.1	173.9	-53.1	180	0	0	0	111.8	D304 F316 K332	D304-L306 PolarHBondContact O-N 3.26Å; D304-L306 PolarHBondContact OD1-N 3.18Å; L306-F316 HydrophobicContact CD2-CE2 4.13Å; L306-K332 HydrophobicContact CD2-CD 4.12Å
307	A	94.1	Very high	93.5	Very high	9 Å²	9	48.9 Å²	48.9	7%	0.074	26%	0.258	C	S	.	.			trans	-60.3	144.9	166.2	0	0	0	0	0	110.5	H284 D304 T314	H284-A307 PolarHBondContact NE2-O 3.28Å; D304-A307 HydrophobicContact CB-CB 4.44Å; D304-A307 WeakPolarHBondContact O-CB 3.33Å; D304-A307 PolarHBondContact O-N 3.02Å; A307-T314 WeakPolarHBondContact O-CA 3.23Å
308	E	94	Very high	93.3	Very high	135 Å²	135	49.1 Å²	49.1	63%	0.631	26%	0.26	S	S	*	.			trans	-110.1	139.5	175	-69.7	173.3	-163.5	0	0	109.3	E313 T314	E308-E313 CarbonylContact C-O 3.52Å; E308-E313 WeakPolarHBondContact CA-O 3.31Å; E308-T314 HydrophobicContact CG-CG2 4.16Å
309	T	93	Very high	92.9	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.055	26%	0.264	C	S	.	.			trans	-69.8	175.6	166.6	71.4	0	0	0	0	110.6	W280 N311 G312 E313 I318	W280-T309 HydrophobicContact CD2-CG2 4.48Å; W280-T309 HydrophobicContact CG-CG2 4.34Å; T309-N311 PolarHBondContact O-N 3.21Å; T309-N311 PolarHBondContact OG1-N 3.08Å; T309-G312 PolarHBondContact O-N 3.04Å; T309-E313 HydrophobicContact CG2-CB 4.29Å; T309-E313 PolarHBondContact N-O 3.32Å; T309-E313 PolarHBondContact OG1-N 2.88Å; T309-E313 PolarHBondContact OG1-OE2 3.49Å; T309-I318 HydrophobicContact CG2-CD1 3.68Å
310	R	91.8	Very high	92.4	Very high	164 Å²	164	58.6 Å²	58.6	62%	0.619	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-20.7	171.3	-172.8	176.1	-65.5	141.1	1.2	114.1	K277 D278	K277-R310 VanDerWaalsContact O-CZ 3.23Å; K277-R310 PolarHBondContact O-NH1 3Å; K277-R310 PolarHBondContact O-NH2 3.09Å; D278-R310 VanDerWaalsContact O-CB 3.3Å; D278-R310 WeakPolarHBondContact O-CB 3.13Å; D278-R310 VanDerWaalsContact O-CZ 3.28Å; D278-R310 PolarHBondContact O-NH1 3.24Å; D278-R310 VanDerWaalsContact O-NH1 3.09Å
311	N	90.7	Very high	92.2	Very high	109 Å²	109	58.1 Å²	58.1	58%	0.583	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-13.2	178.2	-59.8	-17.2	0	0	0	113	T309 E313	T309-N311 PolarHBondContact O-N 3.21Å; T309-N311 PolarHBondContact OG1-N 3.08Å; N311-E313 HydrophobicContact CB-CG 4.03Å; N311-E313 WeakPolarHBondContact CB-OE1 3.34Å; N311-E313 WeakPolarHBondContact CB-OE2 3.48Å; N311-E313 PolarHBondContact ND2-OE1 3.39Å; N311-E313 PolarHBondContact ND2-OE2 3.2Å
312	G	92	Very high	92.1	Very high	41 Å²	41	63.6 Å²	63.6	42%	0.423	33%	0.331	S	S	.	.	S	Bend	trans	87.8	16	-168.4	0	0	0	0	0	114.2	T309	T309-G312 PolarHBondContact O-N 3.04Å
313	E	93.1	Very high	92	Very high	59 Å²	59	70 Å²	70	28%	0.276	36%	0.356	S	S	.	.			trans	-85.7	139.5	175.2	-58.2	137	173.9	0	0	109.8	E308 T309 N311 D317 I318	E308-E313 CarbonylContact C-O 3.52Å; E308-E313 WeakPolarHBondContact CA-O 3.31Å; T309-E313 HydrophobicContact CG2-CB 4.29Å; T309-E313 PolarHBondContact N-O 3.32Å; T309-E313 PolarHBondContact OG1-N 2.88Å; T309-E313 PolarHBondContact OG1-OE2 3.49Å; N311-E313 HydrophobicContact CB-CG 4.03Å; N311-E313 WeakPolarHBondContact CB-OE1 3.34Å; N311-E313 WeakPolarHBondContact CB-OE2 3.48Å; N311-E313 PolarHBondContact ND2-OE1 3.39Å; N311-E313 PolarHBondContact ND2-OE2 3.2Å; E313-D317 HydrophobicContact CB-CB 4.23Å; E313-I318 HydrophobicContact CB-CD1 4.35Å; E313-I318 HydrophobicContact CB-CG1 4.06Å
314	T	94	Very high	91.7	Very high	23 Å²	23	69.5 Å²	69.5	14%	0.141	35%	0.352	C	S	.	.			trans	-102.9	175.1	171.2	73.5	0	0	0	0	111	A307 E308 F316 D317 I318	A307-T314 WeakPolarHBondContact O-CA 3.23Å; E308-T314 HydrophobicContact CG-CG2 4.16Å; T314-F316 PolarHBondContact O-N 2.97Å; T314-F316 PolarHBondContact OG1-N 3.27Å; T314-D317 WeakPolarHBondContact CA-OD2 3.48Å; T314-D317 WeakPolarHBondContact CB-OD2 3.36Å; T314-D317 PolarHBondContact N-OD2 3.27Å; T314-D317 PolarHBondContact O-N 2.85Å; T314-D317 PolarHBondContact OG1-OD2 3.31Å; T314-I318 WeakPolarHBondContact O-CD1 3.5Å; T314-I318 VanDerWaalsContact O-CG1 3.3Å; T314-I318 WeakPolarHBondContact O-CG1 3.36Å; T314-I318 PolarHBondContact O-N 2.71Å; T314-I318 VanDerWaalsContact O-N 3.08Å
315	V	93.1	Very high	91.7	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56	-22.1	172.7	-60.4	0	0	0	0	114	I283 A287 I305 C319 L328	I283-V315 HydrophobicContact CD1-CG1 4.4Å; I283-V315 HydrophobicContact CG1-CG1 4.11Å; I283-V315 HydrophobicContact CG2-CG1 4.24Å; A287-V315 HydrophobicContact CB-CB 3.81Å; A287-V315 HydrophobicContact CB-CG1 3.98Å; I305-V315 HydrophobicContact CG1-CG2 3.79Å; I305-V315 WeakPolarHBondContact O-CG2 3.34Å; V315-C319 VanDerWaalsContact O-CB 3.28Å; V315-C319 WeakPolarHBondContact O-CB 3.37Å; V315-C319 PolarHBondContact O-N 2.82Å; V315-L328 HydrophobicContact CB-CD1 4.39Å; V315-L328 HydrophobicContact CB-CD2 4.39Å; V315-L328 HydrophobicContact CG2-CD1 4.32Å; V315-L328 HydrophobicContact CG2-CD2 3.92Å; V315-L328 WeakPolarHBondContact O-CD1 3.49Å
316	F	93.5	Very high	91.7	Very high	30 Å²	30	71.1 Å²	71.1	13%	0.132	36%	0.36	C	S	.	.	H	α-helix	trans	-78.2	-31.7	176	-61.8	-90.4	0	0	0	112.5	I305 L306 T314 L328 I329 K332	I305-F316 HydrophobicContact CD1-CZ 4.16Å; I305-F316 HydrophobicContact CG1-CE2 4.05Å; I305-F316 HydrophobicContact CG1-CZ 4.2Å; L306-F316 HydrophobicContact CD2-CE2 4.13Å; T314-F316 PolarHBondContact O-N 2.97Å; T314-F316 PolarHBondContact OG1-N 3.27Å; F316-L328 HydrophobicContact CD1-CB 4.07Å; F316-L328 HydrophobicContact CE1-CB 3.59Å; F316-L328 HydrophobicContact CZ-CB 4.07Å; F316-I329 HydrophobicContact CD1-CG1 4.4Å; F316-I329 HydrophobicContact CE1-CG1 4.02Å; F316-K332 HydrophobicContact CE1-CD 4.46Å; F316-K332 HydrophobicContact CE2-CD 4.18Å; F316-K332 HydrophobicContact CZ-CB 3.98Å; F316-K332 HydrophobicContact CZ-CD 3.73Å; F316-K332 HydrophobicContact CZ-CG 4.48Å
317	D	92.2	Very high	91.7	Very high	112 Å²	112	71.5 Å²	71.5	60%	0.599	36%	0.356	S	S	*	.	H	α-helix	trans	-85.6	-22.3	-179.7	-47.7	-82.6	0	0	0	112	E313 T314	E313-D317 HydrophobicContact CB-CB 4.23Å; T314-D317 WeakPolarHBondContact CA-OD2 3.48Å; T314-D317 WeakPolarHBondContact CB-OD2 3.36Å; T314-D317 PolarHBondContact N-OD2 3.27Å; T314-D317 PolarHBondContact O-N 2.85Å; T314-D317 PolarHBondContact OG1-OD2 3.31Å
318	I	89.7	Confident	91.7	Very high	22 Å²	22	71.1 Å²	71.1	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-85.1	-22	178.1	-66.2	165.8	0	0	0	112.2	W280 H284 C288 T309 E313 T314	W280-I318 HydrophobicContact CH2-CD1 4.39Å; W280-I318 HydrophobicContact CH2-CG2 3.92Å; W280-I318 HydrophobicContact CZ2-CD1 4.4Å; W280-I318 HydrophobicContact CZ3-CG2 4.27Å; H284-I318 HydrophobicContact CB-CD1 4.09Å; C288-I318 HydrophobicContact CB-CG2 3.54Å; T309-I318 HydrophobicContact CG2-CD1 3.68Å; E313-I318 HydrophobicContact CB-CD1 4.35Å; E313-I318 HydrophobicContact CB-CG1 4.06Å; T314-I318 WeakPolarHBondContact O-CD1 3.5Å; T314-I318 VanDerWaalsContact O-CG1 3.3Å; T314-I318 WeakPolarHBondContact O-CG1 3.36Å; T314-I318 PolarHBondContact O-N 2.71Å; T314-I318 VanDerWaalsContact O-N 3.08Å
319	C	87.7	Confident	91.6	Very high	13 Å²	13	67.9 Å²	67.9	9%	0.088	34%	0.339	C	S	.	.			trans	-90	109	-174.1	-173	0	0	0	0	111.5	V315 D321 M324 L328	V315-C319 VanDerWaalsContact O-CB 3.28Å; V315-C319 WeakPolarHBondContact O-CB 3.37Å; V315-C319 PolarHBondContact O-N 2.82Å; C319-D321 PolarHBondContact SG-O 3.35Å; C319-M324 VanDerWaalsContact SG-CB 3.58Å; C319-M324 WeakPolarHBondContact SG-CG 3.49Å; C319-L328 HydrophobicContact CB-CD1 3.93Å
320	E	85	Confident	91.7	Very high	196 Å²	196	72 Å²	72	92%	0.916	36%	0.358	S	S	*	.			trans	-81.4	-22.9	175.8	-61.8	-173.4	170.3	0	0	113.1
321	D	89.3	Confident	91.8	Very high	63 Å²	63	65 Å²	65	34%	0.337	33%	0.332	S	S	.	.			trans	-78.4	139.1	-179.3	171.3	47.7	0	0	0	113.5	C319 E323 M324 H325	C319-D321 PolarHBondContact SG-O 3.35Å; D321-E323 PolarHBondContact OD1-N 3.28Å; D321-E323 PolarHBondContact OD2-N 2.88Å; D321-M324 HydrophobicContact CB-CB 4.21Å; D321-M324 WeakPolarHBondContact OD2-CB 3.37Å; D321-M324 PolarHBondContact OD2-N 3.31Å; D321-H325 WeakPolarHBondContact O-CB 3.33Å; D321-H325 PolarHBondContact O-N 2.93Å
322	I	90.6	Very high	92	Very high	135 Å²	135	62.9 Å²	62.9	69%	0.692	32%	0.318	S	S	*	.	H	α-helix	trans	-74.2	-38.6	-177.4	-58.8	175.9	0	0	0	111.5	T326	I322-T326 VanDerWaalsContact O-CB 3.29Å; I322-T326 WeakPolarHBondContact O-CB 3.48Å; I322-T326 PolarHBondContact O-N 3.22Å; I322-T326 PolarHBondContact O-OG1 2.92Å
323	E	90.7	Very high	92.1	Very high	150 Å²	150	66.7 Å²	66.7	70%	0.701	33%	0.325	S	S	*	.	H	α-helix	trans	-71.9	-48.2	-177.6	-59.3	-155.7	164.3	0	0	110.5	D321 T326 R327	D321-E323 PolarHBondContact OD1-N 3.28Å; D321-E323 PolarHBondContact OD2-N 2.88Å; E323-T326 WeakPolarHBondContact O-CB 3.42Å; E323-T326 PolarHBondContact O-N 3.48Å; E323-R327 WeakPolarHBondContact O-CG 3.23Å; E323-R327 PolarHBondContact O-N 3.42Å
324	M	89.9	Confident	92	Very high	5 Å²	5	66.3 Å²	66.3	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-46.3	174.4	-178.3	57.1	168.5	0	0	112	A287 L292 V295 C319 D321 T326 R327 L328	A287-M324 HydrophobicContact CB-CE 4.46Å; L292-M324 HydrophobicContact CB-SD 3.83Å; L292-M324 HydrophobicContact CD1-SD 3.69Å; L292-M324 HydrophobicContact CG-SD 4.34Å; V295-M324 HydrophobicContact CB-CE 3.94Å; V295-M324 HydrophobicContact CG1-CE 4.44Å; V295-M324 HydrophobicContact CG2-CE 3.5Å; V295-M324 VanDerWaalsContact CG2-CE 3.5Å; C319-M324 VanDerWaalsContact SG-CB 3.58Å; C319-M324 WeakPolarHBondContact SG-CG 3.49Å; D321-M324 HydrophobicContact CB-CB 4.21Å; D321-M324 WeakPolarHBondContact OD2-CB 3.37Å; D321-M324 PolarHBondContact OD2-N 3.31Å; M324-T326 VanDerWaalsContact C-N 3.29Å; M324-T326 PolarHBondContact O-N 3Å; M324-R327 PolarHBondContact O-N 3.08Å; M324-L328 HydrophobicContact CE-CD2 4.36Å; M324-L328 HydrophobicContact CE-CG 4.4Å; M324-L328 HydrophobicContact CG-CD1 4.38Å; M324-L328 WeakPolarHBondContact O-CB 3.42Å; M324-L328 WeakPolarHBondContact O-CG 3.47Å; M324-L328 PolarHBondContact O-N 3.08Å; M324-L328 HydrophobicContact SD-CG 4.44Å
325	H	92.3	Very high	91.8	Very high	66 Å²	66	67.6 Å²	67.6	31%	0.306	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-37.2	174.6	-179.6	-89.2	0	0	0	112.2	D321 L328 I329	D321-H325 WeakPolarHBondContact O-CB 3.33Å; D321-H325 PolarHBondContact O-N 2.93Å; H325-L328 PolarHBondContact O-N 3.34Å; H325-I329 WeakPolarHBondContact O-CG1 3.17Å; H325-I329 PolarHBondContact O-N 3.32Å
326	T	94.2	Very high	91.7	Very high	70 Å²	70	72.1 Å²	72.1	43%	0.429	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-45.3	173.8	-60.8	0	0	0	0	111.4	I322 E323 M324 I329 E330	I322-T326 VanDerWaalsContact O-CB 3.29Å; I322-T326 WeakPolarHBondContact O-CB 3.48Å; I322-T326 PolarHBondContact O-N 3.22Å; I322-T326 PolarHBondContact O-OG1 2.92Å; E323-T326 WeakPolarHBondContact O-CB 3.42Å; E323-T326 PolarHBondContact O-N 3.48Å; M324-T326 VanDerWaalsContact C-N 3.29Å; M324-T326 PolarHBondContact O-N 3Å; T326-I329 WeakPolarHBondContact O-CB 3.44Å; T326-I329 PolarHBondContact O-N 3.48Å; T326-E330 PolarHBondContact O-N 2.88Å
327	R	93.9	Very high	91.6	Very high	91 Å²	91	74.7 Å²	74.7	34%	0.343	36%	0.361	S	S	.	.	H	α-helix	trans	-66.6	-38.4	177.5	-67.2	-68.9	-68.5	162.3	-7.7	112.5	L292 E296 E323 M324 I329 E330 I331	L292-R327 HydrophobicContact CD1-CB 3.57Å; L292-R327 HydrophobicContact CD1-CG 4.07Å; L292-R327 HydrophobicContact CD2-CB 4.43Å; L292-R327 HydrophobicContact CD2-CG 3.99Å; E296-R327 IonicContact OE1-CZ 2.82Å; E296-R327 IonicContact OE1-NE 2.72Å; E296-R327 IonicContact OE1-NH2 2.7Å; E296-R327 PolarHBondContact OE1-NH2 2.79Å; E323-R327 WeakPolarHBondContact O-CG 3.23Å; E323-R327 PolarHBondContact O-N 3.42Å; M324-R327 PolarHBondContact O-N 3.08Å; R327-I329 VanDerWaalsContact C-N 3.26Å; R327-I329 PolarHBondContact O-N 3.29Å; R327-E330 IonicContact CZ-OE2 3.86Å; R327-E330 IonicContact NE-OE2 3.94Å; R327-E330 IonicContact NH1-OE2 3.55Å; R327-E330 PolarHBondContact NH1-OE2 3.38Å; R327-E330 PolarHBondContact O-N 3.17Å; R327-E330 VanDerWaalsContact O-N 3.1Å; R327-I331 WeakPolarHBondContact O-CD1 3.36Å; R327-I331 VanDerWaalsContact O-CG1 3.22Å; R327-I331 WeakPolarHBondContact O-CG1 3.39Å; R327-I331 PolarHBondContact O-N 3.04Å
328	L	94.3	Very high	91.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56.3	-39.4	172.7	-75.4	171.5	0	0	0	112	V295 I305 V315 F316 C319 M324 H325 K332	V295-L328 HydrophobicContact CG1-CD2 3.78Å; I305-L328 HydrophobicContact CD1-CD2 4.1Å; I305-L328 HydrophobicContact CG1-CD2 4.45Å; V315-L328 HydrophobicContact CB-CD1 4.39Å; V315-L328 HydrophobicContact CB-CD2 4.39Å; V315-L328 HydrophobicContact CG2-CD1 4.32Å; V315-L328 HydrophobicContact CG2-CD2 3.92Å; V315-L328 WeakPolarHBondContact O-CD1 3.49Å; F316-L328 HydrophobicContact CD1-CB 4.07Å; F316-L328 HydrophobicContact CE1-CB 3.59Å; F316-L328 HydrophobicContact CZ-CB 4.07Å; C319-L328 HydrophobicContact CB-CD1 3.93Å; M324-L328 HydrophobicContact CE-CD2 4.36Å; M324-L328 HydrophobicContact CE-CG 4.4Å; M324-L328 HydrophobicContact CG-CD1 4.38Å; M324-L328 WeakPolarHBondContact O-CB 3.42Å; M324-L328 WeakPolarHBondContact O-CG 3.47Å; M324-L328 PolarHBondContact O-N 3.08Å; M324-L328 HydrophobicContact SD-CG 4.44Å; H325-L328 PolarHBondContact O-N 3.34Å; L328-K332 WeakPolarHBondContact O-CB 3.23Å; L328-K332 PolarHBondContact O-N 3.29Å
329	I	93.7	Very high	91	Very high	67 Å²	67	76.8 Å²	76.8	34%	0.344	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-45	174.9	-68.4	166.1	0	0	0	111.1	F316 H325 T326 R327 K332 Q333	F316-I329 HydrophobicContact CD1-CG1 4.4Å; F316-I329 HydrophobicContact CE1-CG1 4.02Å; H325-I329 WeakPolarHBondContact O-CG1 3.17Å; H325-I329 PolarHBondContact O-N 3.32Å; T326-I329 WeakPolarHBondContact O-CB 3.44Å; T326-I329 PolarHBondContact O-N 3.48Å; R327-I329 VanDerWaalsContact C-N 3.26Å; R327-I329 PolarHBondContact O-N 3.29Å; I329-K332 PolarHBondContact O-N 2.91Å; I329-Q333 VanDerWaalsContact CG2-NE2 3.35Å; I329-Q333 WeakPolarHBondContact O-CG 3.29Å; I329-Q333 PolarHBondContact O-N 2.98Å
330	E	94.5	Very high	91	Very high	95 Å²	95	79.2 Å²	79.2	44%	0.444	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-43.1	178.1	-65.1	-172.1	145.1	0	0	112	T326 R327 K332 Q333 E334	T326-E330 PolarHBondContact O-N 2.88Å; R327-E330 IonicContact CZ-OE2 3.86Å; R327-E330 IonicContact NE-OE2 3.94Å; R327-E330 IonicContact NH1-OE2 3.55Å; R327-E330 PolarHBondContact NH1-OE2 3.38Å; R327-E330 PolarHBondContact O-N 3.17Å; R327-E330 VanDerWaalsContact O-N 3.1Å; E330-K332 VanDerWaalsContact C-N 3.34Å; E330-K332 PolarHBondContact O-N 3.16Å; E330-Q333 PolarHBondContact O-N 3.2Å; E330-E334 WeakPolarHBondContact O-CB 3.5Å; E330-E334 PolarHBondContact O-N 2.82Å
331	I	93.4	Very high	91	Very high	18 Å²	18	74.8 Å²	74.8	9%	0.092	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-43.6	176.5	-64.8	161	0	0	0	110.4	L292 V295 E296 V299 I305 R327 E334 V335	L292-I331 HydrophobicContact CD1-CD1 4.25Å; V295-I331 HydrophobicContact CG1-CD1 4.47Å; E296-I331 HydrophobicContact CG-CD1 3.57Å; E296-I331 HydrophobicContact CG-CG1 4.1Å; V299-I331 HydrophobicContact CB-CG2 4.16Å; V299-I331 HydrophobicContact CG1-CG2 3.76Å; V299-I331 HydrophobicContact CG2-CG2 4.18Å; I305-I331 HydrophobicContact CD1-CB 4.04Å; I305-I331 HydrophobicContact CD1-CG2 3.7Å; R327-I331 WeakPolarHBondContact O-CD1 3.36Å; R327-I331 VanDerWaalsContact O-CG1 3.22Å; R327-I331 WeakPolarHBondContact O-CG1 3.39Å; R327-I331 PolarHBondContact O-N 3.04Å; I331-E334 PolarHBondContact O-N 2.9Å; I331-V335 WeakPolarHBondContact O-CG2 3.46Å; I331-V335 PolarHBondContact O-N 3.21Å
332	K	94.4	Very high	90.5	Very high	65 Å²	65	75.9 Å²	75.9	28%	0.283	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-48.1	175.4	175	175.5	176.9	173.1	0	112.3	I305 L306 F316 L328 I329 E330 E334 V335 E336	I305-K332 HydrophobicContact CD1-CB 4.3Å; I305-K332 HydrophobicContact CG2-CB 4.46Å; L306-K332 HydrophobicContact CD2-CD 4.12Å; F316-K332 HydrophobicContact CE1-CD 4.46Å; F316-K332 HydrophobicContact CE2-CD 4.18Å; F316-K332 HydrophobicContact CZ-CB 3.98Å; F316-K332 HydrophobicContact CZ-CD 3.73Å; F316-K332 HydrophobicContact CZ-CG 4.48Å; L328-K332 WeakPolarHBondContact O-CB 3.23Å; L328-K332 PolarHBondContact O-N 3.29Å; I329-K332 PolarHBondContact O-N 2.91Å; E330-K332 VanDerWaalsContact C-N 3.34Å; E330-K332 PolarHBondContact O-N 3.16Å; K332-E334 VanDerWaalsContact C-N 3.27Å; K332-E334 PolarHBondContact O-N 2.99Å; K332-V335 PolarHBondContact O-N 3.28Å; K332-E336 WeakPolarHBondContact CE-OE1 3.44Å; K332-E336 WeakPolarHBondContact CG-OE1 3.47Å; K332-E336 WeakPolarHBondContact O-CG 3.38Å; K332-E336 PolarHBondContact O-N 3.15Å
333	Q	93.9	Very high	89.9	Confident	120 Å²	120	75 Å²	75	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-59.2	-40	176.2	-70.9	178.3	32.1	0	0	111.6	I329 E330 E336 R337	I329-Q333 VanDerWaalsContact CG2-NE2 3.35Å; I329-Q333 WeakPolarHBondContact O-CG 3.29Å; I329-Q333 PolarHBondContact O-N 2.98Å; E330-Q333 PolarHBondContact O-N 3.2Å; Q333-E336 PolarHBondContact O-N 2.64Å; Q333-R337 WeakPolarHBondContact O-CB 3.43Å; Q333-R337 PolarHBondContact O-N 2.75Å
334	E	91.7	Very high	89.4	Confident	52 Å²	52	72.4 Å²	72.4	24%	0.243	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-39.6	176.7	175.5	60.9	-170.3	0	0	112.4	E330 I331 K332 R337 K338 M379	E330-E334 WeakPolarHBondContact O-CB 3.5Å; E330-E334 PolarHBondContact O-N 2.82Å; I331-E334 PolarHBondContact O-N 2.9Å; K332-E334 VanDerWaalsContact C-N 3.27Å; K332-E334 PolarHBondContact O-N 2.99Å; E334-R337 PolarHBondContact O-N 3.17Å; E334-R337 IonicContact OE1-CZ 2.74Å; E334-R337 IonicContact OE1-NH2 2.62Å; E334-R337 PolarHBondContact OE1-NH2 2.93Å; E334-R337 IonicContact OE2-CZ 3.44Å; E334-R337 IonicContact OE2-NE 3.15Å; E334-R337 PolarHBondContact OE2-NE 2.94Å; E334-R337 IonicContact OE2-NH2 3.81Å; E334-R337 PolarHBondContact OE2-NH2 3.48Å; E334-K338 HydrophobicContact CG-CD 4.48Å; E334-K338 WeakPolarHBondContact O-CB 3.34Å; E334-K338 VanDerWaalsContact O-CG 3.25Å; E334-K338 WeakPolarHBondContact O-CG 3.3Å; E334-K338 PolarHBondContact O-N 2.92Å; E334-K338 WeakPolarHBondContact OE1-CE 3.5Å; E334-K338 IonicContact OE1-NZ 3.72Å; E334-M379 WeakPolarHBondContact OE1-CE 3.2Å
335	V	90.5	Very high	88.8	Confident	49 Å²	49	77.4 Å²	77.4	30%	0.297	37%	0.373	S	S	.	.	H	α-helix	trans	-65.7	-46.3	173.2	170.4	0	0	0	0	111.7	V299 I331 K332 R337 K338 K339	V299-V335 HydrophobicContact CG1-CG2 3.5Å; I331-V335 WeakPolarHBondContact O-CG2 3.46Å; I331-V335 PolarHBondContact O-N 3.21Å; K332-V335 PolarHBondContact O-N 3.28Å; V335-R337 VanDerWaalsContact C-N 3.31Å; V335-R337 PolarHBondContact O-N 3.09Å; V335-K338 PolarHBondContact O-N 2.71Å; V335-K339 WeakPolarHBondContact O-CB 3.28Å; V335-K339 PolarHBondContact O-N 3.03Å
336	E	90.2	Very high	87.8	Confident	95 Å²	95	80.7 Å²	80.7	44%	0.444	39%	0.392	S	S	.	.	H	α-helix	trans	-60.9	-40.3	176.2	-72.1	174.4	-176	0	0	111.5	K332 Q333 K339 S340	K332-E336 WeakPolarHBondContact CE-OE1 3.44Å; K332-E336 WeakPolarHBondContact CG-OE1 3.47Å; K332-E336 WeakPolarHBondContact O-CG 3.38Å; K332-E336 PolarHBondContact O-N 3.15Å; Q333-E336 PolarHBondContact O-N 2.64Å; E336-K339 PolarHBondContact O-N 3.19Å; E336-S340 WeakPolarHBondContact O-CB 3.28Å; E336-S340 PolarHBondContact O-N 3.05Å; E336-S340 PolarHBondContact O-OG 3.26Å
337	R	90.8	Very high	86.6	Confident	84 Å²	84	82.7 Å²	82.7	32%	0.317	40%	0.4	S	S	.	.	H	α-helix	trans	-66.3	-41.9	176	-168.2	-161.5	62.9	60.7	-1.3	112.4	Q333 E334 V335 Q341	Q333-R337 WeakPolarHBondContact O-CB 3.43Å; Q333-R337 PolarHBondContact O-N 2.75Å; E334-R337 PolarHBondContact O-N 3.17Å; E334-R337 IonicContact OE1-CZ 2.74Å; E334-R337 IonicContact OE1-NH2 2.62Å; E334-R337 PolarHBondContact OE1-NH2 2.93Å; E334-R337 IonicContact OE2-CZ 3.44Å; E334-R337 IonicContact OE2-NE 3.15Å; E334-R337 PolarHBondContact OE2-NE 2.94Å; E334-R337 IonicContact OE2-NH2 3.81Å; E334-R337 PolarHBondContact OE2-NH2 3.48Å; V335-R337 VanDerWaalsContact C-N 3.31Å; V335-R337 PolarHBondContact O-N 3.09Å; R337-Q341 WeakPolarHBondContact O-CG 3.25Å; R337-Q341 PolarHBondContact O-N 3.26Å; R337-Q341 VanDerWaalsContact O-N 3.12Å
338	K	84.5	Confident	85.3	Confident	33 Å²	33	84.7 Å²	84.7	14%	0.143	41%	0.412	C	S	.	.	H	α-helix	trans	-60	-49.8	172.6	-75.1	167.5	-177.5	174.9	0	110.8	N300 E334 V335 S340 Q341 Q342 M379	N300-K338 PolarHBondContact OD1-NZ 3.09Å; E334-K338 HydrophobicContact CG-CD 4.48Å; E334-K338 WeakPolarHBondContact O-CB 3.34Å; E334-K338 VanDerWaalsContact O-CG 3.25Å; E334-K338 WeakPolarHBondContact O-CG 3.3Å; E334-K338 PolarHBondContact O-N 2.92Å; E334-K338 WeakPolarHBondContact OE1-CE 3.5Å; E334-K338 IonicContact OE1-NZ 3.72Å; V335-K338 PolarHBondContact O-N 2.71Å; K338-S340 PolarHBondContact O-N 3Å; K338-Q341 PolarHBondContact O-N 3.16Å; K338-Q342 PolarHBondContact O-N 3.12Å; K338-M379 VanDerWaalsContact CD-O 3.28Å; K338-M379 WeakPolarHBondContact CD-O 3.47Å; K338-M379 WeakPolarHBondContact CE-O 3.35Å
339	K	85.4	Confident	83	Confident	146 Å²	146	91.3 Å²	91.3	64%	0.635	45%	0.454	S	S	*	.	H	α-helix	trans	-59.5	-44	179.7	-171.2	175.7	-176.1	175.4	0	112.4	V335 E336 Q342 Q343	V335-K339 WeakPolarHBondContact O-CB 3.28Å; V335-K339 PolarHBondContact O-N 3.03Å; E336-K339 PolarHBondContact O-N 3.19Å; K339-Q342 PolarHBondContact O-N 3.11Å; K339-Q343 PolarHBondContact O-N 2.83Å
340	S	87	Confident	81.1	Confident	63 Å²	63	91.2 Å²	91.2	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.2	-58.2	0	0	0	0	112.2	E336 K338 Q342 Q343 D344	E336-S340 WeakPolarHBondContact O-CB 3.28Å; E336-S340 PolarHBondContact O-N 3.05Å; E336-S340 PolarHBondContact O-OG 3.26Å; K338-S340 PolarHBondContact O-N 3Å; S340-Q342 VanDerWaalsContact C-N 3.32Å; S340-Q342 PolarHBondContact O-N 2.91Å; S340-Q343 PolarHBondContact O-N 3.24Å; S340-D344 PolarHBondContact O-N 2.81Å
341	Q	85.7	Confident	78.7	Confident	103 Å²	103	96 Å²	96	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-34.9	177.2	-74.2	179.9	-5.8	0	0	112.9	R337 K338 D344 L345	R337-Q341 WeakPolarHBondContact O-CG 3.25Å; R337-Q341 PolarHBondContact O-N 3.26Å; R337-Q341 VanDerWaalsContact O-N 3.12Å; K338-Q341 PolarHBondContact O-N 3.16Å; Q341-D344 PolarHBondContact O-N 3.34Å; Q341-L345 VanDerWaalsContact O-CG 3.31Å; Q341-L345 WeakPolarHBondContact O-CG 3.28Å; Q341-L345 PolarHBondContact O-N 3.18Å; Q341-L345 VanDerWaalsContact O-N 3.11Å
342	Q	78.3	Confident	76.1	Confident	86 Å²	86	101.1 Å²	101.1	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-41.8	172.4	-170.7	-177.8	98.1	0	0	111.5	K338 K339 S340 L345 L346 E384	K338-Q342 PolarHBondContact O-N 3.12Å; K339-Q342 PolarHBondContact O-N 3.11Å; S340-Q342 VanDerWaalsContact C-N 3.32Å; S340-Q342 PolarHBondContact O-N 2.91Å; Q342-L345 WeakPolarHBondContact O-CB 3.34Å; Q342-L345 PolarHBondContact O-N 3.08Å; Q342-L346 WeakPolarHBondContact O-CG 3.43Å; Q342-L346 PolarHBondContact O-N 3.18Å; Q342-L346 VanDerWaalsContact O-N 3.12Å; Q342-E384 PolarHBondContact NE2-OE1 2.85Å
343	Q	79.1	Confident	73.5	Confident	116 Å²	116	109.4 Å²	109.4	54%	0.542	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-39.8	175.5	-166.2	174.6	11.7	0	0	112.3	K339 S340 L345 L346 N347	K339-Q343 PolarHBondContact O-N 2.83Å; S340-Q343 PolarHBondContact O-N 3.24Å; Q343-L345 VanDerWaalsContact C-N 3.28Å; Q343-L345 PolarHBondContact O-N 3.1Å; Q343-L346 PolarHBondContact O-N 2.98Å; Q343-N347 WeakPolarHBondContact O-CB 3.49Å; Q343-N347 PolarHBondContact O-N 2.87Å
344	D	80.5	Confident	70.8	Confident	97 Å²	97	111.5 Å²	111.5	52%	0.519	56%	0.563	S	S	.	*	H	α-helix	trans	-66.6	-24.8	173.6	-82.2	-18.3	0	0	0	113.9	S340 Q341 K348	S340-D344 PolarHBondContact O-N 2.81Å; Q341-D344 PolarHBondContact O-N 3.34Å; D344-K348 VanDerWaalsContact O-CD 3.31Å; D344-K348 WeakPolarHBondContact O-CD 3.34Å; D344-K348 WeakPolarHBondContact O-CE 3.38Å; D344-K348 WeakPolarHBondContact O-CG 3.47Å
345	L	75.9	Confident	68.2	Low	110 Å²	110	117.2 Å²	117.2	58%	0.576	59%	0.594	S	S	*	*	H	α-helix	trans	-76	-35.6	172	-73.3	166.9	0	0	0	111.6	Q341 Q342 Q343	Q341-L345 VanDerWaalsContact O-CG 3.31Å; Q341-L345 WeakPolarHBondContact O-CG 3.28Å; Q341-L345 PolarHBondContact O-N 3.18Å; Q341-L345 VanDerWaalsContact O-N 3.11Å; Q342-L345 WeakPolarHBondContact O-CB 3.34Å; Q342-L345 PolarHBondContact O-N 3.08Å; Q343-L345 VanDerWaalsContact C-N 3.28Å; Q343-L345 PolarHBondContact O-N 3.1Å
346	L	72.7	Confident	65.8	Low	134 Å²	134	119.2 Å²	119.2	70%	0.702	61%	0.606	S	S	*	*	H	α-helix	trans	-73.4	-38.4	175.4	-68.1	167.2	0	0	0	112.7	Q342 Q343 K348	Q342-L346 WeakPolarHBondContact O-CG 3.43Å; Q342-L346 PolarHBondContact O-N 3.18Å; Q342-L346 VanDerWaalsContact O-N 3.12Å; Q343-L346 PolarHBondContact O-N 2.98Å; L346-K348 VanDerWaalsContact C-N 3.3Å; L346-K348 PolarHBondContact O-N 2.97Å
347	N	69	Low	63.1	Low	112 Å²	112	125.8 Å²	125.8	60%	0.599	63%	0.627	S	S	*	*	S	Bend	trans	-76.6	-8.5	-177.5	-76.8	-19	0	0	0	114.6	Q343 P349	Q343-N347 WeakPolarHBondContact O-CB 3.49Å; Q343-N347 PolarHBondContact O-N 2.87Å; N347-P349 WeakPolarHBondContact O-CD 3.42Å
348	K	65.3	Low	60.6	Low	133 Å²	133	132 Å²	132	58%	0.578	65%	0.651	S	S	*	*	S	Bend	trans	-69	123.7	177.6	-85.6	160.1	-172.3	150.8	0	110.5	D344 L346 G350	D344-K348 VanDerWaalsContact O-CD 3.31Å; D344-K348 WeakPolarHBondContact O-CD 3.34Å; D344-K348 WeakPolarHBondContact O-CE 3.38Å; D344-K348 WeakPolarHBondContact O-CG 3.47Å; L346-K348 VanDerWaalsContact C-N 3.3Å; L346-K348 PolarHBondContact O-N 2.97Å; K348-G350 VanDerWaalsContact C-N 3.3Å; K348-G350 PolarHBondContact O-N 3.18Å
349	P	45.9	Very low	58.2	Low	139 Å²	139	142 Å²	142	90%	0.903	69%	0.688	S	S	*	*			trans	-73.1	77.9	-173.5	29.1	-35.8	0	0	0	113	N347	N347-P349 WeakPolarHBondContact O-CD 3.42Å
350	G	53.7	Low	56.3	Low	65 Å²	65	140.1 Å²	140.1	67%	0.67	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-98.7	122.2	169.6	0	0	0	0	0	111	K348	K348-G350 VanDerWaalsContact C-N 3.3Å; K348-G350 PolarHBondContact O-N 3.18Å
351	K	45.4	Very low	54.3	Low	196 Å²	196	142.5 Å²	142.5	85%	0.852	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-51.8	136	-178.3	-65.1	-178.1	178.6	-177.2	0	111.6	R353	K351-R353 PolarHBondContact O-N 3.06Å; K351-R353 VanDerWaalsContact O-N 3.08Å
352	P	37.2	Very low	52.3	Low	125 Å²	125	144.2 Å²	144.2	81%	0.812	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-61.2	116.4	177	25.7	-33.8	0	0	0	109.8	E354	P352-E354 PolarHBondContact O-N 3.11Å
353	R	40.3	Very low	50.6	Low	239 Å²	239	145.2 Å²	145.2	90%	0.902	74%	0.735	S	S	*	*			trans	-80.8	78	167.5	-87	-173.3	161.3	-172.4	-5.2	108.8	K351 L355	K351-R353 PolarHBondContact O-N 3.06Å; K351-R353 VanDerWaalsContact O-N 3.08Å; R353-L355 PolarHBondContact O-N 3.32Å
354	E	38.2	Very low	49.1	Very low	165 Å²	165	145.8 Å²	145.8	77%	0.771	75%	0.749	S	S	*	*			trans	-49.6	120.1	167.1	-171.5	-178.3	174.2	0	0	109.5	P352 V356	P352-E354 PolarHBondContact O-N 3.11Å; E354-V356 HydrophobicContact CB-CG2 4.47Å; E354-V356 HydrophobicContact CG-CG2 4.05Å; E354-V356 PolarHBondContact O-N 3.44Å
355	L	36.3	Very low	47.5	Very low	171 Å²	171	152.2 Å²	152.2	90%	0.895	77%	0.766	S	S	*	*			trans	-79	63	-174.3	-82.4	166.1	0	0	0	111.3	R353 R357	R353-L355 PolarHBondContact O-N 3.32Å; L355-R357 PolarHBondContact O-N 2.95Å
356	V	40.3	Very low	46.2	Very low	91 Å²	91	151.9 Å²	151.9	55%	0.552	77%	0.773	S	S	*	*			trans	-61.8	100.9	173.9	-178.5	0	0	0	0	109	E354 R358	E354-V356 HydrophobicContact CB-CG2 4.47Å; E354-V356 HydrophobicContact CG-CG2 4.05Å; E354-V356 PolarHBondContact O-N 3.44Å; V356-R358 VanDerWaalsContact C-N 3.26Å; V356-R358 HydrophobicContact CG1-CG 4.5Å; V356-R358 PolarHBondContact O-N 3Å
357	R	33.6	Very low	44.8	Very low	234 Å²	234	149.4 Å²	149.4	88%	0.883	77%	0.772	S	S	*	*			trans	-68.8	66.5	-170	-168.4	-179.4	-176.8	151.4	1	113.4	L355 R359	L355-R357 PolarHBondContact O-N 2.95Å; R357-R359 PolarHBondContact O-N 2.95Å
358	R	38.1	Very low	43.6	Very low	214 Å²	214	149.8 Å²	149.8	81%	0.808	78%	0.783	S	S	*	*			trans	-72.3	110.6	174.5	-80.1	-169.6	162.7	117.3	0.8	111.1	V356 S360	V356-R358 VanDerWaalsContact C-N 3.26Å; V356-R358 HydrophobicContact CG1-CG 4.5Å; V356-R358 PolarHBondContact O-N 3Å; R358-S360 PolarHBondContact O-N 3.11Å
359	R	34.4	Very low	42.8	Very low	244 Å²	244	150.3 Å²	150.3	92%	0.921	79%	0.791	S	S	*	*			trans	-68.5	101.2	167	-72	179.3	174.6	-124.6	6.6	109.8	R357	R357-R359 PolarHBondContact O-N 2.95Å
360	S	46.2	Very low	42.9	Very low	105 Å²	105	155.1 Å²	155.1	73%	0.734	79%	0.791	S	S	*	*			trans	-155.9	126.6	163	53	0	0	0	0	109.9	R358	R358-S360 PolarHBondContact O-N 3.11Å
361	S	43.6	Very low	42.7	Very low	114 Å²	114	163 Å²	163	80%	0.797	80%	0.8	S	S	*	*			trans	-73.9	125.5	179.5	49.5	0	0	0	0	112
362	T	44.4	Very low	43.2	Very low	139 Å²	139	155.9 Å²	155.9	85%	0.853	77%	0.773	S	S	*	*			trans	-176.2	142.5	135.3	17.9	0	0	0	0	112.5
363	N	43.5	Very low	43.8	Very low	107 Å²	107	152.7 Å²	152.7	57%	0.572	75%	0.754	S	S	*	*			trans	58.3	101.8	157.3	-163.3	2.8	0	0	0	119.3	R365	N363-R365 PolarHBondContact O-N 2.79Å; N363-R365 VanDerWaalsContact O-N 3.13Å; N363-R365 WeakPolarHBondContact OD1-CB 3.48Å; N363-R365 PolarHBondContact OD1-N 2.93Å
364	P	47.1	Very low	44.3	Very low	128 Å²	128	147.2 Å²	147.2	83%	0.831	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	12	179.5	34	-37	0	0	0	115.5
365	R	47.2	Very low	44.6	Very low	232 Å²	232	149.4 Å²	149.4	88%	0.875	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-1.3	-172	-81.8	-175.7	156.5	123.6	-3.4	117.3	N363	N363-R365 PolarHBondContact O-N 2.79Å; N363-R365 VanDerWaalsContact O-N 3.13Å; N363-R365 WeakPolarHBondContact OD1-CB 3.48Å; N363-R365 PolarHBondContact OD1-N 2.93Å
366	S	47.6	Very low	45.4	Very low	103 Å²	103	146.6 Å²	146.6	72%	0.72	72%	0.723	S	S	*	*			trans	-103.9	3.7	-176.8	62.4	0	0	0	0	115.6	S368	S366-S368 PolarHBondContact O-N 2.64Å
367	A	42.9	Very low	46	Very low	82 Å²	82	147.3 Å²	147.3	68%	0.678	72%	0.719	S	S	*	*			trans	-74.2	67.1	177.3	0	0	0	0	0	112.3	I369	A367-I369 PolarHBondContact O-N 2.94Å
368	S	44.3	Very low	46.7	Very low	120 Å²	120	142.7 Å²	142.7	84%	0.839	71%	0.706	S	S	*	*			trans	-73	75.4	176.8	-166.8	0	0	0	0	111.2	S366	S366-S368 PolarHBondContact O-N 2.64Å
369	I	49	Very low	47.1	Very low	144 Å²	144	136.3 Å²	136.3	74%	0.738	69%	0.686	S	S	*	*			trans	-76.1	123.8	166.6	-61.4	173.2	0	0	0	106.8	A367 R371	A367-I369 PolarHBondContact O-N 2.94Å; I369-R371 PolarHBondContact O-N 3.37Å
370	R	48.7	Very low	48.4	Very low	240 Å²	240	127.6 Å²	127.6	91%	0.906	66%	0.657	S	S	*	*			trans	-62.1	110.9	172.1	-70.8	-175.3	176.3	117.7	-2.7	108	T372	R370-T372 PolarHBondContact O-N 3.41Å
371	R	48.4	Very low	49.2	Very low	230 Å²	230	123.3 Å²	123.3	87%	0.868	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-58.7	125.6	164.1	-73.1	177.5	166.6	86.4	-6.9	107.1	I369	I369-R371 PolarHBondContact O-N 3.37Å
372	T	55.1	Low	50.1	Low	47 Å²	47	122.9 Å²	122.9	29%	0.288	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-54.4	146.2	157.1	38.8	0	0	0	0	108.6	R370 E376	R370-T372 PolarHBondContact O-N 3.41Å; T372-E376 VanDerWaalsContact CA-OE2 3.3Å; T372-E376 WeakPolarHBondContact CA-OE2 3.35Å; T372-E376 VanDerWaalsContact CB-OE2 3.3Å; T372-E376 WeakPolarHBondContact CB-OE2 3.44Å
373	S	51	Low	51	Low	57 Å²	57	121.6 Å²	121.6	40%	0.399	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-56.7	144.7	-177.5	-179.8	0	0	0	0	110.4	R375 E376 K377	S373-R375 PolarHBondContact O-N 2.92Å; S373-R375 PolarHBondContact OG-N 3.15Å; S373-E376 PolarHBondContact N-OE2 2.91Å; S373-E376 WeakPolarHBondContact O-CB 3.35Å; S373-E376 PolarHBondContact O-N 3.16Å; S373-K377 PolarHBondContact O-N 2.96Å
374	M	50	Low	52.3	Low	124 Å²	124	118.5 Å²	118.5	61%	0.611	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-21.7	169.3	-71.6	-69.2	-80.6	0	0	111.9
375	R	44.6	Very low	53.3	Low	212 Å²	212	114.1 Å²	114.1	80%	0.8	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-35.7	171.7	-166.6	176.8	-173	174.4	2.9	113.3	S373 M379	S373-R375 PolarHBondContact O-N 2.92Å; S373-R375 PolarHBondContact OG-N 3.15Å; R375-M379 WeakPolarHBondContact O-CG 3.16Å
376	E	53.1	Low	54.5	Low	111 Å²	111	107.9 Å²	107.9	52%	0.519	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-40.5	177.8	-69.1	160.7	175.2	0	0	110.6	T372 S373 K378 M379	T372-E376 VanDerWaalsContact CA-OE2 3.3Å; T372-E376 WeakPolarHBondContact CA-OE2 3.35Å; T372-E376 VanDerWaalsContact CB-OE2 3.3Å; T372-E376 WeakPolarHBondContact CB-OE2 3.44Å; S373-E376 PolarHBondContact N-OE2 2.91Å; S373-E376 WeakPolarHBondContact O-CB 3.35Å; S373-E376 PolarHBondContact O-N 3.16Å; E376-K378 PolarHBondContact O-N 3.4Å; E376-K378 VanDerWaalsContact O-N 3.15Å; E376-M379 PolarHBondContact O-N 2.88Å
377	K	54	Low	55.4	Low	107 Å²	107	108.1 Å²	108.1	47%	0.465	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.9	178.1	-76.7	-166.1	165.9	-157.5	0	115.4	S373 M379	S373-K377 PolarHBondContact O-N 2.96Å; K377-M379 VanDerWaalsContact C-N 3.33Å
378	K	47.5	Very low	56.6	Low	137 Å²	137	107.3 Å²	107.3	60%	0.596	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-8.8	172.7	-74.2	-164	174.4	-159.9	0	113.8	E376	E376-K378 PolarHBondContact O-N 3.4Å; E376-K378 VanDerWaalsContact O-N 3.15Å
379	M	46.3	Very low	57.6	Low	79 Å²	79	103.5 Å²	103.5	39%	0.389	47%	0.474	S	S	.	.	S	Bend	trans	-115.2	4	-170.2	-45.3	-57.8	-72.6	0	0	113.7	E334 K338 R375 E376 K377	E334-M379 WeakPolarHBondContact OE1-CE 3.2Å; K338-M379 VanDerWaalsContact CD-O 3.28Å; K338-M379 WeakPolarHBondContact CD-O 3.47Å; K338-M379 WeakPolarHBondContact CE-O 3.35Å; R375-M379 WeakPolarHBondContact O-CG 3.16Å; E376-M379 PolarHBondContact O-N 2.88Å; K377-M379 VanDerWaalsContact C-N 3.33Å
380	I	61.4	Low	58.6	Low	61 Å²	61	102 Å²	102	31%	0.313	46%	0.464	S	S	.	.	S	Bend	trans	-91.3	134.5	-179.9	-166.9	163.5	0	0	0	109.6	E384 A385	I380-E384 HydrophobicContact CD1-CB 4.07Å; I380-E384 HydrophobicContact CG1-CB 3.49Å; I380-E384 VanDerWaalsContact CG1-CB 3.49Å; I380-A385 HydrophobicContact CG2-CB 4.18Å
381	S	63.3	Low	58.8	Low	15 Å²	15	98.8 Å²	98.8	11%	0.105	46%	0.461	C	S	.	.			trans	-64.1	152.5	178	172.8	0	0	0	0	110.9	N300 K383 E384 A385	N300-S381 WeakPolarHBondContact O-CA 3.36Å; N300-S381 WeakPolarHBondContact O-CB 3.49Å; N300-S381 PolarHBondContact O-OG 3.14Å; S381-K383 PolarHBondContact O-N 3.38Å; S381-E384 WeakPolarHBondContact CB-OE2 3.38Å; S381-E384 PolarHBondContact N-OE2 3.12Å; S381-E384 WeakPolarHBondContact O-CB 3.22Å; S381-E384 PolarHBondContact O-N 2.78Å; S381-A385 WeakPolarHBondContact O-CB 3.34Å; S381-A385 PolarHBondContact O-N 3.35Å
382	W	62.9	Low	59.2	Low	106 Å²	106	93.9 Å²	93.9	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-56.5	-39.6	176.8	-172.9	91.9	0	0	0	112.4	N300 F301 E384 A385 K386	N300-W382 PolarHBondContact O-N 2.91Å; N300-W382 VanDerWaalsContact O-N 3.09Å; F301-W382 HydrophobicContact CD1-CB 3.63Å; F301-W382 AromaticContact CD1-CD2 3.83Å; F301-W382 HydrophobicContact CD1-CD2 3.83Å; F301-W382 HydrophobicContact CD1-CE3 4.13Å; F301-W382 AromaticContact CD1-CG 3.61Å; F301-W382 HydrophobicContact CD1-CG 3.61Å; F301-W382 HydrophobicContact CE1-CB 3.95Å; F301-W382 AromaticContact CE1-CD1 3.62Å; F301-W382 AromaticContact CE1-CD2 3.83Å; F301-W382 HydrophobicContact CE1-CD2 3.83Å; F301-W382 HydrophobicContact CE1-CE3 4.5Å; F301-W382 AromaticContact CE1-CG 3.54Å; F301-W382 HydrophobicContact CE1-CG 3.54Å; F301-W382 AromaticContact CE1-NE1 3.95Å; F301-W382 HydrophobicContact CG-CB 4.14Å; F301-W382 HydrophobicContact CZ-CG 4.42Å; W382-E384 PolarHBondContact O-N 2.93Å; W382-A385 PolarHBondContact O-N 3.26Å; W382-K386 HydrophobicContact CH2-CD 3.85Å; W382-K386 HydrophobicContact CZ3-CD 3.84Å; W382-K386 WeakPolarHBondContact O-CB 3.47Å; W382-K386 PolarHBondContact O-N 2.93Å
383	K	64.2	Low	58.5	Low	112 Å²	112	94.5 Å²	94.5	49%	0.487	46%	0.459	S	S	.	.	H	α-helix	trans	-59.8	-43.4	174.8	-171.4	173	-175.4	172.1	0	112.1	G302 S381 Q387	G302-K383 PolarHBondContact O-NZ 3.5Å; S381-K383 PolarHBondContact O-N 3.38Å; K383-Q387 WeakPolarHBondContact O-CG 3.28Å; K383-Q387 PolarHBondContact O-N 3.42Å
384	E	70.6	Confident	58.2	Low	42 Å²	42	97.1 Å²	97.1	20%	0.196	47%	0.472	C	S	.	.	H	α-helix	trans	-71.4	-40.7	176.8	-63.4	175.7	133.8	0	0	112	Q342 I380 S381 W382 K386 Q387 E388	Q342-E384 PolarHBondContact NE2-OE1 2.85Å; I380-E384 HydrophobicContact CD1-CB 4.07Å; I380-E384 HydrophobicContact CG1-CB 3.49Å; I380-E384 VanDerWaalsContact CG1-CB 3.49Å; S381-E384 WeakPolarHBondContact CB-OE2 3.38Å; S381-E384 PolarHBondContact N-OE2 3.12Å; S381-E384 WeakPolarHBondContact O-CB 3.22Å; S381-E384 PolarHBondContact O-N 2.78Å; W382-E384 PolarHBondContact O-N 2.93Å; E384-K386 VanDerWaalsContact C-N 3.31Å; E384-K386 PolarHBondContact O-N 3.11Å; E384-Q387 PolarHBondContact O-N 2.95Å; E384-E388 WeakPolarHBondContact O-CB 3.47Å; E384-E388 PolarHBondContact O-N 2.66Å
385	A	67.9	Low	57.5	Low	36 Å²	36	95.1 Å²	95.1	30%	0.298	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-39.3	176.4	0	0	0	0	0	111.7	I380 S381 W382 A389	I380-A385 HydrophobicContact CG2-CB 4.18Å; S381-A385 WeakPolarHBondContact O-CB 3.34Å; S381-A385 PolarHBondContact O-N 3.35Å; W382-A385 PolarHBondContact O-N 3.26Å; A385-A389 WeakPolarHBondContact O-CB 3.18Å; A385-A389 PolarHBondContact O-N 3.18Å
386	K	72.3	Confident	57	Low	101 Å²	101	91.2 Å²	91.2	44%	0.439	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-50	173.1	179.6	174.8	172.5	-178.7	0	111.4	W382 E384 E388 A389 E390	W382-K386 HydrophobicContact CH2-CD 3.85Å; W382-K386 HydrophobicContact CZ3-CD 3.84Å; W382-K386 WeakPolarHBondContact O-CB 3.47Å; W382-K386 PolarHBondContact O-N 2.93Å; E384-K386 VanDerWaalsContact C-N 3.31Å; E384-K386 PolarHBondContact O-N 3.11Å; K386-E388 VanDerWaalsContact C-N 3.3Å; K386-E388 PolarHBondContact O-N 3.44Å; K386-A389 WeakPolarHBondContact O-CA 3.45Å; K386-A389 WeakPolarHBondContact O-CB 3.45Å; K386-A389 PolarHBondContact O-N 3.36Å; K386-E390 WeakPolarHBondContact CE-OE1 3.32Å; K386-E390 WeakPolarHBondContact CG-OE1 3.44Å; K386-E390 WeakPolarHBondContact O-CG 3.28Å; K386-E390 PolarHBondContact O-N 3.28Å
387	Q	66	Low	56	Low	107 Å²	107	92 Å²	92	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-60.6	-37.4	175.6	-73.4	175.9	-1	0	0	112.4	K383 E384 A389 E390 M391	K383-Q387 WeakPolarHBondContact O-CG 3.28Å; K383-Q387 PolarHBondContact O-N 3.42Å; E384-Q387 PolarHBondContact O-N 2.95Å; Q387-A389 VanDerWaalsContact C-N 3.34Å; Q387-A389 PolarHBondContact O-N 3.1Å; Q387-E390 PolarHBondContact O-N 3.21Å; Q387-M391 VanDerWaalsContact O-CB 3.27Å; Q387-M391 WeakPolarHBondContact O-CB 3.28Å; Q387-M391 WeakPolarHBondContact O-CG 3.49Å; Q387-M391 PolarHBondContact O-N 3.19Å
388	E	68	Low	54.8	Low	65 Å²	65	92.8 Å²	92.8	30%	0.304	51%	0.506	S	S	.	.	H	α-helix	trans	-67.8	-32.2	174.4	-157.4	-158.2	-172.7	0	0	111.9	E384 K386 R392	E384-E388 WeakPolarHBondContact O-CB 3.47Å; E384-E388 PolarHBondContact O-N 2.66Å; K386-E388 VanDerWaalsContact C-N 3.3Å; K386-E388 PolarHBondContact O-N 3.44Å; E388-R392 WeakPolarHBondContact O-CB 3.49Å; E388-R392 WeakPolarHBondContact O-CD 3.32Å; E388-R392 WeakPolarHBondContact O-CG 3.45Å; E388-R392 PolarHBondContact O-N 3.09Å; E388-R392 VanDerWaalsContact O-N 3.12Å; E388-R392 IonicContact OE1-CZ 2.69Å; E388-R392 IonicContact OE1-NH1 3.57Å; E388-R392 IonicContact OE1-NH2 2.6Å; E388-R392 PolarHBondContact OE1-NH2 3.46Å; E388-R392 IonicContact OE2-CZ 3.56Å; E388-R392 IonicContact OE2-NH1 3.48Å; E388-R392 PolarHBondContact OE2-NH1 3.22Å; E388-R392 IonicContact OE2-NH2 3.27Å; E388-R392 PolarHBondContact OE2-NH2 3.25Å
389	A	65.2	Low	54.2	Low	41 Å²	41	90.7 Å²	90.7	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-73.2	-39.6	173.9	0	0	0	0	0	112.6	A385 K386 Q387 R392	A385-A389 WeakPolarHBondContact O-CB 3.18Å; A385-A389 PolarHBondContact O-N 3.18Å; K386-A389 WeakPolarHBondContact O-CA 3.45Å; K386-A389 WeakPolarHBondContact O-CB 3.45Å; K386-A389 PolarHBondContact O-N 3.36Å; Q387-A389 VanDerWaalsContact C-N 3.34Å; Q387-A389 PolarHBondContact O-N 3.1Å; A389-R392 WeakPolarHBondContact O-CB 3.33Å; A389-R392 PolarHBondContact O-N 3.1Å
390	E	69.4	Low	53.4	Low	113 Å²	113	94.7 Å²	94.7	53%	0.528	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-48.1	173.2	-70.7	166.1	179.4	0	0	110.5	K386 Q387 R392 G393	K386-E390 WeakPolarHBondContact CE-OE1 3.32Å; K386-E390 WeakPolarHBondContact CG-OE1 3.44Å; K386-E390 WeakPolarHBondContact O-CG 3.28Å; K386-E390 PolarHBondContact O-N 3.28Å; Q387-E390 PolarHBondContact O-N 3.21Å; E390-R392 PolarHBondContact O-N 3.1Å; E390-G393 PolarHBondContact O-N 3.31Å
391	M	53.5	Low	52.1	Low	171 Å²	171	101.3 Å²	101.3	84%	0.842	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-21.8	175.7	-73.6	-71.8	-75.6	0	0	114	Q387 G393	Q387-M391 VanDerWaalsContact O-CB 3.27Å; Q387-M391 WeakPolarHBondContact O-CB 3.28Å; Q387-M391 WeakPolarHBondContact O-CG 3.49Å; Q387-M391 PolarHBondContact O-N 3.19Å; M391-G393 PolarHBondContact O-N 2.67Å
392	R	56.1	Low	50.7	Low	128 Å²	128	109.6 Å²	109.6	48%	0.483	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-5.1	169.9	-81	170	-177.5	123.2	-1.1	113.6	E388 A389 E390	E388-R392 WeakPolarHBondContact O-CB 3.49Å; E388-R392 WeakPolarHBondContact O-CD 3.32Å; E388-R392 WeakPolarHBondContact O-CG 3.45Å; E388-R392 PolarHBondContact O-N 3.09Å; E388-R392 VanDerWaalsContact O-N 3.12Å; E388-R392 IonicContact OE1-CZ 2.69Å; E388-R392 IonicContact OE1-NH1 3.57Å; E388-R392 IonicContact OE1-NH2 2.6Å; E388-R392 PolarHBondContact OE1-NH2 3.46Å; E388-R392 IonicContact OE2-CZ 3.56Å; E388-R392 IonicContact OE2-NH1 3.48Å; E388-R392 PolarHBondContact OE2-NH1 3.22Å; E388-R392 IonicContact OE2-NH2 3.27Å; E388-R392 PolarHBondContact OE2-NH2 3.25Å; A389-R392 WeakPolarHBondContact O-CB 3.33Å; A389-R392 PolarHBondContact O-N 3.1Å; E390-R392 PolarHBondContact O-N 3.1Å
393	G	42.2	Very low	49.1	Very low	60 Å²	60	111.6 Å²	111.6	62%	0.619	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.3	21.6	176.3	0	0	0	0	0	114.3	E390 M391 A395	E390-G393 PolarHBondContact O-N 3.31Å; M391-G393 PolarHBondContact O-N 2.67Å; G393-A395 PolarHBondContact O-N 3.02Å
394	V	44.2	Very low	47.6	Very low	111 Å²	111	113.4 Å²	113.4	67%	0.673	64%	0.635	S	S	*	*			trans	-79.2	60	168.1	-168	0	0	0	0	108.8	T396	V394-T396 PolarHBondContact O-N 3.07Å; V394-T396 VanDerWaalsContact O-N 3.12Å
395	A	34.5	Very low	45.7	Very low	83 Å²	83	116.6 Å²	116.6	69%	0.686	66%	0.662	S	S	*	*			trans	-69.5	106.7	175.9	0	0	0	0	0	109	G393 T397	G393-A395 PolarHBondContact O-N 3.02Å; A395-T397 PolarHBondContact O-N 3.3Å
396	T	34.7	Very low	44	Very low	129 Å²	129	124.2 Å²	124.2	79%	0.791	69%	0.688	S	S	*	*			trans	-57.1	128.5	159.8	42.2	0	0	0	0	107.7	V394 S398	V394-T396 PolarHBondContact O-N 3.07Å; V394-T396 VanDerWaalsContact O-N 3.12Å; T396-S398 PolarHBondContact O-N 3.31Å
397	T	31.2	Very low	42	Very low	127 Å²	127	125.5 Å²	125.5	78%	0.779	71%	0.707	S	S	*	*			trans	-71.4	96.1	-166.5	47.3	0	0	0	0	111.6	A395 S399	A395-T397 PolarHBondContact O-N 3.3Å; T397-S399 PolarHBondContact O-N 3.04Å; T397-S399 VanDerWaalsContact O-N 3.08Å
398	S	29.3	Very low	40.4	Very low	124 Å²	124	128.5 Å²	128.5	87%	0.867	73%	0.726	S	S	*	*			trans	-70.3	94.2	163.1	59.2	0	0	0	0	109.2	T396	T396-S398 PolarHBondContact O-N 3.31Å
399	S	34.9	Very low	38.6	Very low	93 Å²	93	130.3 Å²	130.3	65%	0.65	75%	0.745	S	S	*	*			trans	-137.5	120.3	170.9	54	0	0	0	0	108.6	T397	T397-S399 PolarHBondContact O-N 3.04Å; T397-S399 VanDerWaalsContact O-N 3.08Å
400	D	30.4	Very low	37.1	Very low	164 Å²	164	134.5 Å²	134.5	88%	0.877	77%	0.769	S	S	*	*			trans	-60.4	131.6	-177.2	-47.8	-103.6	0	0	0	112.1
401	E	34.2	Very low	35.3	Very low	199 Å²	199	136.7 Å²	136.7	93%	0.93	78%	0.783	S	S	*	*			trans	-156.5	169.9	138.1	-124.1	175.9	-165.7	0	0	113.2
402	K	32.8	Very low	34.1	Very low	189 Å²	189	136.5 Å²	136.5	82%	0.822	78%	0.784	S	S	*	*			trans	-94	149.9	-161.5	-63.1	162.8	-177.6	163.9	0	112.7
403	N	29.1	Very low	33	Very low	148 Å²	148	138.1 Å²	138.1	79%	0.791	80%	0.803	S	S	*	*			trans	36.4	98.7	148.2	-62.2	-4.6	0	0	0	118.1
404	T	32.3	Very low	32.2	Very low	151 Å²	151	138.5 Å²	138.5	93%	0.926	81%	0.807	S	S	*	*				-169.9	162	118.8	17.8	0	0	0	0	111.7
405	S	30.8	Very low	31.7	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	82%	0.817	S	S	*	*			trans	-96.8	129.1	-169.8	45.9	0	0	0	0	114.1
406	K	33.6	Very low	31.4	Very low	196 Å²	196	141.5 Å²	141.5	85%	0.852	82%	0.822	S	S	*	*			trans	-178.5	139.6	140.4	-101.6	154.6	-172.4	175.6	0	111.5
407	P	30.1	Very low	31.3	Very low	129 Å²	129	141.9 Å²	141.9	84%	0.838	82%	0.819	S	S	*	*			trans	-77.3	143.6	169	32.5	-33.2	0	0	0	110.9
408	L	31.8	Very low	31.2	Very low	170 Å²	170	143.8 Å²	143.8	89%	0.89	82%	0.819	S	S	*	*			trans	-124.8	148.4	167.5	-79.7	170.1	0	0	0	109.4
409	S	31.2	Very low	31.3	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-77.2	154	-169.4	43.4	0	0	0	0	113.7
410	P	33.5	Very low	30.9	Very low	130 Å²	130	147.1 Å²	147.1	84%	0.844	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-68	134.6	172.9	-15.1	29.9	0	0	0	111.3
411	I	32	Very low	30.9	Very low	159 Å²	159	147.1 Å²	147.1	82%	0.815	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.8	128.1	171.4	-68.1	174.6	0	0	0	109.1
412	L	26.6	Very low	30.7	Very low	166 Å²	166	148 Å²	148	87%	0.869	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.7	132.6	175.1	-142.9	81.5	0	0	0	110.7
413	N	33.1	Very low	30.6	Very low	162 Å²	162	142.2 Å²	142.2	87%	0.866	80%	0.797	S	S	*	*			trans	-155	117.3	158.8	-114.7	-29.8	0	0	0	109.5
414	G	26.7	Very low	30.6	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	80%	0.796	S	S	*	*			trans	-101.3	159	-169	0	0	0	0	0	115.3
415	S	33.4	Very low	30.5	Very low	128 Å²	128	139.6 Å²	139.6	90%	0.895	79%	0.786	S	S	*	*			trans	-150.5	124.5	148	-75.4	0	0	0	0	107.4
416	T	28	Very low	30.5	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	78%	0.783	S	S	*	*			trans	-72.8	146.1	179.6	47.6	0	0	0	0	112.1
417	D	33.1	Very low	30.5	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	78%	0.78	S	S	*	*			trans	-155.6	147.9	143.2	-107.8	-33.5	0	0	0	110.3
418	H	28.1	Very low	30.6	Very low	167 Å²	167	142.1 Å²	142.1	77%	0.773	78%	0.782	S	S	*	*			trans	-85	132.1	-160.6	-65.1	-95.9	0	0	0	115.6
419	I	31.7	Very low	30.8	Very low	122 Å²	122	139.5 Å²	139.5	63%	0.626	78%	0.778	S	S	*	*			trans	-130.9	144.7	148.1	-61.7	-176.7	0	0	0	107	E421	I419-E421 PolarHBondContact O-N 3.36Å
420	L	27.3	Very low	31	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	79%	0.785	S	S	*	*			trans	-73	121.5	175.7	-90.1	64.3	0	0	0	109.9
421	E	29.5	Very low	30.9	Very low	164 Å²	164	140.4 Å²	140.4	77%	0.766	78%	0.777	S	S	*	*			trans	-93	143.3	151.8	-70.8	-179.4	176.6	0	0	108.9	I419 S423	I419-E421 PolarHBondContact O-N 3.36Å; E421-S423 VanDerWaalsContact C-N 3.25Å; E421-S423 VanDerWaalsContact CB-OG 3.22Å; E421-S423 WeakPolarHBondContact CB-OG 3.28Å; E421-S423 PolarHBondContact O-N 3.16Å; E421-S423 PolarHBondContact OE2-OG 3.22Å; E421-S423 VanDerWaalsContact OE2-OG 3.09Å
422	K	29.4	Very low	31.1	Very low	216 Å²	216	140.5 Å²	140.5	94%	0.939	78%	0.778	S	S	*	*			trans	-84.3	71.4	158.9	-88	-175.9	167.4	-175.2	0	108	T424	K422-T424 PolarHBondContact O-N 3.03Å; K422-T424 VanDerWaalsContact O-N 3.1Å
423	S	31.5	Very low	31.5	Very low	68 Å²	68	138.9 Å²	138.9	48%	0.476	78%	0.776	S	S	.	*			trans	-76.7	97.9	-178.9	-35.5	0	0	0	0	110.4	E421 T425	E421-S423 VanDerWaalsContact C-N 3.25Å; E421-S423 VanDerWaalsContact CB-OG 3.22Å; E421-S423 WeakPolarHBondContact CB-OG 3.28Å; E421-S423 PolarHBondContact O-N 3.16Å; E421-S423 PolarHBondContact OE2-OG 3.22Å; E421-S423 VanDerWaalsContact OE2-OG 3.09Å; S423-T425 PolarHBondContact O-N 2.89Å; S423-T425 PolarHBondContact O-OG1 2.89Å
424	T	28.8	Very low	31.5	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	77%	0.77	S	S	*	*			trans	-60.2	109.3	169.9	-51.5	0	0	0	0	108.5	K422 Y426	K422-T424 PolarHBondContact O-N 3.03Å; K422-T424 VanDerWaalsContact O-N 3.1Å; T424-Y426 PolarHBondContact O-N 3.46Å
425	T	29.6	Very low	31.9	Very low	119 Å²	119	138.6 Å²	138.6	73%	0.73	77%	0.772	S	S	*	*			trans	-96.8	96.4	-159.5	-54.9	0	0	0	0	112.2	S423	S423-T425 PolarHBondContact O-N 2.89Å; S423-T425 PolarHBondContact O-OG1 2.89Å
426	Y	32.6	Very low	32.1	Very low	175 Å²	175	141.7 Å²	141.7	69%	0.686	77%	0.77	S	S	*	*			trans	-75.5	129.4	164.7	-67.7	-84.2	0	0	0	110.6	T424 E428	T424-Y426 PolarHBondContact O-N 3.46Å; Y426-E428 PolarHBondContact O-N 3.16Å
427	P	32.4	Very low	32.5	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	77%	0.769	S	S	*	*			trans	-94.9	96.3	-173.6	34.7	-33.9	0	0	0	113.6
428	E	32.1	Very low	32.5	Very low	189 Å²	189	143 Å²	143	88%	0.883	78%	0.777	S	S	*	*			trans	-92.9	124.9	158	-79	-148.5	129.3	0	0	111.2	Y426	Y426-E428 PolarHBondContact O-N 3.16Å
429	S	36.6	Very low	32.7	Very low	115 Å²	115	145.3 Å²	145.3	80%	0.804	78%	0.779	S	S	*	*			trans	-108.3	111.7	-178.7	64	0	0	0	0	113
430	H	35.8	Very low	32.9	Very low	186 Å²	186	145.8 Å²	145.8	86%	0.861	78%	0.782	S	S	*	*			trans	-68.4	150.1	158.8	-42.9	-50.2	0	0	0	109.7
431	G	31.5	Very low	33.1	Very low	65 Å²	65	141.9 Å²	141.9	67%	0.67	77%	0.769	S	S	*	*			cis	143.4	118.2	-2.4	0	0	0	0	0	110.9
432	L	34.6	Very low	33.2	Very low	162 Å²	162	140.4 Å²	140.4	85%	0.848	77%	0.772	S	S	*	*			trans	-141.2	114.3	-178.9	-77.5	179.2	0	0	0	115.1
433	T	35.3	Very low	33.2	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	77%	0.767	S	S	*	*			trans	44.4	117.4	140.2	60	0	0	0	0	121.7
434	S	32.6	Very low	33.2	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	78%	0.781	S	S	*	*			trans	-85.3	168.9	159.4	-167.3	0	0	0	0	111.5	K436	S434-K436 PolarHBondContact OG-N 2.87Å
435	P	36.1	Very low	33.6	Very low	117 Å²	117	142.2 Å²	142.2	76%	0.76	78%	0.782	S	S	*	*				-151.6	125.6	96.1	36	-16.6	0	0	0	118.2
436	K	37	Very low	34	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	79%	0.787	S	S	*	*			trans	64.4	148.3	138.8	-64.5	-175.5	177.1	179.9	0	122.2	S434	S434-K436 PolarHBondContact OG-N 2.87Å
437	P	36.2	Very low	34.6	Very low	121 Å²	121	143 Å²	143	79%	0.786	79%	0.794	S	S	*	*			trans	-109.5	169.1	-177.7	42.3	-35.5	0	0	0	115.2
438	I	33.9	Very low	34.8	Very low	172 Å²	172	140.1 Å²	140.1	88%	0.882	79%	0.787	S	S	*	*			trans	-135.8	150.5	163.3	-59.2	-176.3	0	0	0	109
439	R	32.6	Very low	35.2	Very low	216 Å²	216	139.7 Å²	139.7	82%	0.815	78%	0.784	S	S	*	*			trans	-72.8	166.6	174.7	-60.9	176.4	172.7	164.2	-4.7	110.1
440	D	34.7	Very low	35.2	Very low	131 Å²	131	139 Å²	139	70%	0.701	78%	0.78	S	S	*	*				-173.4	155.5	53.2	-125.5	-53.3	0	0	0	115
441	S	31.8	Very low	35.4	Very low	85 Å²	85	134.4 Å²	134.4	59%	0.594	77%	0.769	S	S	*	*			trans	40.5	109.8	139.7	-67.1	0	0	0	0	124.3
442	T	31.4	Very low	35.7	Very low	133 Å²	133	140.8 Å²	140.8	82%	0.816	78%	0.778	S	S	*	*				86.5	137.2	123.4	68.3	0	0	0	0	124.2
443	R	30.9	Very low	35.8	Very low	225 Å²	225	138 Å²	138	85%	0.849	77%	0.772	S	S	*	*			trans	98.8	100.7	132.3	-155.8	179.6	-175.6	-155	0.1	121.8
444	S	31.5	Very low	36	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	77%	0.766	S	S	*	*			trans	65.1	158.6	148.9	72.9	0	0	0	0	118.2
445	S	37.1	Very low	36.5	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	77%	0.769	S	S	*	*			cis	-151.9	155.2	17	53.4	0	0	0	0	114.8
446	H	37.6	Very low	36.7	Very low	182 Å²	182	138.4 Å²	138.4	84%	0.843	77%	0.766	S	S	*	*			trans	-73.7	-175	164.6	-71.4	-64.4	0	0	0	113.2
447	P	45.6	Very low	37	Very low	128 Å²	128	134.8 Å²	134.8	83%	0.831	76%	0.763	S	S	*	*			cis	-132.1	-171.8	-23.6	24.2	-0.6	0	0	0	113.9
448	G	36.6	Very low	37.3	Very low	61 Å²	61	136 Å²	136	63%	0.629	77%	0.767	S	S	*	*			trans	-175.5	110.4	158.1	0	0	0	0	0	118.3
449	H	40.2	Very low	37.4	Very low	180 Å²	180	132.6 Å²	132.6	83%	0.833	76%	0.759	S	S	*	*			trans	43.9	107.8	142	-57.8	-69.8	0	0	0	120.8
450	S	36.3	Very low	37.6	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	76%	0.758	S	S	*	*				74.9	140.8	78.8	75.7	0	0	0	0	115.3
451	S	39.1	Very low	38.2	Very low	90 Å²	90	127.4 Å²	127.4	63%	0.629	76%	0.763	S	S	*	*			cis	-165.3	157.4	26.9	-37.6	0	0	0	0	114.4
452	K	37.8	Very low	38.1	Very low	198 Å²	198	130.6 Å²	130.6	86%	0.861	77%	0.772	S	S	*	*			trans	65.5	153	151.3	-66.7	167	-175.7	177.3	0	117.2
453	S	38.4	Very low	38.5	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	77%	0.774	S	S	*	*			cis	-176.3	164.5	-3.7	39.6	0	0	0	0	109.4
454	S	38.5	Very low	38.4	Very low	98 Å²	98	127.5 Å²	127.5	69%	0.685	77%	0.771	S	S	*	*			cis	179.4	164.5	-19.2	-80.4	0	0	0	0	109.9
455	I	42.4	Very low	38.7	Very low	159 Å²	159	125.7 Å²	125.7	82%	0.815	77%	0.769	S	S	*	*			trans	72.7	141.9	148.7	-76.7	156.7	0	0	0	119.3
456	P	41.2	Very low	38.5	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	77%	0.771	S	S	*	*			cis	-138.8	-179	-28	41	-22.4	0	0	0	115.6
457	P	43	Very low	38.2	Very low	118 Å²	118	125 Å²	125	77%	0.766	77%	0.767	S	S	*	*			trans	-107.5	175.3	164.8	39.8	-32.5	0	0	0	114.3
458	V	43	Very low	37.8	Very low	146 Å²	146	124 Å²	124	89%	0.885	76%	0.759	S	S	*	*			trans	-138.7	153.2	175.4	-178.5	0	0	0	0	110.8
459	S	36.7	Very low	37.9	Very low	100 Å²	100	128 Å²	128	70%	0.699	76%	0.761	S	S	*	*			trans	-142.4	169.8	-166.1	-46.8	0	0	0	0	114.4
460	S	36.4	Very low	37.8	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	76%	0.76	S	S	*	*			trans	76.6	164	150.3	-68.5	0	0	0	0	117.1
461	P	46.2	Very low	37.6	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	76%	0.759	S	S	*	*			cis	-133.4	179.2	20.4	43.1	-25.5	0	0	0	118.9
462	I	31.1	Very low	37.3	Very low	152 Å²	152	128 Å²	128	78%	0.779	77%	0.772	S	S	*	*			trans	-103.5	152.7	177	-66.6	161.3	0	0	0	109.7
463	L	38.4	Very low	37.2	Very low	166 Å²	166	123.6 Å²	123.6	87%	0.869	77%	0.766	S	S	*	*			trans	-141.7	153.6	159	-121.9	167.1	0	0	0	111.2
464	T	30.3	Very low	36.9	Very low	128 Å²	128	129.9 Å²	129.9	79%	0.785	77%	0.774	S	S	*	*			trans	-112.3	153.3	-162.3	42.8	0	0	0	0	113.7
465	G	35.9	Very low	36.7	Very low	71 Å²	71	130.9 Å²	130.9	73%	0.732	78%	0.781	S	S	*	*			trans	-167.1	58.8	-173.1	0	0	0	0	0	118.7
466	V	33.9	Very low	36.3	Very low	136 Å²	136	126.3 Å²	126.3	82%	0.824	77%	0.773	S	S	*	*			trans	45.9	107.3	141.8	-173.8	0	0	0	0	120.7
467	L	31.7	Very low	36	Very low	144 Å²	144	131.3 Å²	131.3	75%	0.754	78%	0.784	S	S	*	*			trans	54.6	130.1	134.1	-115.4	69.5	0	0	0	120.7
468	T	36.3	Very low	35.4	Very low	107 Å²	107	131.4 Å²	131.4	66%	0.656	78%	0.782	S	S	*	*				-172.2	149.2	69.1	28.8	0	0	0	0	114
469	H	38.4	Very low	35.1	Very low	144 Å²	144	133.1 Å²	133.1	67%	0.667	78%	0.781	S	S	*	*			trans	37	143.9	144.9	-60.3	-66	0	0	0	122.2
470	H	38.1	Very low	35	Very low	175 Å²	175	135.8 Å²	135.8	81%	0.81	78%	0.782	S	S	*	*			cis	-160.2	163.1	-4.9	-97.2	-62.8	0	0	0	105.7
471	G	33.2	Very low	34.7	Very low	68 Å²	68	136 Å²	136	70%	0.701	77%	0.774	S	S	*	*			cis	158.1	119.8	-2.3	0	0	0	0	0	110.8
472	S	32.5	Very low	34.2	Very low	128 Å²	128	136.3 Å²	136.3	90%	0.895	77%	0.769	S	S	*	*			trans	-127.8	143.4	179.6	-54.4	0	0	0	0	110.3
473	S	35.3	Very low	34.1	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.768	S	S	*	*			trans	-159.8	165.6	178.7	-145.7	0	0	0	0	115.9
474	W	32.8	Very low	33.7	Very low	237 Å²	237	133.2 Å²	133.2	90%	0.898	76%	0.764	S	S	*	*			trans	80.3	105.5	178.4	-57.7	3.2	0	0	0	113.2
475	S	34	Very low	33.8	Very low	118 Å²	118	133.5 Å²	133.5	83%	0.825	77%	0.766	S	S	*	*			cis	64.2	127.3	30.9	-159.9	0	0	0	0	113.8
476	G	33.9	Very low	33.4	Very low	63 Å²	63	138.8 Å²	138.8	65%	0.649	77%	0.771	S	S	*	*			cis	143.9	159.5	-4.1	0	0	0	0	0	112.8
477	K	35.6	Very low	33.5	Very low	213 Å²	213	139.2 Å²	139.2	93%	0.926	77%	0.774	S	S	*	*			trans	-177	153.2	149.5	-109.1	171.7	-179.1	-177	0	111.8
478	V	28.8	Very low	33.3	Very low	120 Å²	120	140.3 Å²	140.3	73%	0.727	78%	0.781	S	S	*	*			trans	-128.1	144.1	176.3	172.1	0	0	0	0	107.9
479	Q	37.9	Very low	33.1	Very low	182 Å²	182	139 Å²	139	85%	0.85	79%	0.788	S	S	*	*			trans	-145.1	135.1	152.9	-151	73.6	53.9	0	0	109.6
480	Q	34	Very low	32.7	Very low	155 Å²	155	137.2 Å²	137.2	72%	0.724	79%	0.792	S	S	*	*			trans	-76.5	167.7	175.4	-72.6	169.4	-59.5	0	0	110.5
481	N	31.3	Very low	32.3	Very low	121 Å²	121	134.6 Å²	134.6	65%	0.647	79%	0.788	S	S	*	*			cis	-164	-170.4	10.3	-137.4	40.3	0	0	0	112.2
482	D	34.7	Very low	32.3	Very low	128 Å²	128	140.1 Å²	140.1	68%	0.684	80%	0.796	S	S	*	*			trans	83.9	101.4	147.2	-61.4	-22.3	0	0	0	123.1
483	T	29.9	Very low	32.3	Very low	124 Å²	124	139.4 Å²	139.4	76%	0.761	79%	0.791	S	S	*	*			trans	57.9	113.2	135.4	44.5	0	0	0	0	124.1
484	V	29.7	Very low	32.4	Very low	130 Å²	130	140.4 Å²	140.4	79%	0.788	80%	0.795	S	S	*	*				53.7	117.6	120.6	-178.4	0	0	0	0	119.7
485	T	32.3	Very low	32.3	Very low	134 Å²	134	136.8 Å²	136.8	82%	0.822	79%	0.794	S	S	*	*				-169.5	146.5	107.7	-62.6	0	0	0	0	109.9
486	E	26.8	Very low	32.5	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	80%	0.799	S	S	*	*			trans	-79	144	178	-48.4	169.8	127.5	0	0	113
487	V	35.5	Very low	32.3	Very low	145 Å²	145	147.3 Å²	147.3	88%	0.879	81%	0.808	S	S	*	*			trans	-153.9	148.4	136.3	-141.7	0	0	0	0	111.1
488	N	28.6	Very low	32.3	Very low	167 Å²	167	143.7 Å²	143.7	89%	0.893	80%	0.799	S	S	*	*			trans	-72.4	149.3	177.5	-63	-68.3	0	0	0	113.5
489	G	32.2	Very low	32.4	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	80%	0.804	S	S	*	*			trans	-170.9	97	175.7	0	0	0	0	0	115.1
490	S	28.9	Very low	32.4	Very low	108 Å²	108	141 Å²	141	76%	0.755	81%	0.805	S	S	*	*			trans	-68.7	168.2	-170.5	-47.8	0	0	0	0	117.6
491	T	29.8	Very low	32.4	Very low	119 Å²	119	144.3 Å²	144.3	73%	0.73	81%	0.811	S	S	*	*			trans	84.2	124.7	144.6	35.9	0	0	0	0	123.4
492	Q	32.9	Very low	32.6	Very low	184 Å²	184	146.9 Å²	146.9	86%	0.86	82%	0.821	S	S	*	*			trans	81.1	130.9	141.3	-67	175	27	0	0	121.1
493	S	32.8	Very low	32.7	Very low	114 Å²	114	149.1 Å²	149.1	80%	0.797	83%	0.825	S	S	*	*			trans	-78	166	171.5	-38.6	0	0	0	0	112.2
494	P	38	Very low	33.2	Very low	126 Å²	126	148.6 Å²	148.6	82%	0.818	82%	0.818	S	S	*	*				-145.1	168.6	105.4	38.1	-24.4	0	0	0	115.8
495	N	31.1	Very low	33.5	Very low	162 Å²	162	150.5 Å²	150.5	87%	0.866	82%	0.815	S	S	*	*			trans	-69.2	145.5	173.3	-71.8	-75.7	0	0	0	113.1
496	L	37.6	Very low	33.8	Very low	180 Å²	180	149.8 Å²	149.8	94%	0.942	81%	0.81	S	S	*	*			trans	-136.1	162	157.6	-86.3	178.2	0	0	0	112
497	R	31	Very low	34.1	Very low	222 Å²	222	148.2 Å²	148.2	84%	0.838	81%	0.808	S	S	*	*			trans	-140	160.9	-163.4	-155.1	-170.4	-161.5	-164.5	7.8	110.9
498	N	33.8	Very low	33.9	Very low	137 Å²	137	148.6 Å²	148.6	73%	0.733	80%	0.804	S	S	*	*			trans	105.4	103.5	159.1	-52.4	-27.2	0	0	0	118.9
499	S	31.8	Very low	34.6	Very low	119 Å²	119	145.3 Å²	145.3	83%	0.832	79%	0.792	S	S	*	*				44.2	125.4	112.1	177.3	0	0	0	0	121.6
500	S	37.1	Very low	34.7	Very low	126 Å²	126	151.6 Å²	151.6	88%	0.881	79%	0.791	S	S	*	*			trans	-146.9	175	145.2	79	0	0	0	0	112.1
501	R	33.7	Very low	35.2	Very low	225 Å²	225	155.5 Å²	155.5	85%	0.849	79%	0.789	S	S	*	*			trans	-159.2	135.9	-154.3	169.9	-165.5	176.3	-158.8	3.4	115.1
502	M	36.6	Very low	35.6	Very low	175 Å²	175	156 Å²	156	86%	0.862	79%	0.788	S	S	*	*			trans	-147.1	128.3	157.4	-74.2	-153.4	175.5	0	0	109.1
503	K	37.5	Very low	35.8	Very low	174 Å²	174	153.6 Å²	153.6	76%	0.757	78%	0.781	S	S	*	*				66.6	127	78.4	-71.3	-170.2	175.7	-177.1	0	112.5
504	D	38.9	Very low	36.1	Very low	114 Å²	114	153.1 Å²	153.1	61%	0.61	77%	0.773	S	S	*	*			cis	-151.5	-165.1	19.6	-112.6	13.2	0	0	0	109.4
505	K	37.3	Very low	36	Very low	169 Å²	169	155.2 Å²	155.2	74%	0.735	77%	0.772	S	S	*	*			cis	-162.9	160.1	9.3	-130.7	162.4	-168.3	81.9	0	111.5
506	V	37	Very low	36.3	Very low	119 Å²	119	151.4 Å²	151.4	72%	0.721	76%	0.758	S	S	*	*			trans	27	121.1	146.3	175.8	0	0	0	0	119.9
507	N	34.6	Very low	36.3	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	75%	0.748	S	S	*	*				-164.8	173.8	70	-139	-17.7	0	0	0	115.2
508	L	31.7	Very low	36.7	Very low	154 Å²	154	145.2 Å²	145.2	81%	0.806	75%	0.746	S	S	*	*			trans	-131.4	-172.6	-178.3	-111.8	91.8	0	0	0	110.8
509	P	42.5	Very low	36.9	Very low	97 Å²	97	145.2 Å²	145.2	63%	0.63	75%	0.746	S	S	*	*			cis	-149.9	176	19.6	45	-24.3	0	0	0	120.8
510	R	35	Very low	37.2	Very low	211 Å²	211	145.5 Å²	145.5	80%	0.796	74%	0.738	S	S	*	*			trans	67.6	153.2	142.6	-83.4	173.4	-176.2	-159.1	2.9	120.9
511	R	37.7	Very low	37.3	Very low	191 Å²	191	145.8 Å²	145.8	72%	0.721	73%	0.73	S	S	*	*			cis	-170.1	167.8	-17.5	-140.9	-175.9	179.9	-179.5	-1.3	111.5
512	N	38.1	Very low	37.7	Very low	130 Å²	130	140.2 Å²	140.2	70%	0.695	73%	0.725	S	S	*	*			trans	75.3	151.8	155.2	-67.9	1.9	0	0	0	120.7
513	N	38.6	Very low	37.8	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	72%	0.719	S	S	*	*			cis	-169.1	173.4	-26.5	-162.8	16.3	0	0	0	112.5
514	T	37.4	Very low	38.1	Very low	103 Å²	103	133 Å²	133	63%	0.632	72%	0.722	S	S	*	*			trans	67.6	152.1	161.2	63.5	0	0	0	0	119.9
515	Q	36.9	Very low	38.2	Very low	170 Å²	170	136 Å²	136	79%	0.794	74%	0.736	S	S	*	*			cis	-174.5	170.9	-17.4	-104.3	172.5	-74.7	0	0	107.1
516	S	36.6	Very low	38.2	Very low	82 Å²	82	131 Å²	131	57%	0.573	73%	0.733	S	S	*	*			cis	-173.2	-178.9	-33.3	52.1	0	0	0	0	110.3
517	T	37.7	Very low	38.2	Very low	120 Å²	120	131.9 Å²	131.9	74%	0.736	74%	0.738	S	S	*	*			trans	75.1	119.6	175.8	68.1	0	0	0	0	116.1
518	L	40.5	Very low	38.3	Very low	152 Å²	152	130.7 Å²	130.7	80%	0.796	74%	0.736	S	S	*	*				85.3	146.4	55	-67	168.3	0	0	0	112.6
519	N	37.3	Very low	38.4	Very low	138 Å²	138	128.5 Å²	128.5	74%	0.738	73%	0.733	S	S	*	*			cis	-147.5	-162.6	26.4	-130.6	3.3	0	0	0	113.9
520	N	38.9	Very low	38.4	Very low	125 Å²	125	129.7 Å²	129.7	67%	0.668	74%	0.741	S	S	*	*			trans	-82.6	-168.9	-174.3	-37.1	-15.3	0	0	0	115.2
521	D	39.2	Very low	38.4	Very low	131 Å²	131	125 Å²	125	70%	0.701	74%	0.74	S	S	*	*			cis	-167.9	177.5	11.1	-124.5	-47.5	0	0	0	108.1
522	S	41	Very low	38.6	Very low	108 Å²	108	121.2 Å²	121.2	76%	0.755	74%	0.741	S	S	*	*			cis	-166.7	173.3	-9.5	-142	0	0	0	0	112.5
523	G	38.2	Very low	38.5	Very low	70 Å²	70	121.7 Å²	121.7	72%	0.722	75%	0.748	S	S	*	*			trans	74.7	120.6	143.1	0	0	0	0	0	124.1
524	P	45.9	Very low	38.4	Very low	127 Å²	127	119.7 Å²	119.7	83%	0.825	75%	0.75	S	S	*	*			trans	-129.4	144	173.2	38.8	-25	0	0	0	117.4
525	I	40	Very low	38.4	Very low	178 Å²	178	119 Å²	119	91%	0.913	75%	0.754	S	S	*	*			trans	-146.2	120.5	169	-60	-177.2	0	0	0	114
526	G	37.1	Very low	38.4	Very low	64 Å²	64	118.7 Å²	118.7	66%	0.66	75%	0.753	S	S	*	*				75.2	113.9	123	0	0	0	0	0	125.6
527	V	37	Very low	38.4	Very low	137 Å²	137	124.8 Å²	124.8	83%	0.83	76%	0.763	S	S	*	*				76.6	103.1	127.7	-175.3	0	0	0	0	122
528	V	37.8	Very low	38.4	Very low	123 Å²	123	125.4 Å²	125.4	75%	0.745	77%	0.767	S	S	*	*			trans	65.7	112.1	136.9	-177.6	0	0	0	0	122.2
529	S	33.2	Very low	38.3	Very low	108 Å²	108	122.7 Å²	122.7	76%	0.755	76%	0.761	S	S	*	*				28.8	156.1	130	-44.3	0	0	0	0	123.5
530	P	43	Very low	38.5	Very low	123 Å²	123	123.6 Å²	123.6	80%	0.799	76%	0.76	S	S	*	*			cis	-135.7	-179.1	9.2	40.5	-21.1	0	0	0	117.5
531	S	33.2	Very low	38.5	Very low	111 Å²	111	122.5 Å²	122.5	78%	0.776	75%	0.754	S	S	*	*			trans	-35.3	157.3	163.6	-62.3	0	0	0	0	117
532	P	42.9	Very low	38.5	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	76%	0.755	S	S	*	*			cis	-156	164.3	47.3	43.2	-21.8	0	0	0	122.2
533	V	37.1	Very low	38.3	Very low	139 Å²	139	127.5 Å²	127.5	84%	0.842	76%	0.759	S	S	*	*			trans	73.4	142.4	143.1	162.2	0	0	0	0	121.5
534	A	36	Very low	38.1	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	77%	0.767	S	S	*	*			trans	95.8	96.7	160.1	0	0	0	0	0	121.1
535	A	36.1	Very low	37.7	Very low	88 Å²	88	135.4 Å²	135.4	73%	0.727	76%	0.759	S	S	*	*			trans	83.4	145.4	131.3	0	0	0	0	0	122.9
536	H	36.9	Very low	37.6	Very low	164 Å²	164	133 Å²	133	76%	0.759	75%	0.752	S	S	*	*			trans	78.4	105.8	160.3	-67.2	-49.9	0	0	0	122.6
537	R	36.4	Very low	37.5	Very low	210 Å²	210	140.2 Å²	140.2	79%	0.792	76%	0.759	S	S	*	*				92.3	118.9	126.1	-71.1	-178.4	-179.8	-150.5	-0.1	120.6
538	T	38.9	Very low	37.5	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	76%	0.759	S	S	*	*			trans	79.2	129.1	134.3	51.1	0	0	0	0	122.4
539	S	37.4	Very low	37.7	Very low	95 Å²	95	139.8 Å²	139.8	66%	0.664	76%	0.759	S	S	*	*			trans	97.4	99.2	138.4	-164.7	0	0	0	0	119.9
540	H	42.7	Very low	37.7	Very low	158 Å²	158	140.5 Å²	140.5	73%	0.731	76%	0.764	S	S	*	*				55.6	144	129.8	-63.2	-70.9	0	0	0	120.9
541	D	37.9	Very low	37.4	Very low	101 Å²	101	138 Å²	138	54%	0.54	76%	0.761	S	S	.	*			cis	-153.9	135.2	10	-131.8	4.4	0	0	0	116
542	K	39.4	Very low	37.7	Very low	166 Å²	166	138.9 Å²	138.9	72%	0.722	76%	0.764	S	S	*	*			trans	49.7	108.1	142.6	-67.7	161.8	-164.7	130.5	0	121.9
543	E	36.8	Very low	37.2	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	77%	0.766	S	S	*	*			trans	-68.4	152.3	145.3	-61.8	178.8	122.5	0	0	111.8	I545	E543-I545 PolarHBondContact O-N 3.3Å
544	R	34.2	Very low	37.1	Very low	237 Å²	237	141.4 Å²	141.4	89%	0.894	77%	0.765	S	S	*	*			trans	-95.8	88.5	175.9	-175.8	-175.9	-73	-138.3	-1.2	111.3	V546	R544-V546 PolarHBondContact O-N 3.39Å
545	I	38.3	Very low	37	Very low	127 Å²	127	143.7 Å²	143.7	65%	0.651	77%	0.765	S	S	*	*			trans	-75.9	120.6	168.3	-59.2	176.2	0	0	0	109.1	E543 R547	E543-I545 PolarHBondContact O-N 3.3Å; I545-R547 HydrophobicContact CG2-CG 4.26Å
546	V	37.1	Very low	37.1	Very low	126 Å²	126	145.6 Å²	145.6	76%	0.764	77%	0.77	S	S	*	*			trans	-78.7	123.6	168.6	-179.9	0	0	0	0	108.6	R544	R544-V546 PolarHBondContact O-N 3.39Å
547	R	35.8	Very low	37.1	Very low	217 Å²	217	146.6 Å²	146.6	82%	0.819	78%	0.775	S	S	*	*			trans	-122.1	132.9	166.9	-78.5	-175.5	175.7	164	-1.2	109.3	I545	I545-R547 HydrophobicContact CG2-CG 4.26Å
548	V	35.6	Very low	37.1	Very low	135 Å²	135	144.5 Å²	144.5	82%	0.818	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-73.8	129.2	173.4	-177.5	0	0	0	0	109.3
549	P	42.3	Very low	36.9	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-95.5	125	165.5	33.7	-26.5	0	0	0	110.5	G551	P549-G551 PolarHBondContact O-N 3.34Å
550	S	34.3	Very low	37	Very low	123 Å²	123	143.6 Å²	143.6	86%	0.86	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-68	124.1	169.4	-49.5	0	0	0	0	110.4
551	G	36.5	Very low	36.5	Very low	72 Å²	72	141.6 Å²	141.6	74%	0.742	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-86.8	143.6	173.1	0	0	0	0	0	112.2	P549	P549-G551 PolarHBondContact O-N 3.34Å
552	P	39.1	Very low	36.4	Very low	128 Å²	128	144.5 Å²	144.5	83%	0.831	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-90.3	160.3	174.1	36.4	-34.4	0	0	0	113
553	V	33.4	Very low	36	Very low	130 Å²	130	142.8 Å²	142.8	79%	0.788	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.5	146.6	-179.1	177.2	0	0	0	0	113.2
554	Q	34.8	Very low	36	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	81%	0.807	S	S	*	*			trans	-133.5	143.9	157.4	-61.2	179.5	-33.8	0	0	105.4
555	N	32.5	Very low	35.9	Very low	140 Å²	140	146 Å²	146	75%	0.749	81%	0.807	S	S	*	*			cis	-117.1	-175.9	13.3	-58.4	-59	0	0	0	111.7
556	P	39.4	Very low	35.9	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	81%	0.814	S	S	*	*				-144.7	153.2	85.3	37.9	-22.3	0	0	0	115.8
557	E	37.1	Very low	36	Very low	184 Å²	184	149.1 Å²	149.1	86%	0.86	82%	0.821	S	S	*	*			trans	-128.8	106.8	164.2	-74.1	-164.6	148.1	0	0	111.4
558	N	35.5	Very low	35.8	Very low	167 Å²	167	147.8 Å²	147.8	89%	0.893	83%	0.825	S	S	*	*				-165.4	154.8	128.9	-113.2	-52.8	0	0	0	111.1
559	V	35.5	Very low	35.7	Very low	128 Å²	128	148.3 Å²	148.3	78%	0.776	83%	0.828	S	S	*	*			trans	-127.9	129.1	-164.5	-177.9	0	0	0	0	111.7
560	G	38.3	Very low	35.1	Very low	81 Å²	81	151 Å²	151	84%	0.835	83%	0.831	S	S	*	*			trans	-138.8	62.8	-178.7	0	0	0	0	0	113
561	T	32.4	Very low	35.2	Very low	115 Å²	115	156.2 Å²	156.2	71%	0.706	83%	0.833	S	S	*	*			trans	-68.8	133.9	-174.7	-48.9	0	0	0	0	113.6
562	L	35.4	Very low	35.1	Very low	162 Å²	162	156 Å²	156	85%	0.848	83%	0.831	S	S	*	*			trans	-165.2	131.2	138.5	-108.6	166.8	0	0	0	111.9
563	T	31.5	Very low	35.1	Very low	130 Å²	130	154.9 Å²	154.9	80%	0.798	83%	0.826	S	S	*	*			trans	-140.9	139.2	178.4	-46.5	0	0	0	0	109.9
564	R	38	Very low	35.3	Very low	242 Å²	242	158.1 Å²	158.1	91%	0.913	83%	0.829	S	S	*	*			trans	-134.3	153	165.8	-91.2	-169	170.3	-127	-0.9	112.1
565	R	31.5	Very low	35.4	Very low	241 Å²	241	155 Å²	155	91%	0.909	83%	0.827	S	S	*	*			trans	-74.7	154.6	-163.3	-65.6	171.7	169.3	173.4	-6.9	114.3
566	P	37.5	Very low	35.8	Very low	121 Å²	121	154.4 Å²	154.4	79%	0.786	83%	0.831	S	S	*	*			trans	-81.8	172.8	161.8	36.9	-36.1	0	0	0	112.5
567	Q	39.3	Very low	35.9	Very low	197 Å²	197	153.9 Å²	153.9	92%	0.921	83%	0.828	S	S	*	*			trans	-132.4	162.5	158.3	-74	-170	-8.9	0	0	109.6
568	Q	31.8	Very low	36	Very low	190 Å²	190	153.1 Å²	153.1	89%	0.888	83%	0.827	S	S	*	*			trans	-106.4	146.9	-175.2	-59.3	163.4	-45.8	0	0	111.2
569	T	34	Very low	36	Very low	146 Å²	146	150.1 Å²	150.1	90%	0.896	82%	0.82	S	S	*	*			trans	-154.5	141.9	145.2	39.1	0	0	0	0	109.7
570	E	30.2	Very low	35.9	Very low	171 Å²	171	149.5 Å²	149.5	80%	0.799	82%	0.821	S	S	*	*			trans	-83.4	164	174.2	-59.5	165.8	109.9	0	0	111.9
571	Y	36.4	Very low	36.3	Very low	233 Å²	233	152 Å²	152	91%	0.914	82%	0.822	S	S	*	*				160.9	139.1	128.6	-94.2	-72.9	0	0	0	108.8
572	G	33.8	Very low	36.4	Very low	67 Å²	67	153.5 Å²	153.5	69%	0.691	83%	0.826	S	S	*	*			trans	-145.7	168.1	-179.6	0	0	0	0	0	113.4
573	S	38.2	Very low	36.8	Very low	104 Å²	104	153.7 Å²	153.7	73%	0.727	83%	0.827	S	S	*	*			trans	-172.8	125.6	162.2	-90.3	0	0	0	0	114.9
574	K	37.5	Very low	36.9	Very low	198 Å²	198	152.1 Å²	152.1	86%	0.861	82%	0.822	S	S	*	*			trans	67.5	132.6	135.3	-58.9	175.8	-176.5	178	0	121.2
575	S	36.7	Very low	37.1	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	82%	0.816	S	S	*	*			trans	-79.1	177.6	172.7	-32	0	0	0	0	113.5
576	P	41.9	Very low	37.4	Very low	127 Å²	127	144.1 Å²	144.1	83%	0.825	82%	0.815	S	S	*	*				-145	165.7	100.1	39.5	-25.9	0	0	0	115.9
577	P	40.5	Very low	37.4	Very low	117 Å²	117	146.2 Å²	146.2	76%	0.76	81%	0.814	S	S	*	*			trans	-108.7	160	177.6	40.2	-33.3	0	0	0	115.1
578	I	39.3	Very low	37.3	Very low	167 Å²	167	144.9 Å²	144.9	86%	0.856	81%	0.808	S	S	*	*			trans	-175.2	151.7	166	-108	153.6	0	0	0	108.3
579	S	37.4	Very low	37.4	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	80%	0.8	S	S	*	*			cis	-167.1	154.3	-31	-91.3	0	0	0	0	109.1
580	S	33	Very low	37.5	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	80%	0.801	S	S	*	*			trans	-75.3	166.6	175	-44.2	0	0	0	0	113.5
581	P	46.5	Very low	37.6	Very low	132 Å²	132	139.9 Å²	139.9	86%	0.857	80%	0.8	S	S	*	*				-136.6	168.1	116.1	39.3	-30.2	0	0	0	115.5
582	D	34.2	Very low	37.6	Very low	148 Å²	148	134.8 Å²	134.8	79%	0.791	80%	0.795	S	S	*	*			trans	-86.6	158.3	-178.9	176.1	28.6	0	0	0	113
583	L	42.9	Very low	37.8	Very low	166 Å²	166	140 Å²	140	87%	0.869	80%	0.801	S	S	*	*			trans	-165.9	134.4	155.3	-110.6	175.8	0	0	0	112.6
584	S	35.1	Very low	37.6	Very low	97 Å²	97	141.7 Å²	141.7	68%	0.678	80%	0.801	S	S	*	*			trans	-101.1	162	-169.9	58	0	0	0	0	114.9
585	P	40.8	Very low	37.5	Very low	123 Å²	123	141.9 Å²	141.9	80%	0.799	80%	0.797	S	S	*	*			trans	-90.2	160.1	-166.7	35.9	-37.3	0	0	0	115.8
586	Q	39.1	Very low	37.5	Very low	191 Å²	191	145.1 Å²	145.1	89%	0.893	80%	0.799	S	S	*	*			trans	-141.5	161.8	163.8	-71.5	-162.7	-8.3	0	0	112.4
587	H	36.4	Very low	37.2	Very low	165 Å²	165	143 Å²	143	76%	0.764	79%	0.793	S	S	*	*			trans	-71.6	159.6	-175.8	-69.8	-121.2	0	0	0	113.3
588	H	38.4	Very low	36.9	Very low	169 Å²	169	147.1 Å²	147.1	78%	0.782	80%	0.799	S	S	*	*				165.4	106	108.2	-83.1	-63.7	0	0	0	114
589	T	32.2	Very low	36.6	Very low	117 Å²	117	144.6 Å²	144.6	72%	0.718	80%	0.796	S	S	*	*			trans	15.9	123.7	140.2	55.1	0	0	0	0	120.5
590	L	36.8	Very low	36.5	Very low	175 Å²	175	151.6 Å²	151.6	92%	0.916	81%	0.807	S	S	*	*				179.3	169.2	109.3	-93.8	168.7	0	0	0	113.5
591	S	32.1	Very low	36.4	Very low	111 Å²	111	152.3 Å²	152.3	78%	0.776	81%	0.806	S	S	*	*			trans	-91.3	162.8	-163	-52.1	0	0	0	0	116.3
592	P	37.9	Very low	36	Very low	125 Å²	125	154.1 Å²	154.1	81%	0.812	81%	0.807	S	S	*	*			trans	-95.1	163.7	-170.1	37.6	-37.1	0	0	0	115.7
593	Q	36.3	Very low	36	Very low	178 Å²	178	152.3 Å²	152.3	83%	0.832	81%	0.806	S	S	*	*			trans	-147.8	120.9	169.3	-79.5	-159.6	1.5	0	0	116.1
594	L	35.5	Very low	35.7	Very low	138 Å²	138	147.8 Å²	147.8	72%	0.723	80%	0.799	S	S	*	*			trans	61	145.7	131.1	-100.1	76.2	0	0	0	124.6
595	R	34.9	Very low	35.9	Very low	203 Å²	203	148.6 Å²	148.6	77%	0.766	80%	0.8	S	S	*	*			trans	85.8	108.3	161.5	-64.1	160.1	-166.3	-105.7	1.6	115.9
596	Q	35.6	Very low	35.6	Very low	178 Å²	178	151.9 Å²	151.9	83%	0.832	80%	0.804	S	S	*	*				74.6	112.7	68.8	-73.6	178.5	-5	0	0	114.2
597	A	35.6	Very low	35.4	Very low	83 Å²	83	145.8 Å²	145.8	69%	0.686	79%	0.793	S	S	*	*				153.8	138.1	103.1	0	0	0	0	0	116.2
598	K	35.9	Very low	35.3	Very low	203 Å²	203	146.3 Å²	146.3	88%	0.883	80%	0.801	S	S	*	*			trans	73.2	111	146.4	-69.1	164.1	-177.3	175.2	0	120.7
599	S	31.2	Very low	35.2	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	80%	0.801	S	S	*	*			trans	-67	164.1	160.7	-5.7	0	0	0	0	113.5
600	R	36.2	Very low	35	Very low	251 Å²	251	145.5 Å²	145.5	95%	0.947	81%	0.806	S	S	*	*			trans	-148.8	124.7	156.1	-113.4	-180	179.8	-178	-1.3	111.6
601	T	30.2	Very low	35.4	Very low	130 Å²	130	142 Å²	142	80%	0.798	79%	0.794	S	S	*	*			trans	-91.2	145.6	177.1	-44.4	0	0	0	0	110.7
602	I	39.6	Very low	35.5	Very low	170 Å²	170	142.7 Å²	142.7	87%	0.872	79%	0.789	S	S	*	*			trans	-134	142.5	161.1	-63.2	-176.6	0	0	0	108.1
603	S	33.4	Very low	35.5	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	79%	0.786	S	S	*	*			trans	-122.7	153.9	-175.2	51.3	0	0	0	0	112.2
604	G	36.7	Very low	35.4	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	79%	0.79	S	S	*	*			trans	167.6	115.4	175.5	0	0	0	0	0	109.6
605	V	38.3	Very low	35.3	Very low	113 Å²	113	138.5 Å²	138.5	69%	0.685	79%	0.786	S	S	*	*			cis	123	120.2	12.4	164.9	0	0	0	0	108.1
606	E	35.9	Very low	35.4	Very low	192 Å²	192	135.4 Å²	135.4	90%	0.897	79%	0.789	S	S	*	*			trans	62.8	149.4	168.1	-68.3	154.8	-146.2	0	0	118.1
607	G	34.1	Very low	35.2	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	79%	0.789	S	S	*	*			cis	163.1	154.8	-9.8	0	0	0	0	0	113.3
608	L	35.2	Very low	35.1	Very low	177 Å²	177	138.9 Å²	138.9	93%	0.927	80%	0.795	S	S	*	*			trans	69	155.1	168.5	-49	177.2	0	0	0	115.7
609	S	35.8	Very low	34.9	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	79%	0.793	S	S	*	*			cis	-158.5	158.6	-5.9	34.6	0	0	0	0	111.8
610	N	28.5	Very low	34.9	Very low	157 Å²	157	137.4 Å²	137.4	84%	0.84	79%	0.793	S	S	*	*			trans	-93.5	175.7	171.8	-99.6	-11	0	0	0	111.4
611	P	43.5	Very low	34.4	Very low	100 Å²	100	137.2 Å²	137.2	65%	0.649	79%	0.792	S	S	*	*			cis	-137.7	-155.4	-27.5	37	-15.6	0	0	0	112.7
612	D	35.6	Very low	34.4	Very low	126 Å²	126	137.5 Å²	137.5	67%	0.674	79%	0.793	S	S	*	*			trans	102.1	133.8	138.3	-105.3	34	0	0	0	124.2
613	Q	36.7	Very low	34.1	Very low	162 Å²	162	134.6 Å²	134.6	76%	0.757	79%	0.788	S	S	*	*			trans	77.6	113.2	148.4	-69.1	171.8	50.4	0	0	124
614	S	35.4	Very low	33.9	Very low	130 Å²	130	135.1 Å²	135.1	91%	0.909	78%	0.782	S	S	*	*			trans	71.9	147.3	149.7	77.1	0	0	0	0	119.5
615	G	33.5	Very low	33.7	Very low	62 Å²	62	142.5 Å²	142.5	64%	0.639	79%	0.79	S	S	*	*			cis	174.2	175.7	-8	0	0	0	0	0	114.8
616	T	36.3	Very low	33.3	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	79%	0.789	S	S	*	*			trans	77	107.2	167.7	66.7	0	0	0	0	121.4
617	H	32.6	Very low	33.1	Very low	178 Å²	178	141.9 Å²	141.9	82%	0.824	79%	0.789	S	S	*	*			trans	41.4	119.9	134.3	-75.3	-100.2	0	0	0	122.5
618	L	32.5	Very low	32.9	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	79%	0.79	S	S	*	*				-168	114.8	112	-105.3	157.8	0	0	0	115.4
619	K	31.9	Very low	32.7	Very low	191 Å²	191	144 Å²	144	83%	0.83	78%	0.784	S	S	*	*			trans	30.5	132.2	152.2	-69.5	176.9	179.3	176.4	0	123.2
620	A	30.5	Very low	32.6	Very low	97 Å²	97	142.6 Å²	142.6	80%	0.802	78%	0.779	S	S	*	*			trans	66.3	107.4	149.3	0	0	0	0	0	117.6
621	R	26.3	Very low	32.7	Very low	247 Å²	247	140.4 Å²	140.4	93%	0.932	78%	0.776	S	S	*	*				76.3	83.2	56.3	-166.1	-169.9	-162.8	177.7	7.6	113.8
622	V	29.7	Very low	32.2	Very low	135 Å²	135	141.3 Å²	141.3	82%	0.818	78%	0.784	S	S	*	*			trans	-171.3	125.9	140.6	142.3	0	0	0	0	108.1
623	S	32.6	Very low	32	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	79%	0.788	S	S	*	*			trans	-174.9	74.9	158.9	58.1	0	0	0	0	108.7
624	N	30.9	Very low	31.9	Very low	121 Å²	121	140.2 Å²	140.2	65%	0.647	79%	0.79	S	S	*	*			trans	-69.7	136.7	170.4	-74.5	30.3	0	0	0	109.2	D626	N624-D626 WeakPolarHBondContact CB-OD2 3.4Å; N624-D626 PolarHBondContact ND2-OD2 2.9Å
625	Y	31.8	Very low	31.7	Very low	227 Å²	227	145.2 Å²	145.2	89%	0.89	79%	0.789	S	S	*	*			trans	-114.5	79.1	151.3	-105	-85.9	0	0	0	107.1	N627	Y625-N627 PolarHBondContact O-N 3.21Å
626	D	30	Very low	31.7	Very low	127 Å²	127	153.2 Å²	153.2	68%	0.679	80%	0.8	S	S	*	*			trans	-75.8	109.8	166.1	-63.3	-64.3	0	0	0	107.4	N624	N624-D626 WeakPolarHBondContact CB-OD2 3.4Å; N624-D626 PolarHBondContact ND2-OD2 2.9Å
627	N	32.1	Very low	31.7	Very low	165 Å²	165	153.8 Å²	153.8	88%	0.882	80%	0.798	S	S	*	*			trans	-115.1	103.9	167.6	-134	21.1	0	0	0	107.5	Y625	Y625-N627 PolarHBondContact O-N 3.21Å
628	A	30.2	Very low	31.7	Very low	83 Å²	83	152.4 Å²	152.4	69%	0.686	80%	0.796	S	S	*	*			trans	-107.4	133.4	-173.4	0	0	0	0	0	110.6
629	Y	31	Very low	32	Very low	201 Å²	201	152.6 Å²	152.6	79%	0.788	80%	0.798	S	S	*	*			trans	-132.3	109.5	153.1	-114.4	-87.7	0	0	0	109.8
630	A	32.6	Very low	32	Very low	83 Å²	83	150.7 Å²	150.7	69%	0.686	80%	0.797	S	S	*	*			trans	-145.6	143.3	178	0	0	0	0	0	109.9
631	S	31.2	Very low	32.4	Very low	110 Å²	110	154.9 Å²	154.9	77%	0.769	80%	0.8	S	S	*	*			trans	62.7	75.3	169.1	65	0	0	0	0	117.8	L633	S631-L633 PolarHBondContact O-N 3.06Å
632	S	32.7	Very low	32.8	Very low	119 Å²	119	150.2 Å²	150.2	83%	0.832	79%	0.786	S	S	*	*			trans	-74.8	81.2	162.6	-58.9	0	0	0	0	111.8
633	L	32.4	Very low	33.2	Very low	144 Å²	144	150.5 Å²	150.5	75%	0.754	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-100.4	138.8	166.4	-80.5	172.9	0	0	0	110.9	S631 R635	S631-L633 PolarHBondContact O-N 3.06Å; L633-R635 PolarHBondContact O-N 3.11Å
634	P	32.9	Very low	33.4	Very low	122 Å²	122	150.6 Å²	150.6	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74.2	125.9	-158.4	27.5	-35.8	0	0	0	113.3
635	R	32.5	Very low	33.8	Very low	234 Å²	234	151.9 Å²	151.9	88%	0.883	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.1	135.5	162	-71.9	-170.7	174.8	-144.3	2	110.1	L633	L633-R635 PolarHBondContact O-N 3.11Å
636	R	32.3	Very low	34	Very low	231 Å²	231	147.1 Å²	147.1	87%	0.872	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-86.6	134.2	158.4	-70.6	171.5	168.9	166.5	-6.1	107.6
637	D	36.1	Very low	34.4	Very low	149 Å²	149	146.7 Å²	146.7	80%	0.797	77%	0.774	S	S	*	*			trans	-128.3	144.5	147.4	-88.7	-60.6	0	0	0	109.3
638	N	34.4	Very low	34.7	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	77%	0.768	S	S	*	*			trans	-90.9	131	178.4	-63.4	-66.3	0	0	0	108.9
639	N	37.2	Very low	35.1	Very low	161 Å²	161	147.6 Å²	147.6	86%	0.861	77%	0.768	S	S	*	*			trans	-133.6	125.7	147.9	-100.3	-41.8	0	0	0	108.9
640	N	33.6	Very low	35.4	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	78%	0.775	S	S	*	*			trans	-142.9	91.9	-172.4	-170	17.6	0	0	0	107.9
641	Q	39	Very low	35.3	Very low	186 Å²	186	153.1 Å²	153.1	87%	0.869	79%	0.787	S	S	*	*			trans	-110.1	117.1	175	-69	-169	3.5	0	0	109.4
642	K	34.1	Very low	35.5	Very low	148 Å²	148	151.2 Å²	151.2	64%	0.643	79%	0.785	S	S	*	*			trans	-86.5	139.1	169.9	-91.8	169	138	-85.2	0	109.8	D644	K642-D644 IonicContact NZ-OD1 2.7Å; K642-D644 PolarHBondContact NZ-OD1 3.15Å; K642-D644 IonicContact NZ-OD2 3.8Å; K642-D644 PolarHBondContact NZ-OD2 3.01Å
643	T	37	Very low	35.6	Very low	142 Å²	142	155 Å²	155	87%	0.871	79%	0.789	S	S	*	*			trans	-126.1	115.6	144.2	42.5	0	0	0	0	107.9
644	D	36.7	Very low	35.7	Very low	112 Å²	112	159.1 Å²	159.1	60%	0.599	80%	0.795	S	S	*	*			trans	-84.3	164.6	175.2	-67.8	-65.4	0	0	0	110.9	K642	K642-D644 IonicContact NZ-OD1 2.7Å; K642-D644 PolarHBondContact NZ-OD1 3.15Å; K642-D644 IonicContact NZ-OD2 3.8Å; K642-D644 PolarHBondContact NZ-OD2 3.01Å
645	L	39.3	Very low	35.9	Very low	147 Å²	147	165.3 Å²	165.3	77%	0.77	80%	0.803	S	S	*	*			trans	175.5	120.4	130.3	-94.2	163.1	0	0	0	112.8
646	N	37.9	Very low	35.9	Very low	128 Å²	128	159.6 Å²	159.6	68%	0.684	80%	0.798	S	S	*	*			trans	51.3	153.1	138.5	-65.9	-2.7	0	0	0	121.3
647	N	37.5	Very low	36.1	Very low	117 Å²	117	154.5 Å²	154.5	63%	0.626	80%	0.798	S	S	*	*			cis	-172.1	162.9	-6.3	-98.6	-18.1	0	0	0	106.5
648	Q	37.9	Very low	36	Very low	159 Å²	159	153.3 Å²	153.3	74%	0.743	80%	0.796	S	S	*	*			cis	-159.7	161.4	-13.7	-89.3	-93.4	-13	0	0	108.2
649	P	38	Very low	36	Very low	108 Å²	108	156.7 Å²	156.7	70%	0.701	80%	0.798	S	S	*	*			trans	-103.1	159.7	-169.6	38.6	-33.2	0	0	0	115.8
650	V	38.2	Very low	35.9	Very low	154 Å²	154	157.4 Å²	157.4	93%	0.933	79%	0.794	S	S	*	*			trans	-131.7	163.7	170.7	-176.3	0	0	0	0	110.6
651	R	31.4	Very low	36	Very low	246 Å²	246	160.4 Å²	160.4	93%	0.928	80%	0.799	S	S	*	*			trans	-140.9	138.2	-151.9	-172.4	-169.3	-163.3	-170.3	8.2	112.9
652	G	34.1	Very low	35.9	Very low	71 Å²	71	160.9 Å²	160.9	73%	0.732	80%	0.798	S	S	*	*			trans	108.7	156	176.9	0	0	0	0	0	112.8
653	E	36	Very low	35.9	Very low	198 Å²	198	159.8 Å²	159.8	93%	0.925	81%	0.806	S	S	*	*			cis	-139.3	-179.8	5.5	-81	-144.2	106.1	0	0	113.1
654	R	33.3	Very low	35.8	Very low	231 Å²	231	160.9 Å²	160.9	87%	0.872	81%	0.805	S	S	*	*			trans	-78.4	151.1	178.8	-56	164.5	171.3	174.4	-4.6	112
655	R	37.3	Very low	35.7	Very low	252 Å²	252	163 Å²	163	95%	0.951	82%	0.816	S	S	*	*				-166.9	149.9	118.6	-103.2	155.2	-162.2	-131.1	3.4	114
656	S	33	Very low	35.1	Very low	113 Å²	113	161.4 Å²	161.4	79%	0.79	82%	0.817	S	S	*	*			trans	-93.1	148.4	-172.7	50.7	0	0	0	0	113.6
657	S	36.8	Very low	34.8	Very low	124 Å²	124	164.4 Å²	164.4	87%	0.867	83%	0.827	S	S	*	*			trans	-149	143.8	152.8	-171.3	0	0	0	0	110.8
658	T	33.2	Very low	34.6	Very low	124 Å²	124	167.7 Å²	167.7	76%	0.761	84%	0.838	S	S	*	*			trans	-126.2	137.4	-174.7	57.1	0	0	0	0	111.1
659	R	35.3	Very low	34.2	Very low	220 Å²	220	169.7 Å²	169.7	83%	0.83	85%	0.845	S	S	*	*			trans	-165.3	133.2	144	-115	170.9	-179.2	-168.2	1	115.9
660	K	35.6	Very low	33.9	Very low	176 Å²	176	169.7 Å²	169.7	77%	0.765	85%	0.845	S	S	*	*			trans	50.1	102.8	146	-70.3	175.2	178	-171	0	119.3
661	K	35.6	Very low	33.4	Very low	213 Å²	213	168 Å²	168	93%	0.926	84%	0.837	S	S	*	*			trans	-64.8	146.5	141.6	-70.8	-177.2	173.6	-176.7	0	110.1
662	K	35.8	Very low	33.2	Very low	195 Å²	195	166.5 Å²	166.5	85%	0.848	83%	0.831	S	S	*	*			trans	-116.1	148.9	148.9	-86.5	-172.5	172.9	-174.7	0	107.5
663	P	33.5	Very low	33	Very low	125 Å²	125	169 Å²	169	81%	0.812	83%	0.828	S	S	*	*			trans	-75.1	147.7	167.4	32.8	-33.1	0	0	0	110.4
664	I	35.4	Very low	32.6	Very low	166 Å²	166	166 Å²	166	85%	0.851	82%	0.819	S	S	*	*			trans	-113	154.9	162.9	-69.3	179	0	0	0	107.2
665	L	34.1	Very low	32.4	Very low	156 Å²	156	160 Å²	160	82%	0.817	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-61.8	159.6	-170.2	-96.3	60	0	0	0	113.8	E667	L665-E667 PolarHBondContact O-N 3.09Å
666	S	28.3	Very low	31.9	Very low	114 Å²	114	159 Å²	159	80%	0.797	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-67.7	117	163.2	51.7	0	0	0	0	110.8
667	E	31.3	Very low	31.7	Very low	190 Å²	190	160 Å²	160	89%	0.888	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-96.7	141.9	155.4	-70.8	-172.2	128.4	0	0	109.6	L665	L665-E667 PolarHBondContact O-N 3.09Å
668	Q	32	Very low	31.4	Very low	186 Å²	186	159.3 Å²	159.3	87%	0.869	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.9	-179.5	-66.4	172.3	-12.7	0	0	108.9	P670	Q668-P670 WeakPolarHBondContact O-CD 3.42Å
669	K	30.4	Very low	31.2	Very low	202 Å²	202	159.6 Å²	159.6	88%	0.878	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.3	124.6	165.2	-92.8	-171.8	171	-175.8	0	108.7
670	P	31.2	Very low	30.9	Very low	108 Å²	108	153.9 Å²	153.9	70%	0.701	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-62.2	157.7	160.7	29.1	-33.6	0	0	0	109.5	Q668	Q668-P670 WeakPolarHBondContact O-CD 3.42Å
671	P	28.2	Very low	31	Very low	119 Å²	119	146.3 Å²	146.3	77%	0.773	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-61.5	156.3	175.6	28.3	-35.2	0	0	0	110.8	N673	P671-N673 PolarHBondContact O-N 3.49Å
672	R	27.3	Very low	31	Very low	214 Å²	214	138.8 Å²	138.8	81%	0.808	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-64.9	122.9	161.2	-73.3	-178.4	172.9	177	-6.1	107.6
673	N	28.6	Very low	30.9	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	67%	0.668	S	S	*	*			trans	-93.8	99.4	163.2	-155.7	47.1	0	0	0	105.4	P671 N675	P671-N673 PolarHBondContact O-N 3.49Å; N673-N675 PolarHBondContact O-N 2.94Å
674	D	28.5	Very low	31.4	Very low	135 Å²	135	124.6 Å²	124.6	72%	0.722	63%	0.632	S	S	*	*			trans	-79.9	49.3	-174.4	-67.2	-44.3	0	0	0	111.3
675	N	28.7	Very low	32	Very low	103 Å²	103	118.1 Å²	118.1	55%	0.551	60%	0.603	S	S	*	*			trans	-102	95.7	165.5	-75.9	20.9	0	0	0	107.7	N673 E677	N673-N675 PolarHBondContact O-N 2.94Å; N675-E677 PolarHBondContact O-N 3.46Å
676	R	27.7	Very low	33	Very low	231 Å²	231	112.1 Å²	112.1	87%	0.872	57%	0.569	S	S	*	*			trans	-83.3	89.2	157.9	-80.8	178.8	167.4	179.2	-8.9	107.6
677	E	27.7	Very low	33.6	Very low	134 Å²	134	107.3 Å²	107.3	63%	0.626	54%	0.536	S	S	*	.			trans	-63	130.5	148.3	-69.7	171.1	144.6	0	0	106	N675 D679	N675-E677 PolarHBondContact O-N 3.46Å; E677-D679 PolarHBondContact O-N 2.88Å
678	T	30.2	Very low	33.8	Very low	111 Å²	111	101.2 Å²	101.2	68%	0.681	51%	0.512	S	S	*	.			trans	-68.8	117.3	170.7	34.1	0	0	0	0	107	I680	T678-I680 PolarHBondContact O-N 3.21Å
679	D	28.8	Very low	33.7	Very low	129 Å²	129	93.4 Å²	93.4	69%	0.69	48%	0.476	S	S	*	.			trans	-66.4	82	170	-83	-47.3	0	0	0	107.9	E677 S681	E677-D679 PolarHBondContact O-N 2.88Å; D679-S681 PolarHBondContact O-N 2.94Å; D679-S681 VanDerWaalsContact O-N 3.11Å
680	I	31.1	Very low	33.6	Very low	101 Å²	101	88.5 Å²	88.5	52%	0.518	47%	0.465	S	S	.	.			trans	-55.1	118	176.3	-64.6	175.8	0	0	0	107.1	T678 N684	T678-I680 PolarHBondContact O-N 3.21Å; I680-N684 HydrophobicContact CG2-CB 3.84Å
681	S	37	Very low	33.4	Very low	17 Å²	17	88 Å²	88	12%	0.119	46%	0.463	C	S	.	.			trans	-51.6	141.1	174.7	-179.3	0	0	0	0	110.6	D679 H683 N684 A685 M774	D679-S681 PolarHBondContact O-N 2.94Å; D679-S681 VanDerWaalsContact O-N 3.11Å; S681-H683 PolarHBondContact O-N 3.33Å; S681-H683 WeakPolarHBondContact OG-CB 3.21Å; S681-H683 PolarHBondContact OG-N 2.99Å; S681-N684 PolarHBondContact O-N 3.26Å; S681-A685 PolarHBondContact O-N 3.09Å; S681-M774 VanDerWaalsContact CB-C 3.48Å; S681-M774 WeakPolarHBondContact CB-O 3.44Å; S681-M774 PolarHBondContact OG-O 3.29Å
682	V	35	Very low	33.4	Very low	55 Å²	55	87.8 Å²	87.8	33%	0.333	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.3	177.5	-173	0	0	0	0	111	D243 I252 Y686	D243-V682 HydrophobicContact CB-CG2 4.35Å; I252-V682 HydrophobicContact CD1-CB 3.72Å; I252-V682 HydrophobicContact CD1-CG1 3.8Å; V682-Y686 HydrophobicContact CG1-CE2 4.18Å; V682-Y686 WeakPolarHBondContact O-CD2 3.49Å
683	H	35	Very low	33.3	Very low	12 Å²	12	84.1 Å²	84.1	6%	0.056	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-62.8	164.7	-168.5	72	0	0	0	111	I252 S256 S681 A685 Y686 I773	I252-H683 HydrophobicContact CG2-CB 4.38Å; S256-H683 PolarHBondContact OG-CE1 2.94Å; S256-H683 PolarHBondContact OG-ND1 3.48Å; S681-H683 PolarHBondContact O-N 3.33Å; S681-H683 WeakPolarHBondContact OG-CB 3.21Å; S681-H683 PolarHBondContact OG-N 2.99Å; H683-A685 PolarHBondContact O-N 2.9Å; H683-Y686 PolarHBondContact O-N 3.07Å; H683-Y686 VanDerWaalsContact O-N 3.12Å; H683-I773 HydrophobicContact CB-CG2 4.16Å; H683-I773 VanDerWaalsContact CD2-CG2 3.44Å; H683-I773 WeakPolarHBondContact CD2-CG2 3.41Å
684	N	43.6	Very low	33.2	Very low	10 Å²	10	86.2 Å²	86.2	5%	0.053	46%	0.458	C	S	.	.	H	α-helix	trans	-61.8	-30.3	-178.2	-58.2	13	0	0	0	112.4	V182 I680 S681 Y686 C687 V688 M774	V182-N684 WeakPolarHBondContact CG1-OD1 3.45Å; V182-N684 HydrophobicContact CG2-CB 4.43Å; I680-N684 HydrophobicContact CG2-CB 3.84Å; S681-N684 PolarHBondContact O-N 3.26Å; N684-Y686 PolarHBondContact O-N 2.75Å; N684-C687 PolarHBondContact O-N 3.2Å; N684-V688 VanDerWaalsContact O-CG2 3.31Å; N684-V688 WeakPolarHBondContact O-CG2 3.5Å; N684-V688 PolarHBondContact O-N 2.72Å; N684-V688 VanDerWaalsContact O-N 3.15Å; N684-M774 PolarHBondContact ND2-OXT 3.41Å; N684-M774 PolarHBondContact OD1-O 2.86Å; N684-M774 VanDerWaalsContact OD1-O 3.11Å
685	A	47	Very low	33	Very low	30 Å²	30	88.1 Å²	88.1	25%	0.248	46%	0.46	C	S	.	.	H	α-helix	trans	-54.6	-24.4	176.4	0	0	0	0	0	114	S681 H683	S681-A685 PolarHBondContact O-N 3.09Å; H683-A685 PolarHBondContact O-N 2.9Å
686	Y	54.7	Low	32.9	Very low	29 Å²	29	91.4 Å²	91.4	11%	0.114	47%	0.472	C	S	.	.	H	α-helix	trans	-101.2	-11.5	174.9	-67.6	-64.1	0	0	0	114.1	P221 E224 M225 D228 V682 H683 N684	P221-Y686 WeakPolarHBondContact CA-O 3.24Å; P221-Y686 WeakPolarHBondContact CB-O 3.31Å; E224-Y686 HydrophobicContact CB-CD1 4.21Å; M225-Y686 HydrophobicContact CB-CD1 3.82Å; M225-Y686 HydrophobicContact CB-CD2 3.9Å; M225-Y686 HydrophobicContact CB-CE1 4.09Å; M225-Y686 HydrophobicContact CB-CE2 4.15Å; M225-Y686 HydrophobicContact CB-CG 3.74Å; M225-Y686 HydrophobicContact CG-CD1 4.47Å; M225-Y686 HydrophobicContact CG-CD2 3.77Å; M225-Y686 HydrophobicContact CG-CE1 4.47Å; M225-Y686 HydrophobicContact CG-CE2 3.74Å; M225-Y686 HydrophobicContact CG-CG 4.16Å; M225-Y686 HydrophobicContact SD-CD2 4.06Å; M225-Y686 HydrophobicContact SD-CE2 4.38Å; D228-Y686 HydrophobicContact CB-CE1 4.35Å; D228-Y686 WeakPolarHBondContact CB-OH 3.34Å; D228-Y686 PolarHBondContact OD2-OH 3.09Å; V682-Y686 HydrophobicContact CG1-CE2 4.18Å; V682-Y686 WeakPolarHBondContact O-CD2 3.49Å; H683-Y686 PolarHBondContact O-N 3.07Å; H683-Y686 VanDerWaalsContact O-N 3.12Å; N684-Y686 PolarHBondContact O-N 2.75Å
687	C	41.3	Very low	32.8	Very low	14 Å²	14	87.5 Å²	87.5	10%	0.095	47%	0.469	C	S	.	.	H	α-helix	trans	-83.4	-16	169.8	-55	0	0	0	0	112.7	L151 V182 N684 L689	L151-C687 HydrophobicContact CD1-CB 4.34Å; V182-C687 PolarHBondContact O-SG 3.28Å; V182-C687 VanDerWaalsContact O-SG 3.4Å; N684-C687 PolarHBondContact O-N 3.2Å; C687-L689 PolarHBondContact O-N 2.68Å; C687-L689 VanDerWaalsContact O-N 3.08Å
688	V	36.3	Very low	32.7	Very low	62 Å²	62	88.8 Å²	88.8	38%	0.376	48%	0.48	S	S	.	.			trans	-79.8	88	-177.2	176.9	0	0	0	0	112.1	L151 N684 P690	L151-V688 HydrophobicContact CD1-CG2 3.82Å; L151-V688 HydrophobicContact CD2-CG2 4.22Å; N684-V688 VanDerWaalsContact O-CG2 3.31Å; N684-V688 WeakPolarHBondContact O-CG2 3.5Å; N684-V688 PolarHBondContact O-N 2.72Å; N684-V688 VanDerWaalsContact O-N 3.15Å; V688-P690 WeakPolarHBondContact O-CD 3.36Å
689	L	30.2	Very low	32.7	Very low	21 Å²	21	92.8 Å²	92.8	11%	0.11	49%	0.491	C	S	.	.			trans	-66.8	127	166.9	-76.3	173	0	0	0	112.2	R147 M180 W217 V220 C687 S691	R147-L689 PolarHBondContact NH1-O 2.91Å; R147-L689 VanDerWaalsContact NH1-O 3.16Å; M180-L689 HydrophobicContact CE-CD1 3.42Å; M180-L689 VanDerWaalsContact CE-CD1 3.42Å; M180-L689 HydrophobicContact CE-CG 4.2Å; W217-L689 HydrophobicContact CE3-CD1 3.63Å; W217-L689 HydrophobicContact CE3-CD2 4.45Å; W217-L689 HydrophobicContact CZ3-CD1 3.64Å; W217-L689 HydrophobicContact CZ3-CD2 4.13Å; W217-L689 HydrophobicContact CZ3-CG 4.49Å; V220-L689 HydrophobicContact CB-CD2 4.03Å; V220-L689 HydrophobicContact CG1-CD2 3.6Å; C687-L689 PolarHBondContact O-N 2.68Å; C687-L689 VanDerWaalsContact O-N 3.08Å; L689-S691 PolarHBondContact O-N 2.84Å; L689-S691 VanDerWaalsContact O-N 3.14Å
690	P	28.4	Very low	32.5	Very low	100 Å²	100	93.9 Å²	93.9	65%	0.649	50%	0.496	S	S	*	.			trans	-66.9	108.7	174	-19.9	32.6	0	0	0	112.4	V688 N692	V688-P690 WeakPolarHBondContact O-CD 3.36Å; P690-N692 VanDerWaalsContact C-N 3.33Å; P690-N692 PolarHBondContact O-N 3.46Å
691	S	27	Very low	32.5	Very low	96 Å²	96	100.9 Å²	100.9	67%	0.671	52%	0.516	S	S	*	.			trans	-68.2	81.5	177.1	-60	0	0	0	0	112.3	R147 L689	R147-S691 PolarHBondContact NH1-OG 3Å; L689-S691 PolarHBondContact O-N 2.84Å; L689-S691 VanDerWaalsContact O-N 3.14Å
692	N	26.3	Very low	32	Very low	115 Å²	115	106.5 Å²	106.5	62%	0.615	54%	0.544	S	S	*	.			trans	-133.6	37.9	-176.7	-146.5	4.7	0	0	0	114.1	P690 Q694	P690-N692 VanDerWaalsContact C-N 3.33Å; P690-N692 PolarHBondContact O-N 3.46Å; N692-Q694 PolarHBondContact O-N 3.36Å
693	N	27.3	Very low	32.1	Very low	138 Å²	138	112 Å²	112	74%	0.738	57%	0.572	S	S	*	*			trans	-78.9	62.1	174.9	-148	-10.8	0	0	0	111.1	F695	N693-F695 PolarHBondContact O-N 3.29Å
694	Q	25.2	Very low	31.8	Very low	168 Å²	168	120 Å²	120	79%	0.785	61%	0.609	S	S	*	*			trans	-73.3	67.7	-179.7	-73.6	-165.9	12.2	0	0	112.7	N692	N692-Q694 PolarHBondContact O-N 3.36Å
695	F	24.1	Very low	31.2	Very low	175 Å²	175	126.5 Å²	126.5	77%	0.768	64%	0.644	S	S	*	*			trans	-101.4	36.2	173.2	-100.8	-70.6	0	0	0	114	N693	N693-F695 PolarHBondContact O-N 3.29Å
696	Q	26.2	Very low	30.6	Very low	171 Å²	171	133.3 Å²	133.3	80%	0.799	67%	0.671	S	S	*	*	S	Bend	trans	-159.6	143.7	158.8	-112.5	140.7	95.7	0	0	115.2
697	N	27.3	Very low	29.6	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	69%	0.694	S	S	*	*			trans	64	96.7	162.3	-61.7	-32.3	0	0	0	119.7	Q699	N697-Q699 PolarHBondContact O-N 3.32Å
698	N	24	Very low	28.9	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	73%	0.725	S	S	*	*			trans	-54.6	126.2	159.8	-67.1	-68.1	0	0	0	112.8
699	Q	30.5	Very low	28.5	Very low	194 Å²	194	147.9 Å²	147.9	91%	0.907	74%	0.74	S	S	*	*			trans	-159.8	141.7	130.9	-116.5	165.9	108.8	0	0	112.1	N697	N697-Q699 PolarHBondContact O-N 3.32Å
700	L	25.6	Very low	28.3	Very low	153 Å²	153	155.6 Å²	155.6	80%	0.801	78%	0.776	S	S	*	*			trans	-82.8	144.5	-172.4	-54.1	93.9	0	0	0	112.3
701	R	30.1	Very low	28.2	Very low	247 Å²	247	158.3 Å²	158.3	93%	0.932	79%	0.785	S	S	*	*				-161.4	140.3	127.9	-108.7	159.8	-168.1	-164.5	0.9	112.2
702	N	26.6	Very low	28.4	Very low	135 Å²	135	160 Å²	160	72%	0.722	79%	0.785	S	S	*	*			trans	-92.6	157.9	170.3	-50.5	-10.5	0	0	0	108.7
703	D	36.5	Very low	28.4	Very low	170 Å²	170	161 Å²	161	91%	0.909	79%	0.789	S	S	*	*				-169	139.1	123.3	-89.9	-27.3	0	0	0	108.9
704	E	29.7	Very low	28.5	Very low	180 Å²	180	160.9 Å²	160.9	84%	0.841	79%	0.788	S	S	*	*			trans	-97.6	158.5	-179.5	-59.7	-178.6	121.4	0	0	111.6
705	N	31.7	Very low	28.7	Very low	148 Å²	148	159.9 Å²	159.9	79%	0.791	78%	0.777	S	S	*	*				-179.9	153.7	126.1	-105.7	-75.8	0	0	0	116
706	H	33.8	Very low	28.6	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.796	78%	0.78	S	S	*	*			trans	77.3	153.1	157.9	-87.7	-19	0	0	0	121.1
707	P	33	Very low	28.8	Very low	92 Å²	92	153.6 Å²	153.6	60%	0.597	77%	0.771	S	S	*	*			trans	-142.3	-158	-133.4	43.8	-21.8	0	0	0	115.6
708	D	27.5	Very low	28.7	Very low	142 Å²	142	153.9 Å²	153.9	76%	0.759	77%	0.773	S	S	*	*			trans	67.1	72.4	159.6	-67.6	-16.4	0	0	0	118.8
709	Y	28.4	Very low	28.9	Very low	177 Å²	177	152.1 Å²	152.1	69%	0.694	76%	0.762	S	S	*	*			trans	-128.2	129.9	144.6	-83.3	-83.2	0	0	0	111.6
710	Q	26	Very low	28.7	Very low	184 Å²	184	149.2 Å²	149.2	86%	0.86	75%	0.752	S	S	*	*			trans	-110.9	98.6	173.7	-71.1	-177.1	-6.1	0	0	109.7
711	N	25.9	Very low	28.8	Very low	157 Å²	157	152.2 Å²	152.2	84%	0.84	75%	0.753	S	S	*	*			trans	-175.5	160.4	147.4	-98	-45.9	0	0	0	110.9
712	I	30.2	Very low	28.7	Very low	132 Å²	132	147 Å²	147	68%	0.677	74%	0.744	S	S	*	*	S	Bend	trans	65.9	132	-175.2	-50	178.1	0	0	0	112.8	L714	I712-L714 HydrophobicContact CG2-CG 4.19Å; I712-L714 PolarHBondContact O-N 3.25Å
713	I	27.2	Very low	28.8	Very low	136 Å²	136	147.6 Å²	147.6	70%	0.697	75%	0.747	S	S	*	*			trans	-94.9	70.6	-178	-51.9	177.4	0	0	0	108.7
714	L	29.6	Very low	28.5	Very low	134 Å²	134	145.3 Å²	145.3	70%	0.702	74%	0.739	S	S	*	*			trans	-81.9	126.2	163.5	-70.7	176.9	0	0	0	108.7	I712	I712-L714 HydrophobicContact CG2-CG 4.19Å; I712-L714 PolarHBondContact O-N 3.25Å
715	R	27.9	Very low	28.6	Very low	148 Å²	148	145.7 Å²	145.7	56%	0.558	74%	0.738	S	S	*	*			trans	-81.6	125.4	-171.8	-75.3	172.9	150.2	-177.6	-6.6	111.6	D228 P717	D228-R715 WeakPolarHBondContact OD1-CD 3.34Å; D228-R715 IonicContact OD1-CZ 3.52Å; D228-R715 IonicContact OD1-NE 2.99Å; D228-R715 IonicContact OD1-NH1 3.61Å; D228-R715 PolarHBondContact OD1-NH1 3.3Å; R715-P717 VanDerWaalsContact C-CD 3.45Å; R715-P717 WeakPolarHBondContact O-CD 3.17Å
716	S	23	Very low	28.6	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	74%	0.741	S	S	*	*			trans	-97.7	89.1	153.6	-68.7	0	0	0	0	110	N718	S716-N718 PolarHBondContact O-N 3.3Å
717	P	29.8	Very low	28.5	Very low	94 Å²	94	146.9 Å²	146.9	61%	0.61	74%	0.744	S	S	*	*			trans	-79.6	85.5	173.8	33.9	-34	0	0	0	109.7	R715 I719	R715-P717 VanDerWaalsContact C-CD 3.45Å; R715-P717 WeakPolarHBondContact O-CD 3.17Å; P717-I719 HydrophobicContact CB-CD1 4.17Å; P717-I719 HydrophobicContact CB-CG1 4.18Å; P717-I719 PolarHBondContact O-N 3Å
718	N	24.8	Very low	28.3	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	75%	0.746	S	S	*	*			trans	-71.7	72.8	176.2	-167.1	-13.3	0	0	0	111.2	S716 N720	S716-N718 PolarHBondContact O-N 3.3Å; N718-N720 PolarHBondContact O-N 3.07Å
719	I	28.6	Very low	28.5	Very low	123 Å²	123	152.2 Å²	152.2	63%	0.631	75%	0.753	S	S	*	*			trans	-87.7	86.6	-176.7	-59.8	176.4	0	0	0	109.4	P717 R721	P717-I719 HydrophobicContact CB-CD1 4.17Å; P717-I719 HydrophobicContact CB-CG1 4.18Å; P717-I719 PolarHBondContact O-N 3Å; I719-R721 HydrophobicContact CG2-CB 4.2Å; I719-R721 HydrophobicContact CG2-CG 3.82Å; I719-R721 PolarHBondContact O-N 3.28Å
720	N	27	Very low	28.8	Very low	133 Å²	133	149.7 Å²	149.7	71%	0.711	76%	0.761	S	S	*	*			trans	-69.3	97.6	164.9	-175.6	-7.8	0	0	0	109.8	N718	N718-N720 PolarHBondContact O-N 3.07Å
721	R	28.3	Very low	29	Very low	217 Å²	217	151.8 Å²	151.8	82%	0.819	76%	0.761	S	S	*	*			trans	-131.2	90.3	171.7	-82.1	-171.7	172.7	177.9	-0.8	112	I719	I719-R721 HydrophobicContact CG2-CB 4.2Å; I719-R721 HydrophobicContact CG2-CG 3.82Å; I719-R721 PolarHBondContact O-N 3.28Å
722	N	27.5	Very low	29.5	Very low	138 Å²	138	151.6 Å²	151.6	74%	0.738	76%	0.759	S	S	*	*			trans	-68.5	162.6	147.9	-71.3	-79.9	0	0	0	109.9
723	D	28.6	Very low	29.6	Very low	146 Å²	146	150.1 Å²	150.1	78%	0.781	76%	0.756	S	S	*	*			trans	65.7	130.4	-170.3	-59.2	-50.8	0	0	0	113.4
724	V	31	Very low	29.7	Very low	123 Å²	123	149.6 Å²	149.6	75%	0.745	77%	0.765	S	S	*	*			cis	-142.7	123.3	40	168.2	0	0	0	0	113.4
725	K	31.7	Very low	29.8	Very low	187 Å²	187	147 Å²	147	81%	0.813	77%	0.77	S	S	*	*			trans	40.9	119.9	144	-58.5	174.7	-175.7	171.6	0	120.8
726	Q	30.1	Very low	29.9	Very low	184 Å²	184	149.6 Å²	149.6	86%	0.86	79%	0.788	S	S	*	*			trans	-39.4	146.4	145.7	-58.8	168.7	-15.2	0	0	112.9
727	N	32	Very low	30.4	Very low	161 Å²	161	153.2 Å²	153.2	86%	0.861	79%	0.792	S	S	*	*			trans	-134.8	145.1	152.4	-159.6	5.4	0	0	0	110.2
728	T	29.3	Very low	30.5	Very low	103 Å²	103	154.4 Å²	154.4	63%	0.632	80%	0.802	S	S	*	*			trans	-129.6	146.2	-170.6	62.3	0	0	0	0	112.2
729	R	31.5	Very low	30.7	Very low	244 Å²	244	150.9 Å²	150.9	92%	0.921	80%	0.803	S	S	*	*			trans	61.8	126.2	167.4	-64	174.6	165.8	179.7	-3.3	117.7
730	S	35.7	Very low	30.8	Very low	123 Å²	123	150 Å²	150	86%	0.86	81%	0.808	S	S	*	*				-149.3	164	107.8	51.9	0	0	0	0	110.4
731	R	28.4	Very low	31	Very low	228 Å²	228	147 Å²	147	86%	0.86	81%	0.808	S	S	*	*			trans	-130.9	113.6	-171.1	172.4	-159.8	-78	-178.8	-7.6	109.6
732	I	38.1	Very low	31.4	Very low	153 Å²	153	145.7 Å²	145.7	79%	0.785	81%	0.812	S	S	*	*			trans	-142.1	83.6	170.3	-57.3	-178.1	0	0	0	106.3
733	T	32.4	Very low	31.8	Very low	102 Å²	102	143.5 Å²	143.5	63%	0.626	80%	0.803	S	S	*	*				62.7	106.5	95.5	62	0	0	0	0	115.8
734	S	29.2	Very low	32.2	Very low	125 Å²	125	138 Å²	138	87%	0.874	78%	0.775	S	S	*	*			trans	57	98.8	147	59.6	0	0	0	0	119.7
735	G	31.6	Very low	32.3	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	77%	0.77	S	S	*	*			trans	-144.4	111.8	149.1	0	0	0	0	0	109
736	Q	28.8	Very low	32.3	Very low	204 Å²	204	134.5 Å²	134.5	95%	0.953	77%	0.769	S	S	*	*			trans	-82.3	117.4	179.9	-69.3	176	-83.4	0	0	110.6
737	Q	32.9	Very low	32.1	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	76%	0.763	S	S	*	*			trans	-137.9	142.1	152.3	-100.8	169.4	16.1	0	0	109.2
738	S	33.5	Very low	31.9	Very low	118 Å²	118	125.8 Å²	125.8	83%	0.825	74%	0.739	S	S	*	*			trans	-76.5	125.7	-172.6	47.2	0	0	0	0	111.3	S740	S738-S740 PolarHBondContact O-N 3.05Å
739	G	27.4	Very low	31.9	Very low	83 Å²	83	126.4 Å²	126.4	86%	0.856	75%	0.747	S	S	*	*			trans	-67.6	114.6	177.9	0	0	0	0	0	112.8
740	S	30.8	Very low	31.6	Very low	105 Å²	105	122.7 Å²	122.7	73%	0.734	75%	0.745	S	S	*	*			trans	-83.3	115.1	148.4	55.5	0	0	0	0	107.2	S738 Q742	S738-S740 PolarHBondContact O-N 3.05Å; S740-Q742 PolarHBondContact O-N 3.01Å
741	G	31.3	Very low	31.2	Very low	69 Å²	69	120 Å²	120	71%	0.711	73%	0.725	S	S	*	*			trans	-60	126.6	166.1	0	0	0	0	0	109	V743	G741-V743 VanDerWaalsContact C-N 3.31Å; G741-V743 PolarHBondContact O-N 3.27Å; G741-V743 VanDerWaalsContact O-N 3.1Å
742	Q	37.4	Very low	31.5	Very low	191 Å²	191	112 Å²	112	89%	0.893	69%	0.694	S	S	*	*			trans	-73.5	96.5	161.6	-76	175.8	-109.6	0	0	106.2	S740	S740-Q742 PolarHBondContact O-N 3.01Å
743	V	35	Very low	31.3	Very low	92 Å²	92	111.5 Å²	111.5	56%	0.558	68%	0.683	S	S	*	*			trans	-52.7	140.4	163.6	-176.6	0	0	0	0	107.5	G741 H745	G741-V743 VanDerWaalsContact C-N 3.31Å; G741-V743 PolarHBondContact O-N 3.27Å; G741-V743 VanDerWaalsContact O-N 3.1Å; V743-H745 VanDerWaalsContact C-N 3.29Å; V743-H745 PolarHBondContact O-N 2.92Å
744	V	38.2	Very low	31.1	Very low	31 Å²	31	115.3 Å²	115.3	19%	0.188	69%	0.693	C	S	.	*			trans	-56.7	96.3	164.4	-82.8	0	0	0	0	108.9	E201	E201-V744 HydrophobicContact CB-CG2 4.34Å
745	H	32.1	Very low	31.1	Very low	139 Å²	139	115.3 Å²	115.3	64%	0.644	68%	0.683	S	S	*	*			trans	-89.4	130.9	178.3	-121	-73.8	0	0	0	107.4	V743 T747	V743-H745 VanDerWaalsContact C-N 3.29Å; V743-H745 PolarHBondContact O-N 2.92Å; H745-T747 PolarHBondContact O-N 2.66Å
746	A	31.7	Very low	31	Very low	96 Å²	96	117.1 Å²	117.1	79%	0.793	67%	0.673	S	S	*	*	S	Bend	trans	-66.9	68.3	178.2	0	0	0	0	0	112.5
747	T	27.1	Very low	30.9	Very low	120 Å²	120	114.6 Å²	114.6	74%	0.736	67%	0.666	S	S	*	*			trans	-143.7	31	176.4	62.8	0	0	0	0	110.4	H745	H745-T747 PolarHBondContact O-N 2.66Å
748	A	28.4	Very low	30.8	Very low	43 Å²	43	115.4 Å²	115.4	36%	0.355	66%	0.662	S	S	.	*	S	Bend	trans	-72.5	159.1	158	0	0	0	0	0	109.2
749	S	28	Very low	30.6	Very low	115 Å²	115	112.4 Å²	112.4	80%	0.804	65%	0.649	S	S	*	*			trans	-64.3	138.1	-178	-161.8	0	0	0	0	110.6	P751	S749-P751 WeakPolarHBondContact O-CD 3.43Å
750	L	26	Very low	30.7	Very low	167 Å²	167	115 Å²	115	87%	0.874	64%	0.644	S	S	*	*			trans	-41.5	109.3	-175.5	-80	165.9	0	0	0	112.3
751	P	27.2	Very low	30.9	Very low	67 Å²	67	117.5 Å²	117.5	44%	0.435	65%	0.649	S	S	.	*			trans	-65.6	167.1	171.6	-21.1	35.1	0	0	0	111.2	S749 R753	S749-P751 WeakPolarHBondContact O-CD 3.43Å; P751-R753 PolarHBondContact O-N 3.28Å
752	R	35.2	Very low	31	Very low	58 Å²	58	123.1 Å²	123.1	22%	0.219	66%	0.662	C	S	.	*	S	Bend	trans	-70.4	122	-164.9	-66.6	163.7	132.6	-90.7	-43.6	111.5	A255 S256	A255-R752 PolarHBondContact O-NH1 3.01Å; A255-R752 PolarHBondContact O-NH2 2.84Å; S256-R752 VanDerWaalsContact C-CZ 3.45Å; S256-R752 PolarHBondContact O-NE 3.49Å; S256-R752 PolarHBondContact O-NH2 3.06Å; S256-R752 VanDerWaalsContact O-NH2 3.07Å
753	R	33.3	Very low	30.6	Very low	143 Å²	143	116.8 Å²	116.8	54%	0.54	65%	0.648	S	S	.	*			trans	79.3	126.1	174.1	-57	167.1	146	167.4	-12.4	115.4	D183 W289 P751	D183-R753 IonicContact OD1-CZ 3.07Å; D183-R753 IonicContact OD1-NH1 2.73Å; D183-R753 PolarHBondContact OD1-NH1 2.89Å; W289-R753 VanDerWaalsContact CH2-CZ 3.46Å; W289-R753 VanDerWaalsContact CZ3-CZ 3.42Å; P751-R753 PolarHBondContact O-N 3.28Å
754	E	28.1	Very low	30.5	Very low	183 Å²	183	118 Å²	118	86%	0.855	66%	0.661	S	S	*	*			trans	-62.1	155.1	156.2	-68.7	-154.8	134.8	0	0	110.7	I756	E754-I756 PolarHBondContact O-N 3.28Å; E754-I756 VanDerWaalsContact O-N 3.14Å
755	L	28.6	Very low	30.1	Very low	124 Å²	124	127.5 Å²	127.5	65%	0.649	69%	0.693	S	S	*	*			trans	-62.5	116.3	179.1	-69.6	114.4	0	0	0	111.6	M192 N757	M192-L755 HydrophobicContact CE-CD1 4.37Å; M192-L755 HydrophobicContact SD-CD1 3.59Å; M192-L755 VanDerWaalsContact SD-CD1 3.59Å; M192-L755 HydrophobicContact SD-CD2 3.53Å; M192-L755 VanDerWaalsContact SD-CD2 3.53Å; M192-L755 HydrophobicContact SD-CG 4.22Å; L755-N757 VanDerWaalsContact C-N 3.34Å; L755-N757 PolarHBondContact O-N 3.26Å
756	I	29.5	Very low	30.3	Very low	116 Å²	116	126.3 Å²	126.3	60%	0.595	70%	0.698	S	S	*	*			trans	-61.7	100.8	159	-61.8	177.4	0	0	0	107.1	E754 Y758	E754-I756 PolarHBondContact O-N 3.28Å; E754-I756 VanDerWaalsContact O-N 3.14Å; I756-Y758 HydrophobicContact CB-CE2 4.23Å; I756-Y758 HydrophobicContact CG2-CD2 4.21Å; I756-Y758 HydrophobicContact CG2-CE2 3.94Å; I756-Y758 VanDerWaalsContact O-CD2 3.3Å; I756-Y758 WeakPolarHBondContact O-CD2 3.19Å; I756-Y758 PolarHBondContact O-N 2.73Å
757	N	27.6	Very low	30	Very low	151 Å²	151	127 Å²	127	81%	0.807	70%	0.696	S	S	*	*			trans	-63.2	99.2	173.2	-98	-54.4	0	0	0	109.2	L755 G759	L755-N757 VanDerWaalsContact C-N 3.34Å; L755-N757 PolarHBondContact O-N 3.26Å; N757-G759 PolarHBondContact O-N 3.37Å
758	Y	30.2	Very low	29.9	Very low	213 Å²	213	124.4 Å²	124.4	84%	0.835	69%	0.694	S	S	*	*			trans	-72.5	63	169.4	-77.5	-81.8	0	0	0	110.8	I756	I756-Y758 HydrophobicContact CB-CE2 4.23Å; I756-Y758 HydrophobicContact CG2-CD2 4.21Å; I756-Y758 HydrophobicContact CG2-CE2 3.94Å; I756-Y758 VanDerWaalsContact O-CD2 3.3Å; I756-Y758 WeakPolarHBondContact O-CD2 3.19Å; I756-Y758 PolarHBondContact O-N 2.73Å
759	G	29.8	Very low	29.8	Very low	54 Å²	54	129.5 Å²	129.5	56%	0.557	71%	0.708	S	S	*	*			trans	-110.3	92.5	-177.6	0	0	0	0	0	113.1	N757 D761	N757-G759 PolarHBondContact O-N 3.37Å; G759-D761 VanDerWaalsContact C-N 3.26Å; G759-D761 PolarHBondContact O-N 2.58Å
760	D	30.1	Very low	29.7	Very low	138 Å²	138	128.1 Å²	128.1	74%	0.738	70%	0.698	S	S	*	*			trans	50.7	-9.6	153.9	-74.3	-16	0	0	0	122.7	L762	D760-L762 PolarHBondContact O-N 3.1Å
761	D	35	Very low	29.7	Very low	158 Å²	158	123.8 Å²	123.8	85%	0.845	68%	0.68	S	S	*	*			trans	-81.9	75.8	-172.1	-115.3	-28.5	0	0	0	114.4	G759 G763	G759-D761 VanDerWaalsContact C-N 3.26Å; G759-D761 PolarHBondContact O-N 2.58Å; D761-G763 PolarHBondContact O-N 3.35Å
762	L	31.8	Very low	29.5	Very low	186 Å²	186	127.9 Å²	127.9	97%	0.974	70%	0.697	S	S	*	*			trans	-72.6	59.8	169.6	-73.4	172.3	0	0	0	112	D760	D760-L762 PolarHBondContact O-N 3.1Å
763	G	29.4	Very low	29.4	Very low	59 Å²	59	127.7 Å²	127.7	61%	0.608	70%	0.7	S	S	*	*			trans	-133.3	63.8	-161.7	0	0	0	0	0	117.8	D761	D761-G763 PolarHBondContact O-N 3.35Å
764	S	32.5	Very low	29.1	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	70%	0.695	S	S	*	*			trans	70.5	97	163.7	-166.1	0	0	0	0	120
765	R	30.8	Very low	29.1	Very low	230 Å²	230	122.3 Å²	122.3	87%	0.868	69%	0.687	S	S	*	*			trans	-10.7	153.3	137.4	-96.7	-173.7	171.5	-153.7	-3.9	118.1
766	P	35.3	Very low	29.1	Very low	114 Å²	114	122.2 Å²	122.2	74%	0.74	69%	0.689	S	S	*	*				-150	162.1	53.2	42	-22.6	0	0	0	121.2
767	S	25.8	Very low	29.1	Very low	109 Å²	109	122.5 Å²	122.5	76%	0.762	69%	0.694	S	S	*	*			trans	58.7	84.6	150	53.8	0	0	0	0	120.8
768	G	26	Very low	29.2	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	69%	0.688	S	S	*	*			trans	-178.8	121.1	162.2	0	0	0	0	0	105.2
769	K	26.1	Very low	29.1	Very low	149 Å²	149	115.1 Å²	115.1	65%	0.648	68%	0.678	S	S	*	*			cis	72.5	12.9	28.3	-95.3	-150.8	171.5	-145.4	0	116.3	D278	D278-K769 IonicContact OD1-NZ 3.75Å; D278-K769 PolarHBondContact OD1-NZ 3.14Å
770	C	25.4	Very low	29.1	Very low	87 Å²	87	119.1 Å²	119.1	59%	0.588	69%	0.687	S	S	*	*			trans	-61.9	133.6	142.8	-75.5	0	0	0	0	108.6
771	C	26.5	Very low	29	Very low	75 Å²	75	117.8 Å²	117.8	51%	0.507	68%	0.683	S	S	.	*			trans	-69.7	132.3	176.5	-65.6	0	0	0	0	109.4	I773	C771-I773 PolarHBondContact O-N 3.46Å; C771-I773 VanDerWaalsContact O-N 3.07Å
772	I	23.3	Very low	28.6	Very low	154 Å²	154	114.7 Å²	114.7	79%	0.79	67%	0.67	S	S	*	*			trans	-61.5	110	152.5	-62	171.8	0	0	0	104.3	M774	I772-M774 PolarHBondContact O-N 3.17Å
773	I	31.5	Very low	28.3	Very low	54 Å²	54	108.8 Å²	108.8	28%	0.277	65%	0.645	S	S	.	*			trans	-66.8	119.4	160.8	-67.3	-168.8	0	0	0	104.8	A255 W289 H683 C771	A255-I773 HydrophobicContact CB-CD1 3.75Å; W289-I773 HydrophobicContact CH2-CB 4.41Å; W289-I773 HydrophobicContact CH2-CD1 3.91Å; W289-I773 HydrophobicContact CH2-CG1 4.33Å; W289-I773 HydrophobicContact CZ2-CB 4.24Å; W289-I773 HydrophobicContact CZ2-CD1 3.31Å; W289-I773 HydrophobicContact CZ2-CG1 3.71Å; H683-I773 HydrophobicContact CB-CG2 4.16Å; H683-I773 VanDerWaalsContact CD2-CG2 3.44Å; H683-I773 WeakPolarHBondContact CD2-CG2 3.41Å; C771-I773 PolarHBondContact O-N 3.46Å; C771-I773 VanDerWaalsContact O-N 3.07Å
774	M	27.1	Very low	28.2	Very low	89 Å²	89	113.3 Å²	113.3	44%	0.438	65%	0.649	S	S	.	*			trans	-83	0	174.9	-27.8	175.2	-42.9	0	0	109.6	S681 N684 I772	S681-M774 VanDerWaalsContact CB-C 3.48Å; S681-M774 WeakPolarHBondContact CB-O 3.44Å; S681-M774 PolarHBondContact OG-O 3.29Å; N684-M774 PolarHBondContact ND2-OXT 3.41Å; N684-M774 PolarHBondContact OD1-O 2.86Å; N684-M774 VanDerWaalsContact OD1-O 3.11Å; I772-M774 PolarHBondContact O-N 3.17Å

Retrieved 774 of 774 residues in 105.2 ms (Link to these results)

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